A0A087Y9I6_POEFO Loading...

Centrosomal protein of 97 kDa

Acts as a key negative regulator of ciliogenesis in collaboration with CCP110 by capping the mother centriole thereby preventing cilia formation. Required for recruitment of CCP110 to the centrosome.

AlphaFold DB , UniProt , Accession A0A087Y9I6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 758 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	31	Very low	33.3	Very low	150 Å²	150	103.5 Å²	103.5	74%	0.739	59%	0.588	S	S	*	*				0	150.9	0	-69.4	176.7	-179.1	0	0	109.1
2	G	26.1	Very low	34.4	Very low	22 Å²	22	103.1 Å²	103.1	23%	0.227	61%	0.607	C	S	.	*			trans	-69.2	150.3	167.4	0	0	0	0	0	112.2	S4 D5	G2-S4 PolarHBondContact O-N 3.29Å; G2-D5 PolarHBondContact O-N 3.02Å
3	V	37.5	Very low	36.1	Very low	64 Å²	64	100.5 Å²	100.5	39%	0.388	59%	0.593	S	S	.	*	G	3₁₀ helix	trans	-69.8	2.7	-175.4	-163.9	0	0	0	0	113.1	D5 N84	V3-D5 VanDerWaalsContact C-N 3.29Å; V3-D5 PolarHBondContact O-N 2.72Å; V3-N84 WeakPolarHBondContact CG1-ND2 3.2Å; V3-N84 WeakPolarHBondContact CG2-ND2 3.37Å
4	S	31.5	Very low	38.8	Very low	95 Å²	95	97.2 Å²	97.2	66%	0.664	58%	0.576	S	S	*	*	G	3₁₀ helix	trans	-67	-28.1	171.7	50.4	0	0	0	0	113.6	G2 V6	G2-S4 PolarHBondContact O-N 3.29Å; S4-V6 VanDerWaalsContact C-N 3.35Å; S4-V6 PolarHBondContact O-N 3.04Å
5	D	31.9	Very low	41.7	Very low	72 Å²	72	95.6 Å²	95.6	39%	0.385	57%	0.567	S	S	.	*	G	3₁₀ helix	trans	-97.9	18.9	-164.1	-67.8	18.7	0	0	0	113.1	G2 V3 K7 N362	G2-D5 PolarHBondContact O-N 3.02Å; V3-D5 VanDerWaalsContact C-N 3.29Å; V3-D5 PolarHBondContact O-N 2.72Å; D5-K7 PolarHBondContact O-N 2.95Å; D5-N362 PolarHBondContact OD2-ND2 3.16Å
6	V	37.1	Very low	44.3	Very low	76 Å²	76	92.1 Å²	92.1	46%	0.461	55%	0.547	S	S	.	.			trans	-67.1	98.5	162.9	-177.4	0	0	0	0	107.7	S4 C8	S4-V6 VanDerWaalsContact C-N 3.35Å; S4-V6 PolarHBondContact O-N 3.04Å; V6-C8 PolarHBondContact O-N 2.84Å
7	K	31.9	Very low	46.6	Very low	156 Å²	156	91.3 Å²	91.3	68%	0.678	54%	0.539	S	S	*	.			trans	-65.2	87.4	166.8	-80.5	179.1	177.1	169.2	0	109.1	D5 D9	D5-K7 PolarHBondContact O-N 2.95Å; K7-D9 VanDerWaalsContact C-N 3.32Å; K7-D9 PolarHBondContact O-N 3.16Å
8	C	33.5	Very low	48.6	Very low	88 Å²	88	87.4 Å²	87.4	60%	0.595	52%	0.515	S	S	*	.			trans	-63.6	94.4	164.8	-68.4	0	0	0	0	108.6	V6 T10	V6-C8 PolarHBondContact O-N 2.84Å; C8-T10 PolarHBondContact O-N 2.67Å
9	D	32.7	Very low	50.5	Low	137 Å²	137	84.7 Å²	84.7	73%	0.733	50%	0.502	S	S	*	.			trans	-49.8	127.7	167.8	-84.4	-38.6	0	0	0	109.1	K7 N11	K7-D9 VanDerWaalsContact C-N 3.32Å; K7-D9 PolarHBondContact O-N 3.16Å; D9-N11 PolarHBondContact O-N 2.92Å
10	T	34.2	Very low	52.2	Low	142 Å²	142	83.8 Å²	83.8	87%	0.871	50%	0.504	S	S	*	.	S	Bend	trans	-80.2	49.3	-164.2	56.5	0	0	0	0	113.2	C8	C8-T10 PolarHBondContact O-N 2.67Å
11	N	38.9	Very low	53.7	Low	136 Å²	136	87.1 Å²	87.1	73%	0.727	51%	0.507	S	S	*	.	S	Bend	trans	-115.8	62.3	178.3	-79.2	-32	0	0	0	111	D9 V13	D9-N11 PolarHBondContact O-N 2.92Å; N11-V13 VanDerWaalsContact C-N 3.25Å; N11-V13 PolarHBondContact O-N 2.91Å
12	A	46.9	Very low	56.1	Low	99 Å²	99	83.7 Å²	83.7	82%	0.818	50%	0.498	S	S	*	.			trans	38	41.8	161.2	0	0	0	0	0	117.6	P14	A12-P14 WeakPolarHBondContact O-CD 3.32Å
13	V	56.2	Low	58.7	Low	70 Å²	70	84.7 Å²	84.7	42%	0.424	50%	0.497	S	S	.	.			trans	-65.9	126.2	172.1	-174.7	0	0	0	0	108.4	N11 V15 H37	N11-V13 VanDerWaalsContact C-N 3.25Å; N11-V13 PolarHBondContact O-N 2.91Å; V13-V15 PolarHBondContact O-N 2.87Å; V13-H37 HydrophobicContact CG1-CB 3.66Å
14	P	74	Confident	60.8	Low	54 Å²	54	87.6 Å²	87.6	35%	0.351	51%	0.507	S	S	.	.			trans	-71.5	100.4	178.9	-22.8	36.8	0	0	0	111.2	A12 D35 H37	A12-P14 WeakPolarHBondContact O-CD 3.32Å; P14-D35 HydrophobicContact CB-CB 4.4Å; P14-D35 VanDerWaalsContact CB-O 3.31Å; P14-D35 WeakPolarHBondContact CB-O 3.42Å; P14-D35 VanDerWaalsContact CD-O 3.27Å; P14-D35 WeakPolarHBondContact CD-O 3.4Å; P14-D35 HydrophobicContact CG-CB 3.84Å; P14-D35 WeakPolarHBondContact CG-O 3.3Å; P14-H37 PolarHBondContact O-N 2.97Å
15	V	81.8	Confident	63.1	Low	73 Å²	73	89.3 Å²	89.3	44%	0.442	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	130.8	175.8	-176.9	0	0	0	0	109.9	V13 T38 I40	V13-V15 PolarHBondContact O-N 2.87Å; V15-T38 WeakPolarHBondContact CA-O 3.3Å; V15-T38 HydrophobicContact CG1-CG2 4.01Å; V15-T38 HydrophobicContact CG2-CG2 4.17Å; V15-I40 HydrophobicContact CG1-CD1 3.85Å; V15-I40 HydrophobicContact CG1-CG1 4.27Å
16	V	83.2	Confident	65.2	Low	40 Å²	40	86.2 Å²	86.2	24%	0.242	49%	0.486	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	112.1	167.2	173.1	0	0	0	0	109.2	L18 F30 T36 T38 L39 I40	V16-L18 HydrophobicContact CG1-CD1 4.47Å; V16-L18 HydrophobicContact CG1-CD2 4.07Å; V16-L18 HydrophobicContact CG1-CG 4.03Å; V16-F30 HydrophobicContact CG1-CE2 4.24Å; V16-F30 HydrophobicContact CG1-CZ 4.01Å; V16-T36 HydrophobicContact CB-CG2 3.99Å; V16-T36 HydrophobicContact CG2-CG2 3.53Å; V16-T38 PolarHBondContact N-O 2.77Å; V16-L39 HydrophobicContact CB-CD1 4.2Å; V16-L39 HydrophobicContact CG1-CD1 4.02Å; V16-L39 WeakPolarHBondContact O-CA 3.36Å; V16-I40 PolarHBondContact O-N 3.42Å
17	D	84.4	Confident	66.8	Low	78 Å²	78	88.1 Å²	88.1	42%	0.417	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	114	178.9	-178	10.4	0	0	0	111.7	S19 R21 I40	D17-S19 WeakPolarHBondContact OD1-CB 3.3Å; D17-S19 PolarHBondContact OD1-N 3.39Å; D17-S19 PolarHBondContact OD1-OG 3.08Å; D17-S19 PolarHBondContact OD2-OG 3.36Å; D17-R21 PolarHBondContact O-NH2 3.09Å; D17-I40 HydrophobicContact CB-CB 4.46Å
18	L	81.9	Confident	68.3	Low	21 Å²	21	85.2 Å²	85.2	11%	0.11	49%	0.49	C	S	.	.			trans	-116.7	19.9	174.7	-48.2	176.8	0	0	0	112	V16 R21 M23 F30 L39 I40 L41 N44	V16-L18 HydrophobicContact CG1-CD1 4.47Å; V16-L18 HydrophobicContact CG1-CD2 4.07Å; V16-L18 HydrophobicContact CG1-CG 4.03Å; L18-R21 WeakPolarHBondContact O-CG 3.33Å; L18-M23 HydrophobicContact CB-CE 3.61Å; L18-M23 HydrophobicContact CB-SD 4.44Å; L18-M23 HydrophobicContact CD1-CE 4.21Å; L18-F30 HydrophobicContact CD1-CD2 4.33Å; L18-F30 HydrophobicContact CD1-CE2 3.8Å; L18-F30 HydrophobicContact CD1-CZ 4.08Å; L18-L39 HydrophobicContact CD1-CD1 4.36Å; L18-I40 PolarHBondContact N-O 3.14Å; L18-L41 HydrophobicContact CB-CD2 4.1Å; L18-L41 HydrophobicContact CD1-CD2 3.99Å; L18-N44 PolarHBondContact O-ND2 3.42Å
19	S	85.6	Confident	69.5	Low	37 Å²	37	85.9 Å²	85.9	26%	0.259	50%	0.496	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	155.7	-179.1	65.6	0	0	0	0	113.5	D17 R21 D42	D17-S19 WeakPolarHBondContact OD1-CB 3.3Å; D17-S19 PolarHBondContact OD1-N 3.39Å; D17-S19 PolarHBondContact OD1-OG 3.08Å; D17-S19 PolarHBondContact OD2-OG 3.36Å; S19-R21 WeakPolarHBondContact O-CG 3.13Å; S19-R21 PolarHBondContact O-N 3.41Å; S19-D42 CarbonylContact C-O 3.3Å; S19-D42 WeakPolarHBondContact CA-O 3.42Å; S19-D42 VanDerWaalsContact CB-O 3.25Å; S19-D42 WeakPolarHBondContact CB-O 3.46Å
20	A	83.1	Confident	71	Confident	66 Å²	66	81.5 Å²	81.5	55%	0.545	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.3	11.5	176.4	0	0	0	0	0	116.8	S22 D42 R43	A20-S22 PolarHBondContact O-N 3.11Å; A20-D42 PolarHBondContact N-O 3.23Å; A20-R43 WeakPolarHBondContact CA-O 3.43Å; A20-R43 HydrophobicContact CB-CB 4.49Å
21	R	84.1	Confident	72.2	Confident	153 Å²	153	79.7 Å²	79.7	58%	0.577	46%	0.46	S	S	*	.	S	Bend	trans	-80.9	5.4	-179.1	-64.9	-177.4	-166.8	-158.6	10.8	114.4	D17 L18 S19 M23 N44	D17-R21 PolarHBondContact O-NH2 3.09Å; L18-R21 WeakPolarHBondContact O-CG 3.33Å; S19-R21 WeakPolarHBondContact O-CG 3.13Å; S19-R21 PolarHBondContact O-N 3.41Å; R21-M23 HydrophobicContact CB-CG 3.74Å; R21-M23 HydrophobicContact CB-SD 4.19Å; R21-M23 PolarHBondContact O-N 3.01Å; R21-M23 VanDerWaalsContact O-N 3.12Å; R21-N44 VanDerWaalsContact C-OD1 3.26Å; R21-N44 WeakPolarHBondContact CA-OD1 3.06Å; R21-N44 PolarHBondContact N-OD1 3.46Å; R21-N44 VanDerWaalsContact N-OD1 3.11Å
22	S	81	Confident	73.2	Confident	78 Å²	78	74.1 Å²	74.1	55%	0.545	43%	0.431	S	S	.	.			trans	55.6	19.3	-176.5	-62.5	0	0	0	0	115.5	A20 N44	A20-S22 PolarHBondContact O-N 3.11Å; S22-N44 PolarHBondContact N-OD1 3.16Å
23	M	81.5	Confident	73.9	Confident	43 Å²	43	72.6 Å²	72.6	21%	0.212	41%	0.414	C	S	.	.			trans	-62	141.7	-176	-58.3	-176	-55.3	0	0	111.6	L18 R21 L41 N44 N45 I46	L18-M23 HydrophobicContact CB-CE 3.61Å; L18-M23 HydrophobicContact CB-SD 4.44Å; L18-M23 HydrophobicContact CD1-CE 4.21Å; R21-M23 HydrophobicContact CB-CG 3.74Å; R21-M23 HydrophobicContact CB-SD 4.19Å; R21-M23 PolarHBondContact O-N 3.01Å; R21-M23 VanDerWaalsContact O-N 3.12Å; M23-L41 HydrophobicContact CE-CD2 3.89Å; M23-N44 HydrophobicContact CB-CB 4.45Å; M23-N44 PolarHBondContact N-OD1 3.06Å; M23-N45 CarbonylContact O-C 3.53Å; M23-N45 WeakPolarHBondContact O-CA 3.28Å; M23-N45 PolarHBondContact O-N 2.9Å; M23-I46 PolarHBondContact O-N 3.39Å
24	Q	80.7	Confident	74.3	Confident	126 Å²	126	77.8 Å²	77.8	59%	0.589	43%	0.434	S	S	*	.	S	Bend	trans	-98.2	-18.2	177.5	-63.6	-178.1	5.8	0	0	113.4	N45 M47	Q24-N45 HydrophobicContact CG-CB 4.29Å; Q24-M47 PolarHBondContact O-N 3.16Å
25	K	81.1	Confident	73.9	Confident	131 Å²	131	79.5 Å²	79.5	57%	0.57	44%	0.44	S	S	*	.	S	Bend	trans	-154.5	164	-179.9	-58.9	-173.6	-177.9	-176.2	0	108.6
26	L	76.1	Confident	73.5	Confident	7 Å²	7	76.3 Å²	76.3	4%	0.037	42%	0.421	C	S	.	.			trans	-77.6	145.6	156.3	-71.9	95.2	0	0	0	109.9	F30 L41 L49 L52	L26-F30 HydrophobicContact CD2-CD1 3.63Å; L26-F30 HydrophobicContact CD2-CE1 4.04Å; L26-F30 HydrophobicContact CD2-CG 4.23Å; L26-L41 HydrophobicContact CD1-CD1 4.01Å; L26-L41 HydrophobicContact CD2-CD2 4.45Å; L26-L41 HydrophobicContact CG-CD2 4.49Å; L26-L49 HydrophobicContact CD1-CD2 4.47Å; L26-L52 HydrophobicContact CD1-CD2 4.2Å; L26-L52 HydrophobicContact CD2-CD2 3.97Å
27	D	70.6	Confident	73.5	Confident	116 Å²	116	77.1 Å²	77.1	62%	0.62	42%	0.422	S	S	*	.			trans	-71.5	140.3	172.7	-79.7	-50.5	0	0	0	111	S29 F30	D27-S29 PolarHBondContact O-N 2.64Å; D27-F30 VanDerWaalsContact O-CB 3.3Å; D27-F30 WeakPolarHBondContact O-CB 3.41Å; D27-F30 PolarHBondContact O-N 2.92Å
28	P	63.1	Low	73.6	Confident	94 Å²	94	73.9 Å²	73.9	61%	0.61	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-12.8	179.1	-21.4	31.8	0	0	0	115
29	S	57.7	Low	73.9	Confident	103 Å²	103	72.9 Å²	72.9	72%	0.72	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.1	6.7	174.8	58.7	0	0	0	0	113.6	D27 T31	D27-S29 PolarHBondContact O-N 2.64Å; S29-T31 PolarHBondContact O-N 3.33Å; S29-T31 VanDerWaalsContact O-N 3.16Å
30	F	65.3	Low	74.1	Confident	44 Å²	44	73.2 Å²	73.2	19%	0.193	40%	0.398	C	S	.	.			trans	-77.3	97.5	175.5	-178.4	-98.7	0	0	0	110.6	V16 L18 L26 D27 L39	V16-F30 HydrophobicContact CG1-CE2 4.24Å; V16-F30 HydrophobicContact CG1-CZ 4.01Å; L18-F30 HydrophobicContact CD1-CD2 4.33Å; L18-F30 HydrophobicContact CD1-CE2 3.8Å; L18-F30 HydrophobicContact CD1-CZ 4.08Å; L26-F30 HydrophobicContact CD2-CD1 3.63Å; L26-F30 HydrophobicContact CD2-CE1 4.04Å; L26-F30 HydrophobicContact CD2-CG 4.23Å; D27-F30 VanDerWaalsContact O-CB 3.3Å; D27-F30 WeakPolarHBondContact O-CB 3.41Å; D27-F30 PolarHBondContact O-N 2.92Å; F30-L39 HydrophobicContact CE1-CD1 4.33Å; F30-L39 HydrophobicContact CE1-CD2 4.32Å; F30-L39 HydrophobicContact CZ-CD1 4.06Å
31	T	60.2	Low	74.3	Confident	105 Å²	105	70.1 Å²	70.1	64%	0.644	37%	0.372	S	S	*	.	P	Polyproline II helix	trans	-96.5	127.6	165.7	54.4	0	0	0	0	109.6	S29	S29-T31 PolarHBondContact O-N 3.33Å; S29-T31 VanDerWaalsContact O-N 3.16Å
32	C	59.2	Low	74.6	Confident	18 Å²	18	64 Å²	64	12%	0.122	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-63.8	159.9	160.9	-88.9	0	0	0	0	110.6	T36 C55	C32-T36 HydrophobicContact CB-CG2 4.3Å; C32-T36 VanDerWaalsContact SG-CG2 3.53Å; C32-C55 HydrophobicContact CB-CB 4.22Å; C32-C55 PolarHBondContact SG-SG 2.97Å
33	S	62	Low	74.9	Confident	67 Å²	67	68.9 Å²	68.9	47%	0.469	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-68.9	156.4	158.8	-157.8	0	0	0	0	108.5	D35 T36	S33-D35 WeakPolarHBondContact CB-OD2 3.41Å; S33-D35 PolarHBondContact O-N 3.21Å; S33-D35 VanDerWaalsContact O-N 3.11Å; S33-D35 PolarHBondContact OG-OD2 3.06Å; S33-T36 PolarHBondContact N-OG1 3.08Å; S33-T36 VanDerWaalsContact N-OG1 3.16Å; S33-T36 PolarHBondContact O-N 3.02Å; S33-T36 PolarHBondContact O-OG1 3.11Å
34	E	63.3	Low	75.3	Confident	179 Å²	179	67.1 Å²	67.1	84%	0.836	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-29.4	172.1	-63.8	-172.5	134.1	0	0	111	S57	E34-S57 WeakPolarHBondContact O-CB 3.07Å; E34-S57 PolarHBondContact O-OG 3.4Å
35	D	65.8	Low	75.8	Confident	91 Å²	91	63.4 Å²	63.4	49%	0.487	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-5.6	177.5	-24.6	-95.8	0	0	0	115	P14 S33 H37	P14-D35 HydrophobicContact CB-CB 4.4Å; P14-D35 VanDerWaalsContact CB-O 3.31Å; P14-D35 WeakPolarHBondContact CB-O 3.42Å; P14-D35 VanDerWaalsContact CD-O 3.27Å; P14-D35 WeakPolarHBondContact CD-O 3.4Å; P14-D35 HydrophobicContact CG-CB 3.84Å; P14-D35 WeakPolarHBondContact CG-O 3.3Å; S33-D35 WeakPolarHBondContact CB-OD2 3.41Å; S33-D35 PolarHBondContact O-N 3.21Å; S33-D35 VanDerWaalsContact O-N 3.11Å; S33-D35 PolarHBondContact OG-OD2 3.06Å; D35-H37 PolarHBondContact O-CE1 3.24Å; D35-H37 PolarHBondContact O-N 3.5Å; D35-H37 VanDerWaalsContact O-N 3.1Å; D35-H37 PolarHBondContact O-ND1 2.74Å
36	T	73.2	Confident	76.1	Confident	5 Å²	5	57.1 Å²	57.1	3%	0.031	31%	0.306	C	S	.	.			trans	-78.6	99.8	-175.7	-53.9	0	0	0	0	111.8	V16 C32 S33	V16-T36 HydrophobicContact CB-CG2 3.99Å; V16-T36 HydrophobicContact CG2-CG2 3.53Å; C32-T36 HydrophobicContact CB-CG2 4.3Å; C32-T36 VanDerWaalsContact SG-CG2 3.53Å; S33-T36 PolarHBondContact N-OG1 3.08Å; S33-T36 VanDerWaalsContact N-OG1 3.16Å; S33-T36 PolarHBondContact O-N 3.02Å; S33-T36 PolarHBondContact O-OG1 3.11Å
37	H	83.4	Confident	76.7	Confident	57 Å²	57	61.4 Å²	61.4	26%	0.264	33%	0.327	S	S	.	.			trans	-94	-20.4	-178.7	-65	81.2	0	0	0	113.6	V13 P14 D35 L58 Q59 Q60	V13-H37 HydrophobicContact CG1-CB 3.66Å; P14-H37 PolarHBondContact O-N 2.97Å; D35-H37 PolarHBondContact O-CE1 3.24Å; D35-H37 PolarHBondContact O-N 3.5Å; D35-H37 VanDerWaalsContact O-N 3.1Å; D35-H37 PolarHBondContact O-ND1 2.74Å; H37-L58 WeakPolarHBondContact O-CD1 3.32Å; H37-Q59 PolarHBondContact O-N 2.6Å; H37-Q60 PolarHBondContact O-N 3.41Å
38	T	86.8	Confident	77.5	Confident	10 Å²	10	61.6 Å²	61.6	6%	0.061	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	128.4	-178.4	-57.3	0	0	0	0	111.3	V15 V16 I40 Q60	V15-T38 WeakPolarHBondContact CA-O 3.3Å; V15-T38 HydrophobicContact CG1-CG2 4.01Å; V15-T38 HydrophobicContact CG2-CG2 4.17Å; V16-T38 PolarHBondContact N-O 2.77Å; T38-I40 HydrophobicContact CG2-CG1 4.28Å; T38-Q60 WeakPolarHBondContact CA-O 3.5Å; T38-Q60 HydrophobicContact CG2-CB 3.89Å; T38-Q60 PolarHBondContact OG1-OE1 3.15Å
39	L	88.7	Confident	78.6	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	123.7	179.5	177.2	60	0	0	0	110.1	V16 L18 F30 L41 L52 L58 Q60 L61 S62	V16-L39 HydrophobicContact CB-CD1 4.2Å; V16-L39 HydrophobicContact CG1-CD1 4.02Å; V16-L39 WeakPolarHBondContact O-CA 3.36Å; L18-L39 HydrophobicContact CD1-CD1 4.36Å; F30-L39 HydrophobicContact CE1-CD1 4.33Å; F30-L39 HydrophobicContact CE1-CD2 4.32Å; F30-L39 HydrophobicContact CZ-CD1 4.06Å; L39-L41 HydrophobicContact CD1-CD2 4.28Å; L39-L41 HydrophobicContact CD1-CG 4.36Å; L39-L41 HydrophobicContact CD2-CD1 4.16Å; L39-L41 HydrophobicContact CD2-CG 4.47Å; L39-L41 HydrophobicContact CG-CD1 4.27Å; L39-L41 HydrophobicContact CG-CD2 4.48Å; L39-L41 HydrophobicContact CG-CG 4.08Å; L39-L52 HydrophobicContact CD2-CD2 4.1Å; L39-L58 HydrophobicContact CB-CD1 3.6Å; L39-L58 HydrophobicContact CB-CD2 4.02Å; L39-L58 HydrophobicContact CB-CG 4.45Å; L39-L58 HydrophobicContact CD2-CD2 4.39Å; L39-Q60 PolarHBondContact N-O 3.27Å; L39-L61 HydrophobicContact CB-CD1 4.2Å; L39-L61 HydrophobicContact CD2-CD1 4.08Å; L39-L61 HydrophobicContact CG-CD1 4.15Å; L39-S62 PolarHBondContact O-N 3.06Å
40	I	89.4	Confident	79.7	Confident	45 Å²	45	55.5 Å²	55.5	23%	0.231	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	121.3	-179.3	-52.5	176.3	0	0	0	109	V15 V16 D17 L18 T38 D42	V15-I40 HydrophobicContact CG1-CD1 3.85Å; V15-I40 HydrophobicContact CG1-CG1 4.27Å; V16-I40 PolarHBondContact O-N 3.42Å; D17-I40 HydrophobicContact CB-CB 4.46Å; L18-I40 PolarHBondContact N-O 3.14Å; T38-I40 HydrophobicContact CG2-CG1 4.28Å; I40-D42 HydrophobicContact CG2-CB 4.18Å
41	L	87.6	Confident	80.3	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	29%	0.285	C	S	.	.			trans	-123.8	14.6	-176.4	-64.9	170.5	0	0	0	111.7	L18 M23 L26 L39 N44 I46 L49 L61 S62 V63 N66	L18-L41 HydrophobicContact CB-CD2 4.1Å; L18-L41 HydrophobicContact CD1-CD2 3.99Å; M23-L41 HydrophobicContact CE-CD2 3.89Å; L26-L41 HydrophobicContact CD1-CD1 4.01Å; L26-L41 HydrophobicContact CD2-CD2 4.45Å; L26-L41 HydrophobicContact CG-CD2 4.49Å; L39-L41 HydrophobicContact CD1-CD2 4.28Å; L39-L41 HydrophobicContact CD1-CG 4.36Å; L39-L41 HydrophobicContact CD2-CD1 4.16Å; L39-L41 HydrophobicContact CD2-CG 4.47Å; L39-L41 HydrophobicContact CG-CD1 4.27Å; L39-L41 HydrophobicContact CG-CD2 4.48Å; L39-L41 HydrophobicContact CG-CG 4.08Å; L41-N44 PolarHBondContact O-ND2 3.3Å; L41-I46 HydrophobicContact CB-CD1 3.9Å; L41-I46 HydrophobicContact CD1-CD1 4.25Å; L41-I46 HydrophobicContact CD2-CD1 4.18Å; L41-I46 HydrophobicContact CG-CD1 4.35Å; L41-L49 HydrophobicContact CD1-CD2 4.3Å; L41-L61 HydrophobicContact CD1-CD1 4.1Å; L41-S62 WeakPolarHBondContact CB-O 3.15Å; L41-S62 PolarHBondContact N-O 3.46Å; L41-V63 HydrophobicContact CB-CB 4.34Å; L41-V63 HydrophobicContact CB-CG1 3.86Å; L41-V63 HydrophobicContact CB-CG2 4.22Å; L41-V63 HydrophobicContact CD1-CG1 4.48Å; L41-V63 HydrophobicContact CD1-CG2 4.05Å; L41-N66 PolarHBondContact O-ND2 3.24Å
42	D	89.9	Confident	81.1	Confident	24 Å²	24	52.4 Å²	52.4	13%	0.128	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	151.6	-171.9	-67.9	4.4	0	0	0	113.8	S19 A20 I40 N44 S62 V63 A64	S19-D42 CarbonylContact C-O 3.3Å; S19-D42 WeakPolarHBondContact CA-O 3.42Å; S19-D42 VanDerWaalsContact CB-O 3.25Å; S19-D42 WeakPolarHBondContact CB-O 3.46Å; A20-D42 PolarHBondContact N-O 3.23Å; I40-D42 HydrophobicContact CG2-CB 4.18Å; D42-N44 VanDerWaalsContact C-N 3.28Å; D42-N44 PolarHBondContact O-N 3.02Å; D42-N44 PolarHBondContact O-ND2 3.37Å; D42-S62 VanDerWaalsContact CG-OG 3.3Å; D42-S62 VanDerWaalsContact OD1-CB 3.29Å; D42-S62 WeakPolarHBondContact OD1-CB 3.47Å; D42-S62 PolarHBondContact OD1-OG 3.49Å; D42-S62 PolarHBondContact OD2-OG 2.86Å; D42-V63 PolarHBondContact OD1-N 2.9Å; D42-A64 CarbonylContact C-O 3.55Å; D42-A64 VanDerWaalsContact CA-O 3.24Å; D42-A64 WeakPolarHBondContact CA-O 3.28Å; D42-A64 HydrophobicContact CB-CB 4.4Å; D42-A64 PolarHBondContact OD1-N 2.92Å
43	R	88.2	Confident	81.7	Confident	182 Å²	182	58.5 Å²	58.5	69%	0.687	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.1	37.7	175	-52.1	-179.4	-176.2	-161.4	-0.3	113.5	A20 A64 N65	A20-R43 WeakPolarHBondContact CA-O 3.43Å; A20-R43 HydrophobicContact CB-CB 4.49Å; R43-A64 PolarHBondContact N-O 2.82Å; R43-N65 VanDerWaalsContact CA-O 3.3Å; R43-N65 WeakPolarHBondContact CA-O 3.42Å; R43-N65 HydrophobicContact CG-CB 4.25Å; R43-N65 PolarHBondContact N-O 3.3Å
44	N	89.7	Confident	82.1	Confident	6 Å²	6	58.1 Å²	58.1	3%	0.032	28%	0.278	C	S	.	.	S	Bend	trans	-106.8	-173.7	172.1	-78.1	-71.8	0	0	0	110.1	L18 R21 S22 M23 L41 D42 I46 N66	L18-N44 PolarHBondContact O-ND2 3.42Å; R21-N44 VanDerWaalsContact C-OD1 3.26Å; R21-N44 WeakPolarHBondContact CA-OD1 3.06Å; R21-N44 PolarHBondContact N-OD1 3.46Å; R21-N44 VanDerWaalsContact N-OD1 3.11Å; S22-N44 PolarHBondContact N-OD1 3.16Å; M23-N44 HydrophobicContact CB-CB 4.45Å; M23-N44 PolarHBondContact N-OD1 3.06Å; L41-N44 PolarHBondContact O-ND2 3.3Å; D42-N44 VanDerWaalsContact C-N 3.28Å; D42-N44 PolarHBondContact O-N 3.02Å; D42-N44 PolarHBondContact O-ND2 3.37Å; N44-I46 HydrophobicContact CB-CD1 4.05Å; N44-I46 HydrophobicContact CB-CG1 3.9Å; N44-N66 WeakPolarHBondContact CA-OD1 3.27Å; N44-N66 WeakPolarHBondContact CB-OD1 3.31Å; N44-N66 PolarHBondContact N-ND2 2.89Å; N44-N66 PolarHBondContact O-OD1 3.29Å
45	N	89.8	Confident	82.8	Confident	47 Å²	47	49.6 Å²	49.6	25%	0.251	24%	0.239	S	C	.	.			trans	-111.1	32.7	174.9	-68.9	-75.3	0	0	0	111.1	M23 Q24 M47 R67	M23-N45 CarbonylContact O-C 3.53Å; M23-N45 WeakPolarHBondContact O-CA 3.28Å; M23-N45 PolarHBondContact O-N 2.9Å; Q24-N45 HydrophobicContact CG-CB 4.29Å; N45-M47 PolarHBondContact O-N 3.28Å; N45-R67 PolarHBondContact OD1-NE 3.24Å; N45-R67 PolarHBondContact OD1-NH2 3.33Å
46	I	89.2	Confident	83.3	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	24%	0.242	C	C	.	.			trans	-68.3	123.2	-174	-60.7	169.3	0	0	0	109.3	M23 L41 N44 K48 L49 V63 N66 R67 L68	M23-I46 PolarHBondContact O-N 3.39Å; L41-I46 HydrophobicContact CB-CD1 3.9Å; L41-I46 HydrophobicContact CD1-CD1 4.25Å; L41-I46 HydrophobicContact CD2-CD1 4.18Å; L41-I46 HydrophobicContact CG-CD1 4.35Å; N44-I46 HydrophobicContact CB-CD1 4.05Å; N44-I46 HydrophobicContact CB-CG1 3.9Å; I46-K48 WeakPolarHBondContact CG2-O 3.38Å; I46-L49 HydrophobicContact CG2-CD2 4.22Å; I46-V63 HydrophobicContact CD1-CG1 4.28Å; I46-N66 VanDerWaalsContact CB-OD1 3.28Å; I46-N66 WeakPolarHBondContact CB-OD1 3.15Å; I46-N66 WeakPolarHBondContact CG1-OD1 3.43Å; I46-N66 PolarHBondContact N-OD1 2.9Å; I46-R67 CarbonylContact O-C 3.43Å; I46-R67 WeakPolarHBondContact O-CA 3.5Å; I46-R67 PolarHBondContact O-N 3.15Å; I46-L68 HydrophobicContact CG2-CD2 4.22Å; I46-L68 PolarHBondContact O-N 3.04Å
47	M	87.9	Confident	83.8	Confident	96 Å²	96	50.7 Å²	50.7	47%	0.473	25%	0.251	S	S	.	.			trans	-97.9	-19.5	178.6	-66	179.1	-73.4	0	0	113.5	Q24 N45 R67	Q24-M47 PolarHBondContact O-N 3.16Å; N45-M47 PolarHBondContact O-N 3.28Å; M47-R67 WeakPolarHBondContact CA-O 3.08Å; M47-R67 HydrophobicContact CG-CB 4.18Å
48	K	87	Confident	84	Confident	121 Å²	121	48 Å²	48	53%	0.526	24%	0.239	S	C	.	.			trans	-149.4	142.7	179.2	-66.9	-171.2	178.4	-174	0	111.4	I46 D50	I46-K48 WeakPolarHBondContact CG2-O 3.38Å; K48-D50 PolarHBondContact O-N 2.82Å
49	L	85.3	Confident	84.1	Confident	8 Å²	8	50.2 Å²	50.2	4%	0.042	25%	0.249	C	C	.	.			trans	-89.4	84.4	167	-63.7	-179.9	0	0	0	109.3	L26 L41 I46 L52 L61 V63 L68 G73 V74	L26-L49 HydrophobicContact CD1-CD2 4.47Å; L41-L49 HydrophobicContact CD1-CD2 4.3Å; I46-L49 HydrophobicContact CG2-CD2 4.22Å; L49-L52 HydrophobicContact CB-CD1 3.81Å; L49-L52 HydrophobicContact CB-CG 4.37Å; L49-L52 HydrophobicContact CD1-CD1 3.99Å; L49-L52 HydrophobicContact CD2-CD1 4.2Å; L49-L52 HydrophobicContact CG-CD1 4.19Å; L49-L61 HydrophobicContact CD1-CD2 4.29Å; L49-V63 HydrophobicContact CD1-CG2 4.41Å; L49-V63 HydrophobicContact CD2-CG1 4.33Å; L49-V63 HydrophobicContact CD2-CG2 4.17Å; L49-L68 HydrophobicContact CD1-CD1 4.14Å; L49-L68 HydrophobicContact CD2-CD1 4.21Å; L49-L68 HydrophobicContact CD2-CD2 4.32Å; L49-L68 HydrophobicContact CG-CD1 4Å; L49-L68 HydrophobicContact CG-CD2 3.81Å; L49-G73 VanDerWaalsContact O-CA 3.3Å; L49-G73 WeakPolarHBondContact O-CA 3.49Å; L49-V74 HydrophobicContact CD1-CG1 3.81Å
50	D	80.8	Confident	84.3	Confident	60 Å²	60	53 Å²	53	32%	0.321	26%	0.261	S	S	.	.			trans	-99.4	150.9	172.4	-55.5	-37	0	0	0	109.1	K48 L52	K48-D50 PolarHBondContact O-N 2.82Å; D50-L52 PolarHBondContact O-N 3.36Å
51	H	78.3	Confident	84.4	Confident	82 Å²	82	51 Å²	51	38%	0.38	25%	0.251	S	S	.	.	S	Bend	trans	69	9.8	176.8	-40.1	97.6	0	0	0	118.4	E53 C54	H51-E53 PolarHBondContact O-N 3.37Å; H51-E53 VanDerWaalsContact O-N 3.08Å; H51-C54 PolarHBondContact O-N 2.9Å
52	L	77.9	Confident	84.7	Confident	3 Å²	3	51.6 Å²	51.6	2%	0.016	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-65.7	-8.5	173.9	-63.2	-174	0	0	0	114.2	L26 L39 L49 D50 C54 C55 L61 L77	L26-L52 HydrophobicContact CD1-CD2 4.2Å; L26-L52 HydrophobicContact CD2-CD2 3.97Å; L39-L52 HydrophobicContact CD2-CD2 4.1Å; L49-L52 HydrophobicContact CB-CD1 3.81Å; L49-L52 HydrophobicContact CB-CG 4.37Å; L49-L52 HydrophobicContact CD1-CD1 3.99Å; L49-L52 HydrophobicContact CD2-CD1 4.2Å; L49-L52 HydrophobicContact CG-CD1 4.19Å; D50-L52 PolarHBondContact O-N 3.36Å; L52-C54 PolarHBondContact O-N 2.73Å; L52-C54 VanDerWaalsContact O-N 3.16Å; L52-C55 WeakPolarHBondContact O-CB 3.45Å; L52-C55 PolarHBondContact O-N 3.1Å; L52-L61 HydrophobicContact CD1-CD2 3.91Å; L52-L77 HydrophobicContact CB-CD2 4.3Å; L52-L77 HydrophobicContact CD1-CD1 4.09Å
53	E	71.6	Confident	84.7	Confident	145 Å²	145	50.5 Å²	50.5	68%	0.678	25%	0.25	S	C	*	.	G	3₁₀ helix	trans	-59	-22.6	174	-47	-169.1	153.7	0	0	112.9	H51 C55 Q76	H51-E53 PolarHBondContact O-N 3.37Å; H51-E53 VanDerWaalsContact O-N 3.08Å; E53-C55 PolarHBondContact O-N 3.48Å; E53-Q76 HydrophobicContact CG-CB 4.46Å; E53-Q76 HydrophobicContact CG-CG 4.05Å
54	C	69.7	Low	84.9	Confident	60 Å²	60	41.8 Å²	41.8	41%	0.405	22%	0.217	S	C	.	.	G	3₁₀ helix	trans	-77.6	5.3	175.6	-60.5	0	0	0	0	114.1	H51 L52 P56	H51-C54 PolarHBondContact O-N 2.9Å; L52-C54 PolarHBondContact O-N 2.73Å; L52-C54 VanDerWaalsContact O-N 3.16Å; C54-P56 VanDerWaalsContact C-CD 3.46Å
55	C	77.4	Confident	85	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.233	C	C	.	.			trans	-128.7	52	-173.3	-50.2	0	0	0	0	112.8	C32 L52 E53 S57 L58 L77	C32-C55 HydrophobicContact CB-CB 4.22Å; C32-C55 PolarHBondContact SG-SG 2.97Å; L52-C55 WeakPolarHBondContact O-CB 3.45Å; L52-C55 PolarHBondContact O-N 3.1Å; E53-C55 PolarHBondContact O-N 3.48Å; C55-S57 VanDerWaalsContact C-N 3.31Å; C55-S57 PolarHBondContact O-N 3.29Å; C55-L58 HydrophobicContact CB-CB 4.36Å; C55-L58 VanDerWaalsContact O-CB 3.27Å; C55-L58 WeakPolarHBondContact O-CB 3.27Å; C55-L58 PolarHBondContact O-N 3.18Å; C55-L77 HydrophobicContact CB-CD2 4.46Å; C55-L77 WeakPolarHBondContact O-CD2 3.39Å
56	P	78.2	Confident	85.1	Confident	87 Å²	87	43.1 Å²	43.1	57%	0.565	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-23.8	-168	28.3	-36.9	0	0	0	115	C54 L58	C54-P56 VanDerWaalsContact C-CD 3.46Å; P56-L58 VanDerWaalsContact C-N 3.31Å
57	S	82.9	Confident	85.3	Confident	31 Å²	31	50.2 Å²	50.2	22%	0.217	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	4.3	178.3	45.2	0	0	0	0	114.2	E34 C55 Q59	E34-S57 WeakPolarHBondContact O-CB 3.07Å; E34-S57 PolarHBondContact O-OG 3.4Å; C55-S57 VanDerWaalsContact C-N 3.31Å; C55-S57 PolarHBondContact O-N 3.29Å; S57-Q59 PolarHBondContact O-N 3.02Å
58	L	86.4	Confident	85.5	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.228	C	C	.	.			trans	-69.9	118	-174.5	-164.5	78.4	0	0	0	112.2	H37 L39 C55 P56 L61 L77 E79 L80	H37-L58 WeakPolarHBondContact O-CD1 3.32Å; L39-L58 HydrophobicContact CB-CD1 3.6Å; L39-L58 HydrophobicContact CB-CD2 4.02Å; L39-L58 HydrophobicContact CB-CG 4.45Å; L39-L58 HydrophobicContact CD2-CD2 4.39Å; C55-L58 HydrophobicContact CB-CB 4.36Å; C55-L58 VanDerWaalsContact O-CB 3.27Å; C55-L58 WeakPolarHBondContact O-CB 3.27Å; C55-L58 PolarHBondContact O-N 3.18Å; P56-L58 VanDerWaalsContact C-N 3.31Å; L58-L61 HydrophobicContact CD2-CB 3.95Å; L58-L61 HydrophobicContact CD2-CD1 4.15Å; L58-L61 HydrophobicContact CD2-CG 4.47Å; L58-L77 HydrophobicContact CB-CD2 4.32Å; L58-L77 HydrophobicContact CD2-CD1 4.16Å; L58-L77 HydrophobicContact CD2-CD2 4.48Å; L58-E79 CarbonylContact O-C 3.54Å; L58-L80 HydrophobicContact CD2-CD1 4.4Å; L58-L80 WeakPolarHBondContact O-CA 3.48Å; L58-L80 PolarHBondContact O-N 3.32Å
59	Q	90.6	Very high	85.7	Confident	58 Å²	58	44 Å²	44	27%	0.271	23%	0.228	S	C	.	.			trans	-98.2	-22.2	178.4	-67	-175.8	9.9	0	0	113.4	H37 S57 E79 R81 V82	H37-Q59 PolarHBondContact O-N 2.6Å; S57-Q59 PolarHBondContact O-N 3.02Å; Q59-E79 HydrophobicContact CG-CB 4.49Å; Q59-R81 WeakPolarHBondContact O-CA 3.48Å; Q59-R81 PolarHBondContact O-N 3.03Å; Q59-V82 PolarHBondContact O-N 2.97Å
60	Q	92.2	Very high	86	Confident	57 Å²	57	50.5 Å²	50.5	27%	0.266	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	126.2	-177.3	-55.7	-179.7	-6.7	0	0	110.9	H37 T38 L39 V82	H37-Q60 PolarHBondContact O-N 3.41Å; T38-Q60 WeakPolarHBondContact CA-O 3.5Å; T38-Q60 HydrophobicContact CG2-CB 3.89Å; T38-Q60 PolarHBondContact OG1-OE1 3.15Å; L39-Q60 PolarHBondContact N-O 3.27Å; Q60-V82 WeakPolarHBondContact CA-O 3.42Å; Q60-V82 HydrophobicContact CB-CB 4.31Å; Q60-V82 HydrophobicContact CG-CB 4.08Å; Q60-V82 HydrophobicContact CG-CG2 4.14Å
61	L	92.1	Very high	86.4	Confident	3 Å²	3	47.7 Å²	47.7	2%	0.016	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	121.6	177.8	178.9	59.5	0	0	0	110.2	L39 L41 L49 L52 L58 V63 V74 L77 L80 V82 L83 N84	L39-L61 HydrophobicContact CB-CD1 4.2Å; L39-L61 HydrophobicContact CD2-CD1 4.08Å; L39-L61 HydrophobicContact CG-CD1 4.15Å; L41-L61 HydrophobicContact CD1-CD1 4.1Å; L49-L61 HydrophobicContact CD1-CD2 4.29Å; L52-L61 HydrophobicContact CD1-CD2 3.91Å; L58-L61 HydrophobicContact CD2-CB 3.95Å; L58-L61 HydrophobicContact CD2-CD1 4.15Å; L58-L61 HydrophobicContact CD2-CG 4.47Å; L61-V63 HydrophobicContact CD1-CG2 3.87Å; L61-V63 HydrophobicContact CD2-CG2 4.39Å; L61-V63 HydrophobicContact CG-CG2 3.91Å; L61-V74 HydrophobicContact CD2-CG1 3.95Å; L61-L77 HydrophobicContact CD2-CD1 3.85Å; L61-L80 HydrophobicContact CB-CD1 3.77Å; L61-V82 PolarHBondContact N-O 3.36Å; L61-L83 HydrophobicContact CB-CD1 4.1Å; L61-L83 HydrophobicContact CD2-CD1 3.95Å; L61-L83 HydrophobicContact CG-CD1 4.11Å; L61-N84 PolarHBondContact O-N 2.96Å
62	S	93	Very high	86.9	Confident	14 Å²	14	49 Å²	49	10%	0.098	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	127.8	171.7	-166.2	0	0	0	0	111.1	L39 L41 D42 N84	L39-S62 PolarHBondContact O-N 3.06Å; L41-S62 WeakPolarHBondContact CB-O 3.15Å; L41-S62 PolarHBondContact N-O 3.46Å; D42-S62 VanDerWaalsContact CG-OG 3.3Å; D42-S62 VanDerWaalsContact OD1-CB 3.29Å; D42-S62 WeakPolarHBondContact OD1-CB 3.47Å; D42-S62 PolarHBondContact OD1-OG 3.49Å; D42-S62 PolarHBondContact OD2-OG 2.86Å; S62-N84 WeakPolarHBondContact CA-O 3.45Å; S62-N84 PolarHBondContact OG-ND2 2.84Å
63	V	91.3	Very high	87.1	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.257	C	S	.	.			trans	-138.2	40.2	177.5	-155	0	0	0	0	109.8	L41 D42 I46 L49 L61 N66 L68 N84 L85 N88	L41-V63 HydrophobicContact CB-CB 4.34Å; L41-V63 HydrophobicContact CB-CG1 3.86Å; L41-V63 HydrophobicContact CB-CG2 4.22Å; L41-V63 HydrophobicContact CD1-CG1 4.48Å; L41-V63 HydrophobicContact CD1-CG2 4.05Å; D42-V63 PolarHBondContact OD1-N 2.9Å; I46-V63 HydrophobicContact CD1-CG1 4.28Å; L49-V63 HydrophobicContact CD1-CG2 4.41Å; L49-V63 HydrophobicContact CD2-CG1 4.33Å; L49-V63 HydrophobicContact CD2-CG2 4.17Å; L61-V63 HydrophobicContact CD1-CG2 3.87Å; L61-V63 HydrophobicContact CD2-CG2 4.39Å; L61-V63 HydrophobicContact CG-CG2 3.91Å; V63-N66 HydrophobicContact CG1-CB 4.09Å; V63-N66 PolarHBondContact O-ND2 3.12Å; V63-L68 HydrophobicContact CB-CD1 4.06Å; V63-L68 HydrophobicContact CG1-CD1 3.72Å; V63-N84 PolarHBondContact N-O 3.49Å; V63-L85 HydrophobicContact CB-CD2 3.67Å; V63-L85 HydrophobicContact CG2-CD2 3.68Å; V63-N88 PolarHBondContact O-ND2 2.86Å
64	A	91.6	Very high	87.9	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.224	C	C	.	.			trans	-66	148.2	-177.5	0	0	0	0	0	111.7	D42 R43 N66 P86	D42-A64 CarbonylContact C-O 3.55Å; D42-A64 VanDerWaalsContact CA-O 3.24Å; D42-A64 WeakPolarHBondContact CA-O 3.28Å; D42-A64 HydrophobicContact CB-CB 4.4Å; D42-A64 PolarHBondContact OD1-N 2.92Å; R43-A64 PolarHBondContact N-O 2.82Å; A64-N66 PolarHBondContact O-ND2 3.3Å; A64-N66 VanDerWaalsContact O-ND2 3.14Å; A64-P86 CarbonylContact C-O 3.33Å; A64-P86 VanDerWaalsContact CA-O 3.3Å; A64-P86 WeakPolarHBondContact CA-O 3.49Å; A64-P86 HydrophobicContact CB-CG 3.71Å
65	N	91.2	Very high	88.8	Confident	69 Å²	69	41.4 Å²	41.4	37%	0.369	21%	0.213	S	C	.	.	S	Bend	trans	55	60.9	177	-52.8	-88.3	0	0	0	111.9	R43 P86 N87	R43-N65 VanDerWaalsContact CA-O 3.3Å; R43-N65 WeakPolarHBondContact CA-O 3.42Å; R43-N65 HydrophobicContact CG-CB 4.25Å; R43-N65 PolarHBondContact N-O 3.3Å; N65-P86 PolarHBondContact N-O 2.78Å; N65-N87 CarbonylContact C-O 3.21Å; N65-N87 WeakPolarHBondContact CA-O 3.39Å; N65-N87 HydrophobicContact CB-CB 4.45Å; N65-N87 PolarHBondContact N-O 2.84Å; N65-N87 WeakPolarHBondContact OD1-CB 3.48Å; N65-N87 PolarHBondContact OD1-ND2 3.31Å
66	N	92.3	Very high	89.1	Confident	12 Å²	12	45.6 Å²	45.6	6%	0.064	23%	0.232	C	C	.	.	S	Bend	trans	-129.7	-162.8	179.9	-93	-89	0	0	0	109.8	L41 N44 I46 V63 A64 N87 N88	L41-N66 PolarHBondContact O-ND2 3.24Å; N44-N66 WeakPolarHBondContact CA-OD1 3.27Å; N44-N66 WeakPolarHBondContact CB-OD1 3.31Å; N44-N66 PolarHBondContact N-ND2 2.89Å; N44-N66 PolarHBondContact O-OD1 3.29Å; I46-N66 VanDerWaalsContact CB-OD1 3.28Å; I46-N66 WeakPolarHBondContact CB-OD1 3.15Å; I46-N66 WeakPolarHBondContact CG1-OD1 3.43Å; I46-N66 PolarHBondContact N-OD1 2.9Å; V63-N66 HydrophobicContact CG1-CB 4.09Å; V63-N66 PolarHBondContact O-ND2 3.12Å; A64-N66 PolarHBondContact O-ND2 3.3Å; A64-N66 VanDerWaalsContact O-ND2 3.14Å; N66-N87 PolarHBondContact N-O 3.42Å; N66-N87 VanDerWaalsContact N-O 3.1Å; N66-N88 WeakPolarHBondContact CA-OD1 3.5Å; N66-N88 WeakPolarHBondContact CB-OD1 3.16Å; N66-N88 PolarHBondContact O-OD1 2.83Å
67	R	92.5	Very high	89.6	Confident	149 Å²	149	41.5 Å²	41.5	56%	0.562	21%	0.206	S	C	*	.			trans	-124.2	32.7	-179.2	-56.7	-172.4	-168	-136.2	0.7	112.2	N45 I46 M47 V69 N88	N45-R67 PolarHBondContact OD1-NE 3.24Å; N45-R67 PolarHBondContact OD1-NH2 3.33Å; I46-R67 CarbonylContact O-C 3.43Å; I46-R67 WeakPolarHBondContact O-CA 3.5Å; I46-R67 PolarHBondContact O-N 3.15Å; M47-R67 WeakPolarHBondContact CA-O 3.08Å; M47-R67 HydrophobicContact CG-CB 4.18Å; R67-V69 PolarHBondContact O-N 3.14Å; R67-N88 PolarHBondContact N-OD1 2.99Å
68	L	92.8	Very high	89.8	Confident	0 Å²	0	47 Å²	47	0%	0	22%	0.222	C	C	.	.			trans	-69.7	119.6	-178.2	-75.6	164.3	0	0	0	110.8	I46 L49 V63 L85 N88 S89 I90	I46-L68 HydrophobicContact CG2-CD2 4.22Å; I46-L68 PolarHBondContact O-N 3.04Å; L49-L68 HydrophobicContact CD1-CD1 4.14Å; L49-L68 HydrophobicContact CD2-CD1 4.21Å; L49-L68 HydrophobicContact CD2-CD2 4.32Å; L49-L68 HydrophobicContact CG-CD1 4Å; L49-L68 HydrophobicContact CG-CD2 3.81Å; V63-L68 HydrophobicContact CB-CD1 4.06Å; V63-L68 HydrophobicContact CG1-CD1 3.72Å; L68-L85 HydrophobicContact CD1-CD2 4.14Å; L68-N88 HydrophobicContact CB-CB 4.24Å; L68-N88 WeakPolarHBondContact CB-OD1 3.18Å; L68-N88 PolarHBondContact N-OD1 2.95Å; L68-S89 CarbonylContact O-C 3.29Å; L68-S89 WeakPolarHBondContact O-CA 3.29Å; L68-S89 PolarHBondContact O-N 2.93Å; L68-I90 HydrophobicContact CB-CG1 4.33Å; L68-I90 WeakPolarHBondContact O-CG1 3.25Å; L68-I90 PolarHBondContact O-N 3.17Å; L68-I90 VanDerWaalsContact O-N 3.15Å
69	V	91.6	Very high	89.9	Confident	87 Å²	87	50.7 Å²	50.7	53%	0.527	24%	0.239	S	C	.	.	S	Bend	trans	-90.8	-18.6	173.2	-176	0	0	0	0	111.6	R67 S89	R67-V69 PolarHBondContact O-N 3.14Å; V69-S89 WeakPolarHBondContact CA-O 3.35Å
70	R	90.8	Very high	90	Very high	144 Å²	144	48 Å²	48	54%	0.543	23%	0.226	S	C	.	.			trans	-145.4	146.2	-173.2	-84.8	-169.7	-179.3	148.8	7	110.8	Y92 E94	R70-Y92 WeakPolarHBondContact CD-OH 3.46Å; R70-Y92 HydrophobicContact CG-CE1 4.41Å; R70-Y92 PolarHBondContact NE-OH 3.39Å; R70-E94 WeakPolarHBondContact CA-OE1 3.22Å; R70-E94 WeakPolarHBondContact CB-OE1 3.39Å; R70-E94 WeakPolarHBondContact CG-OE1 3.47Å
71	M	90.6	Very high	90.1	Very high	0 Å²	0	50 Å²	50	0%	0	23%	0.232	C	C	.	.			trans	-116.7	0.2	-176.5	63.5	-175.6	-62.8	0	0	113.8	G73 V74 L83 L85 I90 I93 E94 L96 L107	M71-G73 PolarHBondContact O-N 3.29Å; M71-V74 WeakPolarHBondContact O-CG2 3.36Å; M71-V74 PolarHBondContact O-N 3.47Å; M71-L83 HydrophobicContact CE-CD2 4.1Å; M71-L85 HydrophobicContact CB-CD1 4.13Å; M71-L85 HydrophobicContact CE-CD1 3.94Å; M71-I90 HydrophobicContact CB-CD1 4.27Å; M71-I90 HydrophobicContact CG-CG2 4.36Å; M71-I90 HydrophobicContact SD-CG2 4.1Å; M71-I93 HydrophobicContact SD-CG2 4.46Å; M71-E94 HydrophobicContact CG-CG 3.61Å; M71-E94 WeakPolarHBondContact CG-O 3.49Å; M71-E94 PolarHBondContact N-OE1 2.92Å; M71-L96 HydrophobicContact CE-CD1 4.3Å; M71-L96 HydrophobicContact CE-CD2 3.66Å; M71-L96 HydrophobicContact CE-CG 4.05Å; M71-L107 HydrophobicContact CE-CD2 4.14Å; M71-L107 HydrophobicContact SD-CD2 4.05Å
72	M	87.4	Confident	90.2	Very high	110 Å²	110	51.7 Å²	51.7	54%	0.542	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-45.6	-30.4	-179.6	-170.9	176.9	-66.2	0	0	115.1	V74 S75 E94	M72-V74 PolarHBondContact O-N 2.95Å; M72-V74 VanDerWaalsContact O-N 3.16Å; M72-S75 VanDerWaalsContact O-CB 3.3Å; M72-S75 WeakPolarHBondContact O-CB 3.34Å; M72-S75 PolarHBondContact O-N 3.11Å; M72-S75 VanDerWaalsContact O-N 3.11Å; M72-S75 PolarHBondContact O-OG 2.86Å; M72-E94 HydrophobicContact CB-CG 4.34Å; M72-E94 WeakPolarHBondContact CB-OE1 3.5Å; M72-E94 VanDerWaalsContact CE-OE2 3.32Å; M72-E94 WeakPolarHBondContact CE-OE2 3.28Å; M72-E94 PolarHBondContact N-OE1 2.94Å
73	G	83.8	Confident	90.3	Very high	26 Å²	26	51 Å²	51	27%	0.268	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	-60.7	-16.1	177.7	0	0	0	0	0	116.2	L49 M71 S75	L49-G73 VanDerWaalsContact O-CA 3.3Å; L49-G73 WeakPolarHBondContact O-CA 3.49Å; M71-G73 PolarHBondContact O-N 3.29Å; G73-S75 VanDerWaalsContact C-N 3.3Å
74	V	88.6	Confident	90.5	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-78.3	-12.3	174.1	-52.8	0	0	0	0	113.5	L49 L61 M71 M72 Q76 L77 L83 L96 L99	L49-V74 HydrophobicContact CD1-CG1 3.81Å; L61-V74 HydrophobicContact CD2-CG1 3.95Å; M71-V74 WeakPolarHBondContact O-CG2 3.36Å; M71-V74 PolarHBondContact O-N 3.47Å; M72-V74 PolarHBondContact O-N 2.95Å; M72-V74 VanDerWaalsContact O-N 3.16Å; V74-Q76 PolarHBondContact O-N 2.94Å; V74-L77 HydrophobicContact CB-CD1 4.31Å; V74-L77 WeakPolarHBondContact O-CB 3.5Å; V74-L77 PolarHBondContact O-N 2.93Å; V74-L83 HydrophobicContact CB-CD2 4.4Å; V74-L83 HydrophobicContact CG1-CD1 4.12Å; V74-L83 HydrophobicContact CG1-CD2 4.12Å; V74-L83 HydrophobicContact CG2-CD2 4.07Å; V74-L96 HydrophobicContact CG2-CD2 4.17Å; V74-L99 HydrophobicContact CG2-CD1 3.96Å
75	S	87.8	Confident	90.6	Very high	23 Å²	23	51.2 Å²	51.2	16%	0.161	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-19.6	-168.8	54.7	0	0	0	0	116.3	M72 G73 G95	M72-S75 VanDerWaalsContact O-CB 3.3Å; M72-S75 WeakPolarHBondContact O-CB 3.34Å; M72-S75 PolarHBondContact O-N 3.11Å; M72-S75 VanDerWaalsContact O-N 3.11Å; M72-S75 PolarHBondContact O-OG 2.86Å; G73-S75 VanDerWaalsContact C-N 3.3Å; S75-G95 VanDerWaalsContact CA-O 3.28Å; S75-G95 WeakPolarHBondContact CA-O 3.43Å; S75-G95 WeakPolarHBondContact CB-O 3.33Å
76	Q	83.8	Confident	90.8	Very high	87 Å²	87	48.3 Å²	48.3	41%	0.407	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-8.2	177.6	-54	-55.8	-24.3	0	0	113.7	E53 V74 R78	E53-Q76 HydrophobicContact CG-CB 4.46Å; E53-Q76 HydrophobicContact CG-CG 4.05Å; V74-Q76 PolarHBondContact O-N 2.94Å; Q76-R78 VanDerWaalsContact C-N 3.33Å; Q76-R78 PolarHBondContact O-N 2.78Å
77	L	87.9	Confident	90.8	Very high	1 Å²	1	51.6 Å²	51.6	1%	0.005	24%	0.24	C	C	.	.			trans	-86.1	61.4	-172.2	-58.5	175.9	0	0	0	112.5	L52 C55 L58 L61 V74 E79 L80 L99	L52-L77 HydrophobicContact CB-CD2 4.3Å; L52-L77 HydrophobicContact CD1-CD1 4.09Å; C55-L77 HydrophobicContact CB-CD2 4.46Å; C55-L77 WeakPolarHBondContact O-CD2 3.39Å; L58-L77 HydrophobicContact CB-CD2 4.32Å; L58-L77 HydrophobicContact CD2-CD1 4.16Å; L58-L77 HydrophobicContact CD2-CD2 4.48Å; L61-L77 HydrophobicContact CD2-CD1 3.85Å; V74-L77 HydrophobicContact CB-CD1 4.31Å; V74-L77 WeakPolarHBondContact O-CB 3.5Å; V74-L77 PolarHBondContact O-N 2.93Å; L77-E79 PolarHBondContact O-N 3.29Å; L77-E79 VanDerWaalsContact O-N 3.08Å; L77-L80 HydrophobicContact CB-CB 4.06Å; L77-L80 HydrophobicContact CB-CD2 4.48Å; L77-L80 HydrophobicContact CD1-CD2 4.39Å; L77-L80 WeakPolarHBondContact O-CB 3.37Å; L77-L80 PolarHBondContact O-N 3.48Å; L77-L99 WeakPolarHBondContact O-CD2 3.5Å
78	R	88.2	Confident	90.9	Very high	147 Å²	147	45 Å²	45	56%	0.555	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-28.1	-167.7	-62.9	179.8	-176.8	-177.4	-0.2	115.6	Q76 L80	Q76-R78 VanDerWaalsContact C-N 3.33Å; Q76-R78 PolarHBondContact O-N 2.78Å; R78-L80 VanDerWaalsContact C-N 3.29Å; R78-L80 PolarHBondContact O-N 2.93Å
79	E	89.1	Confident	91	Very high	78 Å²	78	47.5 Å²	47.5	36%	0.364	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	1.7	177.1	-66.1	-57.9	138	0	0	114.1	L58 Q59 L77 R81	L58-E79 CarbonylContact O-C 3.54Å; Q59-E79 HydrophobicContact CG-CB 4.49Å; L77-E79 PolarHBondContact O-N 3.29Å; L77-E79 VanDerWaalsContact O-N 3.08Å; E79-R81 PolarHBondContact O-N 3.03Å
80	L	91.6	Very high	91.2	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.209	C	C	.	.			trans	-66.9	122.4	-174.8	-165.3	74.6	0	0	0	111.9	L58 L61 L77 R78 L83 L99 H101 L102	L58-L80 HydrophobicContact CD2-CD1 4.4Å; L58-L80 WeakPolarHBondContact O-CA 3.48Å; L58-L80 PolarHBondContact O-N 3.32Å; L61-L80 HydrophobicContact CB-CD1 3.77Å; L77-L80 HydrophobicContact CB-CB 4.06Å; L77-L80 HydrophobicContact CB-CD2 4.48Å; L77-L80 HydrophobicContact CD1-CD2 4.39Å; L77-L80 WeakPolarHBondContact O-CB 3.37Å; L77-L80 PolarHBondContact O-N 3.48Å; R78-L80 VanDerWaalsContact C-N 3.29Å; R78-L80 PolarHBondContact O-N 2.93Å; L80-L83 HydrophobicContact CD2-CB 3.91Å; L80-L83 HydrophobicContact CD2-CD1 4.16Å; L80-L83 HydrophobicContact CD2-CD2 4.18Å; L80-L83 HydrophobicContact CD2-CG 4.31Å; L80-L99 HydrophobicContact CD2-CD1 4.19Å; L80-H101 CarbonylContact O-C 3.46Å; L80-L102 HydrophobicContact CD2-CD1 4.32Å; L80-L102 HydrophobicContact CG-CD1 4.3Å; L80-L102 VanDerWaalsContact O-CA 3.25Å; L80-L102 WeakPolarHBondContact O-CA 3.48Å; L80-L102 PolarHBondContact O-N 3Å
81	R	93.9	Very high	91.2	Very high	101 Å²	101	38 Å²	38	38%	0.381	20%	0.198	S	C	.	.			trans	-105.7	-35	-179.6	-67.1	166	-172.9	-102.6	-6.8	112.2	Q59 E79 T103 W104	Q59-R81 WeakPolarHBondContact O-CA 3.48Å; Q59-R81 PolarHBondContact O-N 3.03Å; E79-R81 PolarHBondContact O-N 3.03Å; R81-T103 PolarHBondContact O-N 2.84Å; R81-T103 PolarHBondContact O-OG1 2.84Å; R81-T103 VanDerWaalsContact O-OG1 3.13Å; R81-W104 PolarHBondContact O-N 3.23Å
82	V	94.9	Very high	91.4	Very high	37 Å²	37	42.3 Å²	42.3	22%	0.224	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	121	-177.9	-175.3	0	0	0	0	109.8	Q59 Q60 L61 W104	Q59-V82 PolarHBondContact O-N 2.97Å; Q60-V82 WeakPolarHBondContact CA-O 3.42Å; Q60-V82 HydrophobicContact CB-CB 4.31Å; Q60-V82 HydrophobicContact CG-CB 4.08Å; Q60-V82 HydrophobicContact CG-CG2 4.14Å; L61-V82 PolarHBondContact N-O 3.36Å; V82-W104 WeakPolarHBondContact CA-O 3.48Å; V82-W104 HydrophobicContact CG1-CB 4.39Å; V82-W104 HydrophobicContact CG1-CD2 4.15Å; V82-W104 HydrophobicContact CG1-CE3 3.55Å; V82-W104 HydrophobicContact CG1-CZ3 4.09Å; V82-W104 HydrophobicContact CG2-CB 4.38Å
83	L	95.1	Very high	91.6	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	114.4	175	-179.2	52.9	0	0	0	110.8	L61 M71 V74 L80 L85 L96 L102 W104 L105 N106	L61-L83 HydrophobicContact CB-CD1 4.1Å; L61-L83 HydrophobicContact CD2-CD1 3.95Å; L61-L83 HydrophobicContact CG-CD1 4.11Å; M71-L83 HydrophobicContact CE-CD2 4.1Å; V74-L83 HydrophobicContact CB-CD2 4.4Å; V74-L83 HydrophobicContact CG1-CD1 4.12Å; V74-L83 HydrophobicContact CG1-CD2 4.12Å; V74-L83 HydrophobicContact CG2-CD2 4.07Å; L80-L83 HydrophobicContact CD2-CB 3.91Å; L80-L83 HydrophobicContact CD2-CD1 4.16Å; L80-L83 HydrophobicContact CD2-CD2 4.18Å; L80-L83 HydrophobicContact CD2-CG 4.31Å; L83-L85 HydrophobicContact CD1-CD1 3.9Å; L83-L85 HydrophobicContact CD1-CD2 3.91Å; L83-L85 HydrophobicContact CD1-CG 3.69Å; L83-L85 HydrophobicContact CD2-CD1 4.07Å; L83-L85 HydrophobicContact CG-CD1 3.98Å; L83-L85 HydrophobicContact CG-CG 3.98Å; L83-L96 HydrophobicContact CD2-CD2 4.03Å; L83-L102 HydrophobicContact CB-CD1 3.84Å; L83-W104 PolarHBondContact N-O 2.85Å; L83-L105 HydrophobicContact CB-CD1 3.92Å; L83-L105 HydrophobicContact CD2-CD1 3.86Å; L83-L105 HydrophobicContact CG-CD1 3.89Å; L83-L105 WeakPolarHBondContact O-CA 3.33Å; L83-N106 PolarHBondContact O-N 2.92Å
84	N	94.9	Very high	92	Very high	5 Å²	5	36.4 Å²	36.4	3%	0.027	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	102.2	-177.6	-169.8	46.8	0	0	0	110.4	V3 L61 S62 V63 P86 W104 N106	V3-N84 WeakPolarHBondContact CG1-ND2 3.2Å; V3-N84 WeakPolarHBondContact CG2-ND2 3.37Å; L61-N84 PolarHBondContact O-N 2.96Å; S62-N84 WeakPolarHBondContact CA-O 3.45Å; S62-N84 PolarHBondContact OG-ND2 2.84Å; V63-N84 PolarHBondContact N-O 3.49Å; N84-P86 VanDerWaalsContact CG-CD 3.49Å; N84-P86 WeakPolarHBondContact OD1-CD 3.31Å; N84-P86 WeakPolarHBondContact OD1-CG 3.47Å; N84-W104 HydrophobicContact CB-CH2 4.23Å; N84-W104 HydrophobicContact CB-CZ3 3.67Å; N84-W104 VanDerWaalsContact OD1-CH2 3.31Å; N84-W104 WeakPolarHBondContact OD1-CH2 3.1Å; N84-N106 PolarHBondContact OD1-ND2 2.92Å
85	L	94.3	Very high	92	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.186	C	C	.	.			trans	-119.8	29.8	179.8	-59.1	176.8	0	0	0	114.9	V63 L68 M71 L83 N88 I90 N106 L107 N110	V63-L85 HydrophobicContact CB-CD2 3.67Å; V63-L85 HydrophobicContact CG2-CD2 3.68Å; L68-L85 HydrophobicContact CD1-CD2 4.14Å; M71-L85 HydrophobicContact CB-CD1 4.13Å; M71-L85 HydrophobicContact CE-CD1 3.94Å; L83-L85 HydrophobicContact CD1-CD1 3.9Å; L83-L85 HydrophobicContact CD1-CD2 3.91Å; L83-L85 HydrophobicContact CD1-CG 3.69Å; L83-L85 HydrophobicContact CD2-CD1 4.07Å; L83-L85 HydrophobicContact CG-CD1 3.98Å; L83-L85 HydrophobicContact CG-CG 3.98Å; L85-N88 PolarHBondContact O-ND2 2.88Å; L85-I90 HydrophobicContact CB-CD1 4.05Å; L85-I90 HydrophobicContact CD1-CD1 3.9Å; L85-N106 PolarHBondContact N-O 3.25Å; L85-L107 HydrophobicContact CB-CD2 4.07Å; L85-L107 HydrophobicContact CD1-CD2 4.05Å; L85-N110 PolarHBondContact O-ND2 3.33Å; L85-N110 VanDerWaalsContact O-ND2 3.15Å
86	P	94.9	Very high	92.1	Very high	8 Å²	8	36 Å²	36	5%	0.052	18%	0.179	C	C	.	.			trans	-70.8	155.7	-174	32.8	-38.3	0	0	0	112.5	A64 N65 N84 N88 S108	A64-P86 CarbonylContact C-O 3.33Å; A64-P86 VanDerWaalsContact CA-O 3.3Å; A64-P86 WeakPolarHBondContact CA-O 3.49Å; A64-P86 HydrophobicContact CB-CG 3.71Å; N65-P86 PolarHBondContact N-O 2.78Å; N84-P86 VanDerWaalsContact CG-CD 3.49Å; N84-P86 WeakPolarHBondContact OD1-CD 3.31Å; N84-P86 WeakPolarHBondContact OD1-CG 3.47Å; P86-N88 PolarHBondContact O-ND2 2.95Å; P86-S108 CarbonylContact C-O 3.59Å; P86-S108 WeakPolarHBondContact CA-O 3.21Å; P86-S108 WeakPolarHBondContact CB-OG 3.35Å
87	N	93.4	Very high	92.4	Very high	80 Å²	80	40.4 Å²	40.4	43%	0.428	19%	0.192	S	C	.	.	S	Bend	trans	54.4	66.8	-176.7	-62.6	-13.7	0	0	0	111.6	N65 N66 S108 G109	N65-N87 CarbonylContact C-O 3.21Å; N65-N87 WeakPolarHBondContact CA-O 3.39Å; N65-N87 HydrophobicContact CB-CB 4.45Å; N65-N87 PolarHBondContact N-O 2.84Å; N65-N87 WeakPolarHBondContact OD1-CB 3.48Å; N65-N87 PolarHBondContact OD1-ND2 3.31Å; N66-N87 PolarHBondContact N-O 3.42Å; N66-N87 VanDerWaalsContact N-O 3.1Å; N87-S108 PolarHBondContact N-O 2.97Å; N87-G109 VanDerWaalsContact CA-O 3.23Å; N87-G109 WeakPolarHBondContact CA-O 3.33Å; N87-G109 PolarHBondContact N-O 3.29Å
88	N	94	Very high	92.3	Very high	11 Å²	11	44 Å²	44	6%	0.059	21%	0.21	C	C	.	.	S	Bend	trans	-132	-153.2	175.1	-86.3	-77.7	0	0	0	109	V63 N66 R67 L68 L85 P86 I90 G109 N110	V63-N88 PolarHBondContact O-ND2 2.86Å; N66-N88 WeakPolarHBondContact CA-OD1 3.5Å; N66-N88 WeakPolarHBondContact CB-OD1 3.16Å; N66-N88 PolarHBondContact O-OD1 2.83Å; R67-N88 PolarHBondContact N-OD1 2.99Å; L68-N88 HydrophobicContact CB-CB 4.24Å; L68-N88 WeakPolarHBondContact CB-OD1 3.18Å; L68-N88 PolarHBondContact N-OD1 2.95Å; L85-N88 PolarHBondContact O-ND2 2.88Å; P86-N88 PolarHBondContact O-ND2 2.95Å; N88-I90 HydrophobicContact CB-CD1 4.35Å; N88-I90 HydrophobicContact CB-CG1 4.24Å; N88-G109 PolarHBondContact N-O 3.05Å; N88-G109 VanDerWaalsContact N-O 3.12Å; N88-N110 VanDerWaalsContact C-OD1 3.24Å; N88-N110 WeakPolarHBondContact CA-OD1 3.42Å; N88-N110 WeakPolarHBondContact CB-OD1 3.25Å
89	S	94.6	Very high	92.4	Very high	53 Å²	53	37 Å²	37	37%	0.371	18%	0.184	S	C	.	.			trans	-137	33.8	178.3	-51	0	0	0	0	111.3	L68 V69 G91 N110 N111	L68-S89 CarbonylContact O-C 3.29Å; L68-S89 WeakPolarHBondContact O-CA 3.29Å; L68-S89 PolarHBondContact O-N 2.93Å; V69-S89 WeakPolarHBondContact CA-O 3.35Å; S89-G91 PolarHBondContact O-N 2.88Å; S89-N110 PolarHBondContact N-OD1 2.95Å; S89-N111 WeakPolarHBondContact CA-OD1 3.4Å
90	I	94.8	Very high	92.4	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.186	C	C	.	.			trans	-71.3	117.4	-176.5	-59	167.9	0	0	0	108.1	L68 M71 L85 N88 Y92 L107 N110 N111 I112	L68-I90 HydrophobicContact CB-CG1 4.33Å; L68-I90 WeakPolarHBondContact O-CG1 3.25Å; L68-I90 PolarHBondContact O-N 3.17Å; L68-I90 VanDerWaalsContact O-N 3.15Å; M71-I90 HydrophobicContact CB-CD1 4.27Å; M71-I90 HydrophobicContact CG-CG2 4.36Å; M71-I90 HydrophobicContact SD-CG2 4.1Å; L85-I90 HydrophobicContact CB-CD1 4.05Å; L85-I90 HydrophobicContact CD1-CD1 3.9Å; N88-I90 HydrophobicContact CB-CD1 4.35Å; N88-I90 HydrophobicContact CB-CG1 4.24Å; I90-Y92 VanDerWaalsContact CG2-O 3.29Å; I90-Y92 WeakPolarHBondContact CG2-O 3.45Å; I90-L107 HydrophobicContact CD1-CD2 3.83Å; I90-N110 HydrophobicContact CB-CB 4.45Å; I90-N110 VanDerWaalsContact CB-OD1 3.31Å; I90-N110 WeakPolarHBondContact CB-OD1 3.2Å; I90-N110 WeakPolarHBondContact CG1-OD1 3.43Å; I90-N110 PolarHBondContact N-OD1 3.43Å; I90-N111 CarbonylContact O-C 3.54Å; I90-N111 PolarHBondContact O-N 3.33Å; I90-I112 HydrophobicContact CG2-CG1 4.49Å; I90-I112 WeakPolarHBondContact O-CG1 3.37Å; I90-I112 PolarHBondContact O-N 2.87Å
91	G	92.5	Very high	92.4	Very high	30 Å²	30	39.6 Å²	39.6	31%	0.309	20%	0.202	S	C	.	.			trans	-87.8	-17.7	-177.4	0	0	0	0	0	115.2	S89	S89-G91 PolarHBondContact O-N 2.88Å
92	Y	93.2	Very high	92.5	Very high	91 Å²	91	34.8 Å²	34.8	36%	0.357	18%	0.184	S	C	.	.	S	Bend	trans	-159.9	152	-177.9	64.3	-82.2	0	0	0	111.1	R70 I90 E94	R70-Y92 WeakPolarHBondContact CD-OH 3.46Å; R70-Y92 HydrophobicContact CG-CE1 4.41Å; R70-Y92 PolarHBondContact NE-OH 3.39Å; I90-Y92 VanDerWaalsContact CG2-O 3.29Å; I90-Y92 WeakPolarHBondContact CG2-O 3.45Å; Y92-E94 HydrophobicContact CD2-CB 4.11Å; Y92-E94 HydrophobicContact CD2-CG 4.29Å; Y92-E94 HydrophobicContact CE2-CB 3.75Å; Y92-E94 HydrophobicContact CE2-CG 3.79Å; Y92-E94 WeakPolarHBondContact CE2-OE2 3.48Å; Y92-E94 PolarHBondContact OH-OE2 2.79Å
93	I	92.9	Very high	92.5	Very high	4 Å²	4	35.1 Å²	35.1	2%	0.021	19%	0.186	C	C	.	.			trans	-80.3	128.5	179.5	-56.2	177.5	0	0	0	109.4	M71 L96 L107 I112 Q117 L118 L129	M71-I93 HydrophobicContact SD-CG2 4.46Å; I93-L96 HydrophobicContact CG2-CD1 3.45Å; I93-L96 VanDerWaalsContact CG2-CD1 3.45Å; I93-L96 HydrophobicContact CG2-CG 4.12Å; I93-L107 HydrophobicContact CD1-CD1 4.34Å; I93-L107 HydrophobicContact CG1-CD1 4.26Å; I93-I112 HydrophobicContact CD1-CG2 4.43Å; I93-I112 HydrophobicContact CG1-CD1 4.04Å; I93-I112 HydrophobicContact CG1-CG2 4.14Å; I93-Q117 PolarHBondContact O-NE2 2.97Å; I93-L118 HydrophobicContact CD1-CD1 4.08Å; I93-L118 HydrophobicContact CD1-CG 4.29Å; I93-L129 HydrophobicContact CD1-CD2 4.29Å
94	E	92.3	Very high	92.6	Very high	8 Å²	8	37.9 Å²	37.9	4%	0.037	20%	0.197	C	C	.	.			trans	-148.8	164.9	179.3	56.5	172.1	-168	0	0	111.2	R70 M71 M72 Y92 L96	R70-E94 WeakPolarHBondContact CA-OE1 3.22Å; R70-E94 WeakPolarHBondContact CB-OE1 3.39Å; R70-E94 WeakPolarHBondContact CG-OE1 3.47Å; M71-E94 HydrophobicContact CG-CG 3.61Å; M71-E94 WeakPolarHBondContact CG-O 3.49Å; M71-E94 PolarHBondContact N-OE1 2.92Å; M72-E94 HydrophobicContact CB-CG 4.34Å; M72-E94 WeakPolarHBondContact CB-OE1 3.5Å; M72-E94 VanDerWaalsContact CE-OE2 3.32Å; M72-E94 WeakPolarHBondContact CE-OE2 3.28Å; M72-E94 PolarHBondContact N-OE1 2.94Å; Y92-E94 HydrophobicContact CD2-CB 4.11Å; Y92-E94 HydrophobicContact CD2-CG 4.29Å; Y92-E94 HydrophobicContact CE2-CB 3.75Å; Y92-E94 HydrophobicContact CE2-CG 3.79Å; Y92-E94 WeakPolarHBondContact CE2-OE2 3.48Å; Y92-E94 PolarHBondContact OH-OE2 2.79Å; E94-L96 PolarHBondContact O-N 2.98Å; E94-L96 VanDerWaalsContact O-N 3.09Å
95	G	87.2	Confident	92.6	Very high	15 Å²	15	37.7 Å²	37.7	16%	0.155	20%	0.196	C	C	.	.	S	Bend	trans	75	-8	171.3	0	0	0	0	0	116.7	S75 R97	S75-G95 VanDerWaalsContact CA-O 3.28Å; S75-G95 WeakPolarHBondContact CA-O 3.43Å; S75-G95 WeakPolarHBondContact CB-O 3.33Å; G95-R97 VanDerWaalsContact C-N 3.29Å; G95-R97 PolarHBondContact O-N 3.02Å
96	L	91.3	Very high	92.7	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-76.7	-6.3	-177.7	-58.3	-177.5	0	0	0	115.1	M71 V74 L83 I93 E94 D98 L99 L102 L105 L118	M71-L96 HydrophobicContact CE-CD1 4.3Å; M71-L96 HydrophobicContact CE-CD2 3.66Å; M71-L96 HydrophobicContact CE-CG 4.05Å; V74-L96 HydrophobicContact CG2-CD2 4.17Å; L83-L96 HydrophobicContact CD2-CD2 4.03Å; I93-L96 HydrophobicContact CG2-CD1 3.45Å; I93-L96 VanDerWaalsContact CG2-CD1 3.45Å; I93-L96 HydrophobicContact CG2-CG 4.12Å; E94-L96 PolarHBondContact O-N 2.98Å; E94-L96 VanDerWaalsContact O-N 3.09Å; L96-D98 VanDerWaalsContact C-N 3.31Å; L96-D98 PolarHBondContact O-N 2.82Å; L96-L99 HydrophobicContact CD2-CD1 3.75Å; L96-L99 WeakPolarHBondContact O-CB 3.32Å; L96-L99 PolarHBondContact O-N 2.97Å; L96-L99 VanDerWaalsContact O-N 3.14Å; L96-L102 HydrophobicContact CD2-CD2 4.25Å; L96-L105 HydrophobicContact CD1-CD2 3.63Å; L96-L118 HydrophobicContact CD1-CD2 3.51Å
97	R	88.7	Confident	92.8	Very high	180 Å²	180	37.4 Å²	37.4	68%	0.679	19%	0.194	S	C	*	.	G	3₁₀ helix	trans	-55.5	-40.7	-171.8	-178.2	178.9	-66.3	-167.8	0.3	114.2	G95 L99 S120	G95-R97 VanDerWaalsContact C-N 3.29Å; G95-R97 PolarHBondContact O-N 3.02Å; R97-L99 VanDerWaalsContact C-N 3.35Å; R97-S120 WeakPolarHBondContact O-CB 3.41Å; R97-S120 PolarHBondContact O-OG 3.12Å
98	D	87.3	Confident	92.9	Very high	75 Å²	75	34.4 Å²	34.4	40%	0.401	18%	0.179	S	C	.	.	G	3₁₀ helix	trans	-97.5	10.7	-173.4	-59.3	-21.5	0	0	0	112	L96 S100	L96-D98 VanDerWaalsContact C-N 3.31Å; L96-D98 PolarHBondContact O-N 2.82Å; D98-S100 PolarHBondContact O-N 3.39Å
99	L	90.3	Very high	92.9	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.186	C	C	.	.			trans	-98.9	62.8	-178.3	-55.1	-169.6	0	0	0	111.7	V74 L77 L80 L96 R97 H101 L102	V74-L99 HydrophobicContact CG2-CD1 3.96Å; L77-L99 WeakPolarHBondContact O-CD2 3.5Å; L80-L99 HydrophobicContact CD2-CD1 4.19Å; L96-L99 HydrophobicContact CD2-CD1 3.75Å; L96-L99 WeakPolarHBondContact O-CB 3.32Å; L96-L99 PolarHBondContact O-N 2.97Å; L96-L99 VanDerWaalsContact O-N 3.14Å; R97-L99 VanDerWaalsContact C-N 3.35Å; L99-H101 PolarHBondContact O-N 2.8Å; L99-L102 HydrophobicContact CB-CB 4.26Å; L99-L102 WeakPolarHBondContact O-CB 3.44Å; L99-L102 PolarHBondContact O-N 3.15Å
100	S	89.1	Confident	93	Very high	57 Å²	57	32.6 Å²	32.6	40%	0.399	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-23.9	-179.4	49.4	0	0	0	0	114	D98 C123	D98-S100 PolarHBondContact O-N 3.39Å; S100-C123 WeakPolarHBondContact O-CB 3.23Å; S100-C123 PolarHBondContact O-SG 2.85Å
101	H	91.9	Very high	93	Very high	76 Å²	76	36 Å²	36	35%	0.352	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94	3.2	-177	-63.4	-49.7	0	0	0	114.6	L80 L99 T103	L80-H101 CarbonylContact O-C 3.46Å; L99-H101 PolarHBondContact O-N 2.8Å; H101-T103 PolarHBondContact O-N 3.15Å
102	L	94.3	Very high	93.1	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.173	C	C	.	.			trans	-67.7	114.7	-179.7	-167.2	70.2	0	0	0	110.6	L80 L83 L96 L99 L105 C123 L124	L80-L102 HydrophobicContact CD2-CD1 4.32Å; L80-L102 HydrophobicContact CG-CD1 4.3Å; L80-L102 VanDerWaalsContact O-CA 3.25Å; L80-L102 WeakPolarHBondContact O-CA 3.48Å; L80-L102 PolarHBondContact O-N 3Å; L83-L102 HydrophobicContact CB-CD1 3.84Å; L96-L102 HydrophobicContact CD2-CD2 4.25Å; L99-L102 HydrophobicContact CB-CB 4.26Å; L99-L102 WeakPolarHBondContact O-CB 3.44Å; L99-L102 PolarHBondContact O-N 3.15Å; L102-L105 HydrophobicContact CD2-CB 4.14Å; L102-L105 HydrophobicContact CD2-CD1 4.46Å; L102-L105 HydrophobicContact CD2-CD2 4.23Å; L102-C123 CarbonylContact O-C 3.18Å; L102-C123 VanDerWaalsContact O-C 3.3Å; L102-L124 HydrophobicContact CD2-CD1 4.16Å; L102-L124 HydrophobicContact CG-CD1 3.97Å; L102-L124 WeakPolarHBondContact O-CA 3.39Å; L102-L124 PolarHBondContact O-N 3.2Å; L102-L124 VanDerWaalsContact O-N 3.15Å
103	T	95.7	Very high	93.2	Very high	44 Å²	44	36.6 Å²	36.6	27%	0.27	18%	0.184	S	C	.	.			trans	-102.7	-24.7	179.2	57.2	0	0	0	0	113.1	R81 H101 C123 Q125 H126	R81-T103 PolarHBondContact O-N 2.84Å; R81-T103 PolarHBondContact O-OG1 2.84Å; R81-T103 VanDerWaalsContact O-OG1 3.13Å; H101-T103 PolarHBondContact O-N 3.15Å; T103-C123 HydrophobicContact CG2-CB 4.46Å; T103-Q125 PolarHBondContact O-N 3Å; T103-H126 PolarHBondContact O-N 3.13Å
104	W	96.2	Very high	93.2	Very high	59 Å²	59	40.1 Å²	40.1	22%	0.223	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	126.8	-178.5	-169.6	100.1	0	0	0	111	R81 V82 L83 N84 N106 H126	R81-W104 PolarHBondContact O-N 3.23Å; V82-W104 WeakPolarHBondContact CA-O 3.48Å; V82-W104 HydrophobicContact CG1-CB 4.39Å; V82-W104 HydrophobicContact CG1-CD2 4.15Å; V82-W104 HydrophobicContact CG1-CE3 3.55Å; V82-W104 HydrophobicContact CG1-CZ3 4.09Å; V82-W104 HydrophobicContact CG2-CB 4.38Å; L83-W104 PolarHBondContact N-O 2.85Å; N84-W104 HydrophobicContact CB-CH2 4.23Å; N84-W104 HydrophobicContact CB-CZ3 3.67Å; N84-W104 VanDerWaalsContact OD1-CH2 3.31Å; N84-W104 WeakPolarHBondContact OD1-CH2 3.1Å; W104-N106 HydrophobicContact CE3-CB 4.15Å; W104-N106 HydrophobicContact CH2-CB 3.26Å; W104-N106 HydrophobicContact CZ2-CB 3.96Å; W104-N106 HydrophobicContact CZ3-CB 3.34Å; W104-H126 VanDerWaalsContact CD1-CB 3.5Å; W104-H126 AromaticContact CD1-CD2 3.59Å; W104-H126 AromaticContact CD1-CG 3.56Å; W104-H126 HydrophobicContact CG-CB 4.26Å; W104-H126 AromaticContact NE1-CD2 3.28Å; W104-H126 PolarHBondContact NE1-CD2 2.97Å; W104-H126 VanDerWaalsContact NE1-CD2 3.28Å; W104-H126 AromaticContact NE1-CG 3.56Å; W104-H126 AromaticContact NE1-NE2 3.62Å
105	L	96.7	Very high	93.2	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	122.9	179.2	177	57.9	0	0	0	110.2	L83 L96 L102 L107 L118 L124 H126 L127 D128	L83-L105 HydrophobicContact CB-CD1 3.92Å; L83-L105 HydrophobicContact CD2-CD1 3.86Å; L83-L105 HydrophobicContact CG-CD1 3.89Å; L83-L105 WeakPolarHBondContact O-CA 3.33Å; L96-L105 HydrophobicContact CD1-CD2 3.63Å; L102-L105 HydrophobicContact CD2-CB 4.14Å; L102-L105 HydrophobicContact CD2-CD1 4.46Å; L102-L105 HydrophobicContact CD2-CD2 4.23Å; L105-L107 HydrophobicContact CD1-CD1 4.03Å; L105-L107 HydrophobicContact CD1-CG 3.98Å; L105-L107 HydrophobicContact CD2-CD1 3.91Å; L105-L107 HydrophobicContact CG-CD1 3.99Å; L105-L107 HydrophobicContact CG-CG 4.24Å; L105-L118 HydrophobicContact CD2-CD2 3.66Å; L105-L124 HydrophobicContact CB-CD1 3.75Å; L105-L124 HydrophobicContact CB-CD2 4.43Å; L105-H126 PolarHBondContact N-O 3.04Å; L105-L127 HydrophobicContact CB-CD1 4.19Å; L105-L127 HydrophobicContact CD2-CD1 3.87Å; L105-L127 HydrophobicContact CG-CD1 4.02Å; L105-L127 WeakPolarHBondContact O-CA 3.47Å; L105-D128 PolarHBondContact O-N 3.21Å
106	N	96.3	Very high	93.3	Very high	3 Å²	3	45 Å²	45	2%	0.016	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	123.1	172	-179.1	11.6	0	0	0	111.2	L83 N84 L85 W104 S108 D128	L83-N106 PolarHBondContact O-N 2.92Å; N84-N106 PolarHBondContact OD1-ND2 2.92Å; L85-N106 PolarHBondContact N-O 3.25Å; W104-N106 HydrophobicContact CE3-CB 4.15Å; W104-N106 HydrophobicContact CH2-CB 3.26Å; W104-N106 HydrophobicContact CZ2-CB 3.96Å; W104-N106 HydrophobicContact CZ3-CB 3.34Å; N106-S108 WeakPolarHBondContact OD1-CB 3.41Å; N106-S108 PolarHBondContact OD1-N 3.22Å; N106-S108 PolarHBondContact OD1-OG 3Å; N106-D128 HydrophobicContact CB-CB 4.12Å
107	L	95.6	Very high	93.1	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	24%	0.244	C	C	.	.			trans	-128.2	22.5	179.5	-74.3	163.7	0	0	0	111	M71 L85 I90 I93 L105 N110 I112 D128 L129 N132	M71-L107 HydrophobicContact CE-CD2 4.14Å; M71-L107 HydrophobicContact SD-CD2 4.05Å; L85-L107 HydrophobicContact CB-CD2 4.07Å; L85-L107 HydrophobicContact CD1-CD2 4.05Å; I90-L107 HydrophobicContact CD1-CD2 3.83Å; I93-L107 HydrophobicContact CD1-CD1 4.34Å; I93-L107 HydrophobicContact CG1-CD1 4.26Å; L105-L107 HydrophobicContact CD1-CD1 4.03Å; L105-L107 HydrophobicContact CD1-CG 3.98Å; L105-L107 HydrophobicContact CD2-CD1 3.91Å; L105-L107 HydrophobicContact CG-CD1 3.99Å; L105-L107 HydrophobicContact CG-CG 4.24Å; L107-N110 WeakPolarHBondContact O-CB 3.3Å; L107-N110 PolarHBondContact O-ND2 3.1Å; L107-I112 HydrophobicContact CB-CD1 3.85Å; L107-I112 HydrophobicContact CD1-CD1 3.97Å; L107-I112 HydrophobicContact CD2-CD1 4.31Å; L107-I112 HydrophobicContact CG-CD1 4.27Å; L107-D128 PolarHBondContact N-O 3.2Å; L107-L129 HydrophobicContact CB-CD2 3.9Å; L107-L129 HydrophobicContact CD1-CD2 4.03Å; L107-N132 PolarHBondContact O-ND2 2.97Å
108	S	96.3	Very high	93.1	Very high	17 Å²	17	40.6 Å²	40.6	12%	0.119	21%	0.212	C	C	.	.			trans	-65.2	155.4	-176.9	70.6	0	0	0	0	113.7	P86 N87 N106 N110 S130	P86-S108 CarbonylContact C-O 3.59Å; P86-S108 WeakPolarHBondContact CA-O 3.21Å; P86-S108 WeakPolarHBondContact CB-OG 3.35Å; N87-S108 PolarHBondContact N-O 2.97Å; N106-S108 WeakPolarHBondContact OD1-CB 3.41Å; N106-S108 PolarHBondContact OD1-N 3.22Å; N106-S108 PolarHBondContact OD1-OG 3Å; S108-N110 PolarHBondContact O-ND2 3.46Å; S108-S130 CarbonylContact C-O 3.6Å; S108-S130 WeakPolarHBondContact CA-O 3.18Å; S108-S130 WeakPolarHBondContact CB-O 3.25Å; S108-S130 WeakPolarHBondContact CB-OG 3.11Å
109	G	93.8	Very high	93.1	Very high	19 Å²	19	40 Å²	40	20%	0.196	21%	0.208	C	C	.	.	S	Bend	trans	60.4	52.3	-179.2	0	0	0	0	0	112.2	N87 N88 S130 D131	N87-G109 VanDerWaalsContact CA-O 3.23Å; N87-G109 WeakPolarHBondContact CA-O 3.33Å; N87-G109 PolarHBondContact N-O 3.29Å; N88-G109 PolarHBondContact N-O 3.05Å; N88-G109 VanDerWaalsContact N-O 3.12Å; G109-S130 PolarHBondContact N-O 3.17Å; G109-S130 VanDerWaalsContact N-O 3.07Å; G109-D131 WeakPolarHBondContact CA-O 3.4Å; G109-D131 PolarHBondContact N-O 3.08Å; G109-D131 VanDerWaalsContact N-O 3.16Å
110	N	96	Very high	93	Very high	6 Å²	6	42 Å²	42	3%	0.032	22%	0.222	C	C	.	.	S	Bend	trans	-134.4	-174.5	179.5	-84	-84.2	0	0	0	110.3	L85 N88 S89 I90 L107 S108 I112 D131 N132	L85-N110 PolarHBondContact O-ND2 3.33Å; L85-N110 VanDerWaalsContact O-ND2 3.15Å; N88-N110 VanDerWaalsContact C-OD1 3.24Å; N88-N110 WeakPolarHBondContact CA-OD1 3.42Å; N88-N110 WeakPolarHBondContact CB-OD1 3.25Å; S89-N110 PolarHBondContact N-OD1 2.95Å; I90-N110 HydrophobicContact CB-CB 4.45Å; I90-N110 VanDerWaalsContact CB-OD1 3.31Å; I90-N110 WeakPolarHBondContact CB-OD1 3.2Å; I90-N110 WeakPolarHBondContact CG1-OD1 3.43Å; I90-N110 PolarHBondContact N-OD1 3.43Å; L107-N110 WeakPolarHBondContact O-CB 3.3Å; L107-N110 PolarHBondContact O-ND2 3.1Å; S108-N110 PolarHBondContact O-ND2 3.46Å; N110-I112 HydrophobicContact CB-CD1 4.46Å; N110-I112 HydrophobicContact CB-CG1 4.29Å; N110-D131 PolarHBondContact N-O 2.92Å; N110-N132 VanDerWaalsContact CB-OD1 3.31Å; N110-N132 WeakPolarHBondContact CB-OD1 3.13Å; N110-N132 PolarHBondContact O-OD1 3.29Å
111	N	95.1	Very high	93.1	Very high	72 Å²	72	39.3 Å²	39.3	39%	0.385	20%	0.204	S	C	.	.			trans	-112.3	27.9	-175.4	-61.9	102.4	0	0	0	112.4	S89 I90 K113 N132	S89-N111 WeakPolarHBondContact CA-OD1 3.4Å; I90-N111 CarbonylContact O-C 3.54Å; I90-N111 PolarHBondContact O-N 3.33Å; N111-K113 PolarHBondContact O-N 2.87Å; N111-N132 PolarHBondContact N-OD1 3.29Å
112	I	95.9	Very high	93	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.207	C	C	.	.			trans	-70.2	129.7	-176.7	-57.2	170.6	0	0	0	109.1	I90 I93 L107 N110 V114 L129 N132 N133 I134	I90-I112 HydrophobicContact CG2-CG1 4.49Å; I90-I112 WeakPolarHBondContact O-CG1 3.37Å; I90-I112 PolarHBondContact O-N 2.87Å; I93-I112 HydrophobicContact CD1-CG2 4.43Å; I93-I112 HydrophobicContact CG1-CD1 4.04Å; I93-I112 HydrophobicContact CG1-CG2 4.14Å; L107-I112 HydrophobicContact CB-CD1 3.85Å; L107-I112 HydrophobicContact CD1-CD1 3.97Å; L107-I112 HydrophobicContact CD2-CD1 4.31Å; L107-I112 HydrophobicContact CG-CD1 4.27Å; N110-I112 HydrophobicContact CB-CD1 4.46Å; N110-I112 HydrophobicContact CB-CG1 4.29Å; I112-V114 WeakPolarHBondContact CG2-O 3.11Å; I112-L129 HydrophobicContact CD1-CD2 3.86Å; I112-N132 VanDerWaalsContact CB-OD1 3.22Å; I112-N132 WeakPolarHBondContact CB-OD1 3.19Å; I112-N132 WeakPolarHBondContact CG1-OD1 3.42Å; I112-N132 PolarHBondContact N-OD1 2.99Å; I112-N133 CarbonylContact O-C 3.33Å; I112-N133 WeakPolarHBondContact O-CA 3.34Å; I112-N133 PolarHBondContact O-N 2.92Å; I112-I134 HydrophobicContact CG2-CG1 4.41Å; I112-I134 WeakPolarHBondContact O-CG1 3.3Å; I112-I134 PolarHBondContact O-N 2.97Å
113	K	93.9	Very high	92.9	Very high	134 Å²	134	41.6 Å²	41.6	58%	0.583	22%	0.224	S	C	*	.			trans	-106.4	-22.2	-179	-61.8	-168.2	177.5	-167.5	0	114.9	N111 N133	N111-K113 PolarHBondContact O-N 2.87Å; K113-N133 WeakPolarHBondContact CA-O 3.25Å; K113-N133 HydrophobicContact CG-CB 4.02Å
114	V	93.1	Very high	92.9	Very high	78 Å²	78	39.5 Å²	39.5	47%	0.473	21%	0.212	S	C	.	.	S	Bend	trans	-142	135.4	-176	-163.5	0	0	0	0	109.5	I112 E116	I112-V114 WeakPolarHBondContact CG2-O 3.11Å; V114-E116 HydrophobicContact CG1-CG 3.94Å; V114-E116 PolarHBondContact O-N 3.31Å
115	I	92.6	Very high	92.8	Very high	4 Å²	4	41.3 Å²	41.3	2%	0.021	22%	0.222	C	C	.	.			trans	-85.4	102.5	174.5	-52.9	-179.3	0	0	0	108.5	L118 L129 I134 L140 L151	I115-L118 HydrophobicContact CG2-CD1 3.65Å; I115-L129 HydrophobicContact CD1-CD1 3.95Å; I115-L129 HydrophobicContact CG1-CD1 4.09Å; I115-L129 HydrophobicContact CG2-CD1 4.36Å; I115-I134 HydrophobicContact CD1-CD1 4.12Å; I115-I134 HydrophobicContact CD1-CG2 4.05Å; I115-I134 HydrophobicContact CG1-CD1 3.86Å; I115-I134 HydrophobicContact CG1-CG1 4.33Å; I115-I134 HydrophobicContact CG1-CG2 3.89Å; I115-L140 HydrophobicContact CG2-CD2 3.63Å; I115-L140 HydrophobicContact CG2-CG 4.31Å; I115-L151 HydrophobicContact CD1-CD2 3.89Å
116	E	89.9	Confident	92.8	Very high	120 Å²	120	42.4 Å²	42.4	56%	0.561	23%	0.228	S	C	*	.			trans	-136.3	172.8	178.1	-75.7	-171.2	-168.1	0	0	111.7	V114 L118	V114-E116 HydrophobicContact CG1-CG 3.94Å; V114-E116 PolarHBondContact O-N 3.31Å; E116-L118 PolarHBondContact O-N 3.18Å
117	Q	86.2	Confident	92.9	Very high	87 Å²	87	42.3 Å²	42.3	41%	0.407	23%	0.227	S	C	.	.	S	Bend	trans	62.9	-4.6	171.4	-48.9	-167.4	27.8	0	0	117.3	I93 N119	I93-Q117 PolarHBondContact O-NE2 2.97Å; Q117-N119 PolarHBondContact O-N 3.5Å
118	L	89.8	Confident	92.9	Very high	2 Å²	2	42.5 Å²	42.5	1%	0.01	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-68	-14.4	174.9	-70.2	165.6	0	0	0	114.5	I93 L96 L105 I115 E116 S120 C121 L124 L127 L140 L143	I93-L118 HydrophobicContact CD1-CD1 4.08Å; I93-L118 HydrophobicContact CD1-CG 4.29Å; L96-L118 HydrophobicContact CD1-CD2 3.51Å; L105-L118 HydrophobicContact CD2-CD2 3.66Å; I115-L118 HydrophobicContact CG2-CD1 3.65Å; E116-L118 PolarHBondContact O-N 3.18Å; L118-S120 PolarHBondContact O-N 3.15Å; L118-C121 PolarHBondContact O-N 3.39Å; L118-L124 HydrophobicContact CD2-CD2 4.49Å; L118-L127 HydrophobicContact CD1-CD2 3.67Å; L118-L140 HydrophobicContact CB-CD2 4.27Å; L118-L140 HydrophobicContact CD1-CD2 3.75Å; L118-L143 HydrophobicContact CB-CD1 4.44Å; L118-L143 WeakPolarHBondContact O-CD2 3.39Å
119	N	87.1	Confident	92.9	Very high	61 Å²	61	41.7 Å²	41.7	33%	0.326	22%	0.222	S	C	.	.	G	3₁₀ helix	trans	-52.7	-3.4	-176.3	-88.6	-39.4	0	0	0	117.4	Q117 K142	Q117-N119 PolarHBondContact O-N 3.5Å; N119-K142 HydrophobicContact CB-CD 4.19Å; N119-K142 PolarHBondContact ND2-NZ 3Å; N119-K142 WeakPolarHBondContact OD1-CD 3.45Å; N119-K142 PolarHBondContact OD1-NZ 2.77Å
120	S	87.3	Confident	93	Very high	43 Å²	43	40.9 Å²	40.9	30%	0.301	21%	0.214	S	C	.	.	G	3₁₀ helix	trans	-108.6	-15.8	177.8	-58.6	0	0	0	0	114	R97 L118 V122	R97-S120 WeakPolarHBondContact O-CB 3.41Å; R97-S120 PolarHBondContact O-OG 3.12Å; L118-S120 PolarHBondContact O-N 3.15Å; S120-V122 VanDerWaalsContact C-N 3.25Å; S120-V122 PolarHBondContact O-N 3.19Å
121	C	91.3	Very high	93	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.233	C	C	.	.			trans	-85.9	56.7	-176.1	-60.6	0	0	0	0	111.6	L118 C123 L124 L143	L118-C121 PolarHBondContact O-N 3.39Å; C121-C123 PolarHBondContact O-N 2.9Å; C121-L124 HydrophobicContact CB-CB 4.11Å; C121-L124 WeakPolarHBondContact O-CB 3.09Å; C121-L124 PolarHBondContact O-N 3.16Å; C121-L143 HydrophobicContact CB-CD2 4.31Å; C121-L143 VanDerWaalsContact O-CD2 3.28Å; C121-L143 WeakPolarHBondContact O-CD2 3.33Å
122	V	89.6	Confident	93.1	Very high	69 Å²	69	41.2 Å²	41.2	42%	0.418	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-29.2	-172.3	-174.5	0	0	0	0	112.8	S120 L124 A145	S120-V122 VanDerWaalsContact C-N 3.25Å; S120-V122 PolarHBondContact O-N 3.19Å; V122-L124 VanDerWaalsContact C-N 3.32Å; V122-L124 PolarHBondContact O-N 3.07Å; V122-A145 WeakPolarHBondContact O-CB 3.31Å
123	C	92.9	Very high	93	Very high	55 Å²	55	44.5 Å²	44.5	37%	0.372	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	2.8	176.8	-63.9	0	0	0	0	115.3	S100 L102 T103 C121 Q125	S100-C123 WeakPolarHBondContact O-CB 3.23Å; S100-C123 PolarHBondContact O-SG 2.85Å; L102-C123 CarbonylContact O-C 3.18Å; L102-C123 VanDerWaalsContact O-C 3.3Å; T103-C123 HydrophobicContact CG2-CB 4.46Å; C121-C123 PolarHBondContact O-N 2.9Å; C123-Q125 PolarHBondContact O-N 2.87Å
124	L	95	Very high	93.1	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.205	C	C	.	.			trans	-70.1	117.4	-175.5	-166.9	74	0	0	0	111.3	L102 L105 L118 C121 V122 L127 L143 A145 L146	L102-L124 HydrophobicContact CD2-CD1 4.16Å; L102-L124 HydrophobicContact CG-CD1 3.97Å; L102-L124 WeakPolarHBondContact O-CA 3.39Å; L102-L124 PolarHBondContact O-N 3.2Å; L102-L124 VanDerWaalsContact O-N 3.15Å; L105-L124 HydrophobicContact CB-CD1 3.75Å; L105-L124 HydrophobicContact CB-CD2 4.43Å; L118-L124 HydrophobicContact CD2-CD2 4.49Å; C121-L124 HydrophobicContact CB-CB 4.11Å; C121-L124 WeakPolarHBondContact O-CB 3.09Å; C121-L124 PolarHBondContact O-N 3.16Å; V122-L124 VanDerWaalsContact C-N 3.32Å; V122-L124 PolarHBondContact O-N 3.07Å; L124-L127 HydrophobicContact CD2-CB 4.03Å; L124-L127 HydrophobicContact CD2-CD1 4.28Å; L124-L127 HydrophobicContact CD2-CD2 4.38Å; L124-L127 HydrophobicContact CD2-CG 4.47Å; L124-L143 HydrophobicContact CB-CD2 4.35Å; L124-L143 HydrophobicContact CD2-CD1 4.09Å; L124-A145 CarbonylContact O-C 3.33Å; L124-A145 VanDerWaalsContact O-C 3.31Å; L124-L146 HydrophobicContact CD2-CD1 4.48Å; L124-L146 HydrophobicContact CG-CD1 4.48Å; L124-L146 WeakPolarHBondContact O-CA 3.3Å; L124-L146 PolarHBondContact O-N 2.89Å
125	Q	95.4	Very high	93.1	Very high	97 Å²	97	37.6 Å²	37.6	45%	0.453	21%	0.205	S	C	.	.			trans	-100.4	-29.3	-178.2	-61.2	-178.7	13.8	0	0	112.7	T103 C123 A145 K147 T148	T103-Q125 PolarHBondContact O-N 3Å; C123-Q125 PolarHBondContact O-N 2.87Å; Q125-A145 WeakPolarHBondContact CA-O 3.24Å; Q125-A145 HydrophobicContact CG-CB 4.24Å; Q125-K147 PolarHBondContact O-N 3.48Å; Q125-T148 PolarHBondContact O-N 3.39Å
126	H	96.4	Very high	93	Very high	24 Å²	24	39.7 Å²	39.7	11%	0.111	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	126.2	-179.2	-173	-32.1	0	0	0	110.4	T103 W104 L105 T148	T103-H126 PolarHBondContact O-N 3.13Å; W104-H126 VanDerWaalsContact CD1-CB 3.5Å; W104-H126 AromaticContact CD1-CD2 3.59Å; W104-H126 AromaticContact CD1-CG 3.56Å; W104-H126 HydrophobicContact CG-CB 4.26Å; W104-H126 AromaticContact NE1-CD2 3.28Å; W104-H126 PolarHBondContact NE1-CD2 2.97Å; W104-H126 VanDerWaalsContact NE1-CD2 3.28Å; W104-H126 AromaticContact NE1-CG 3.56Å; W104-H126 AromaticContact NE1-NE2 3.62Å; L105-H126 PolarHBondContact N-O 3.04Å; H126-T148 WeakPolarHBondContact CA-O 3.46Å
127	L	96.8	Very high	93.1	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	117.3	175.3	179.4	53.9	0	0	0	109.2	L105 L118 L124 L129 L140 L143 L146 T148 L149 L150	L105-L127 HydrophobicContact CB-CD1 4.19Å; L105-L127 HydrophobicContact CD2-CD1 3.87Å; L105-L127 HydrophobicContact CG-CD1 4.02Å; L105-L127 WeakPolarHBondContact O-CA 3.47Å; L118-L127 HydrophobicContact CD1-CD2 3.67Å; L124-L127 HydrophobicContact CD2-CB 4.03Å; L124-L127 HydrophobicContact CD2-CD1 4.28Å; L124-L127 HydrophobicContact CD2-CD2 4.38Å; L124-L127 HydrophobicContact CD2-CG 4.47Å; L127-L129 HydrophobicContact CD1-CD1 3.94Å; L127-L129 HydrophobicContact CD1-CG 3.86Å; L127-L129 HydrophobicContact CD2-CD1 3.76Å; L127-L129 HydrophobicContact CG-CD1 3.8Å; L127-L129 HydrophobicContact CG-CG 4.02Å; L127-L140 HydrophobicContact CD2-CD1 4.2Å; L127-L143 HydrophobicContact CD2-CD1 4.49Å; L127-L146 HydrophobicContact CB-CD1 3.84Å; L127-T148 PolarHBondContact N-O 2.83Å; L127-L149 HydrophobicContact CB-CD1 4.15Å; L127-L149 HydrophobicContact CD2-CD1 3.92Å; L127-L149 HydrophobicContact CG-CD1 4.02Å; L127-L149 WeakPolarHBondContact O-CA 3.29Å; L127-L150 PolarHBondContact O-N 2.87Å
128	D	96.8	Very high	93.1	Very high	4 Å²	4	30.6 Å²	30.6	2%	0.021	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	114.3	172.5	-162.6	-18.1	0	0	0	109.5	L105 N106 L107 S130 L150	L105-D128 PolarHBondContact O-N 3.21Å; N106-D128 HydrophobicContact CB-CB 4.12Å; L107-D128 PolarHBondContact N-O 3.2Å; D128-S130 WeakPolarHBondContact OD1-CB 3.47Å; D128-S130 PolarHBondContact OD1-N 2.68Å; D128-S130 VanDerWaalsContact OD1-N 3.16Å; D128-S130 PolarHBondContact OD1-OG 3.33Å; D128-L150 HydrophobicContact CB-CD1 4.45Å
129	L	96.1	Very high	93.2	Very high	0 Å²	0	33 Å²	33	0%	0	20%	0.197	C	C	.	.			trans	-127	24.5	179.4	-77.3	168.4	0	0	0	110.3	I93 L107 I112 I115 L127 I134 L150 L151 N154	I93-L129 HydrophobicContact CD1-CD2 4.29Å; L107-L129 HydrophobicContact CB-CD2 3.9Å; L107-L129 HydrophobicContact CD1-CD2 4.03Å; I112-L129 HydrophobicContact CD1-CD2 3.86Å; I115-L129 HydrophobicContact CD1-CD1 3.95Å; I115-L129 HydrophobicContact CG1-CD1 4.09Å; I115-L129 HydrophobicContact CG2-CD1 4.36Å; L127-L129 HydrophobicContact CD1-CD1 3.94Å; L127-L129 HydrophobicContact CD1-CG 3.86Å; L127-L129 HydrophobicContact CD2-CD1 3.76Å; L127-L129 HydrophobicContact CG-CD1 3.8Å; L127-L129 HydrophobicContact CG-CG 4.02Å; L129-I134 HydrophobicContact CB-CD1 3.91Å; L129-I134 HydrophobicContact CD1-CD1 4.23Å; L129-I134 HydrophobicContact CD2-CD1 4.33Å; L129-I134 HydrophobicContact CG-CD1 4.4Å; L129-L150 CarbonylContact C-O 3.44Å; L129-L150 WeakPolarHBondContact CA-O 3.12Å; L129-L150 PolarHBondContact N-O 2.64Å; L129-L151 HydrophobicContact CB-CD2 3.77Å; L129-L151 HydrophobicContact CD1-CD2 4.21Å; L129-N154 PolarHBondContact O-ND2 3.42Å
130	S	95.9	Very high	93.4	Very high	3 Å²	3	30.1 Å²	30.1	2%	0.021	18%	0.182	C	C	.	.			trans	-64.2	159.2	178.1	50.3	0	0	0	0	113.2	S108 G109 D128 N132 L150 H152	S108-S130 CarbonylContact C-O 3.6Å; S108-S130 WeakPolarHBondContact CA-O 3.18Å; S108-S130 WeakPolarHBondContact CB-O 3.25Å; S108-S130 WeakPolarHBondContact CB-OG 3.11Å; G109-S130 PolarHBondContact N-O 3.17Å; G109-S130 VanDerWaalsContact N-O 3.07Å; D128-S130 WeakPolarHBondContact OD1-CB 3.47Å; D128-S130 PolarHBondContact OD1-N 2.68Å; D128-S130 VanDerWaalsContact OD1-N 3.16Å; D128-S130 PolarHBondContact OD1-OG 3.33Å; S130-N132 PolarHBondContact O-N 2.96Å; S130-N132 PolarHBondContact O-ND2 2.8Å; S130-L150 PolarHBondContact N-O 2.83Å; S130-H152 CarbonylContact C-O 3.6Å; S130-H152 WeakPolarHBondContact CA-O 3.43Å; S130-H152 WeakPolarHBondContact CB-CE1 3.22Å; S130-H152 VanDerWaalsContact CB-ND1 3.35Å; S130-H152 WeakPolarHBondContact CB-ND1 3.41Å; S130-H152 WeakPolarHBondContact CB-NE2 3.39Å
131	D	95.7	Very high	93.4	Very high	79 Å²	79	31 Å²	31	42%	0.422	19%	0.185	S	C	.	.	S	Bend	trans	53.3	57.9	173.2	-48.6	-24.5	0	0	0	111.7	G109 N110 H152 G153	G109-D131 WeakPolarHBondContact CA-O 3.4Å; G109-D131 PolarHBondContact N-O 3.08Å; G109-D131 VanDerWaalsContact N-O 3.16Å; N110-D131 PolarHBondContact N-O 2.92Å; D131-H152 PolarHBondContact N-O 2.66Å; D131-H152 IonicContact OD1-CE1 3.74Å; D131-H152 IonicContact OD1-ND1 3.71Å; D131-H152 PolarHBondContact OD1-ND1 2.93Å; D131-G153 CarbonylContact C-O 3.33Å; D131-G153 WeakPolarHBondContact CA-O 3.45Å; D131-G153 PolarHBondContact N-O 2.74Å
132	N	96.4	Very high	93.3	Very high	6 Å²	6	35.1 Å²	35.1	3%	0.032	20%	0.204	C	C	.	.	S	Bend	trans	-138.1	-173.2	-175	-92.5	-89.9	0	0	0	110.4	L107 N110 N111 I112 S130 I134 G153 N154	L107-N132 PolarHBondContact O-ND2 2.97Å; N110-N132 VanDerWaalsContact CB-OD1 3.31Å; N110-N132 WeakPolarHBondContact CB-OD1 3.13Å; N110-N132 PolarHBondContact O-OD1 3.29Å; N111-N132 PolarHBondContact N-OD1 3.29Å; I112-N132 VanDerWaalsContact CB-OD1 3.22Å; I112-N132 WeakPolarHBondContact CB-OD1 3.19Å; I112-N132 WeakPolarHBondContact CG1-OD1 3.42Å; I112-N132 PolarHBondContact N-OD1 2.99Å; S130-N132 PolarHBondContact O-N 2.96Å; S130-N132 PolarHBondContact O-ND2 2.8Å; N132-I134 HydrophobicContact CB-CD1 4.32Å; N132-I134 HydrophobicContact CB-CG1 4.33Å; N132-G153 PolarHBondContact N-O 2.66Å; N132-N154 VanDerWaalsContact CB-OD1 3.25Å; N132-N154 WeakPolarHBondContact CB-OD1 3.49Å; N132-N154 PolarHBondContact O-OD1 2.93Å
133	N	95.3	Very high	93.4	Very high	68 Å²	68	31.9 Å²	31.9	36%	0.364	18%	0.184	S	C	.	.			trans	-114.6	33.3	-177.5	-60.8	131.9	0	0	0	112.8	I112 K113	I112-N133 CarbonylContact O-C 3.33Å; I112-N133 WeakPolarHBondContact O-CA 3.34Å; I112-N133 PolarHBondContact O-N 2.92Å; K113-N133 WeakPolarHBondContact CA-O 3.25Å; K113-N133 HydrophobicContact CG-CB 4.02Å
134	I	95.9	Very high	93.2	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.198	C	C	.	.			trans	-76	124.8	-177.4	-58.1	163.2	0	0	0	109.5	I112 I115 L129 N132 A136 L151 N154 S155 I156	I112-I134 HydrophobicContact CG2-CG1 4.41Å; I112-I134 WeakPolarHBondContact O-CG1 3.3Å; I112-I134 PolarHBondContact O-N 2.97Å; I115-I134 HydrophobicContact CD1-CD1 4.12Å; I115-I134 HydrophobicContact CD1-CG2 4.05Å; I115-I134 HydrophobicContact CG1-CD1 3.86Å; I115-I134 HydrophobicContact CG1-CG1 4.33Å; I115-I134 HydrophobicContact CG1-CG2 3.89Å; L129-I134 HydrophobicContact CB-CD1 3.91Å; L129-I134 HydrophobicContact CD1-CD1 4.23Å; L129-I134 HydrophobicContact CD2-CD1 4.33Å; L129-I134 HydrophobicContact CG-CD1 4.4Å; N132-I134 HydrophobicContact CB-CD1 4.32Å; N132-I134 HydrophobicContact CB-CG1 4.33Å; I134-A136 VanDerWaalsContact CG2-O 3.32Å; I134-A136 WeakPolarHBondContact CG2-O 3.49Å; I134-L151 HydrophobicContact CD1-CD2 4Å; I134-N154 WeakPolarHBondContact CB-OD1 3.12Å; I134-N154 WeakPolarHBondContact CG1-OD1 3.37Å; I134-N154 PolarHBondContact N-OD1 2.85Å; I134-S155 CarbonylContact O-C 3.31Å; I134-S155 VanDerWaalsContact O-C 3.29Å; I134-S155 WeakPolarHBondContact O-CA 3.47Å; I134-S155 PolarHBondContact O-N 3.15Å; I134-I156 PolarHBondContact O-N 3.06Å
135	S	92.4	Very high	93	Very high	67 Å²	67	37.5 Å²	37.5	47%	0.469	21%	0.21	S	C	.	.			trans	-101	-17.3	-179.7	58.6	0	0	0	0	114.7	S155	S135-S155 WeakPolarHBondContact CA-O 3.31Å
136	A	90.9	Very high	93	Very high	49 Å²	49	32.9 Å²	32.9	41%	0.405	19%	0.188	S	C	.	.	S	Bend	trans	-149.3	143	179.6	0	0	0	0	0	111.6	I134 G138	I134-A136 VanDerWaalsContact CG2-O 3.32Å; I134-A136 WeakPolarHBondContact CG2-O 3.49Å; A136-G138 PolarHBondContact O-N 2.88Å
137	I	91.1	Very high	92.9	Very high	2 Å²	2	37.5 Å²	37.5	1%	0.01	21%	0.208	C	C	.	.			trans	-73.7	115	175.3	-60.9	170.6	0	0	0	108.6	L151 I156 L159 T161 V162 H165 L166 L175	I137-L151 HydrophobicContact CD1-CD1 4.39Å; I137-L151 HydrophobicContact CG1-CD1 4.16Å; I137-I156 HydrophobicContact CG1-CD1 4.04Å; I137-L159 HydrophobicContact CD1-CD2 4.15Å; I137-T161 PolarHBondContact O-OG1 2.89Å; I137-V162 HydrophobicContact CD1-CG2 3.63Å; I137-H165 HydrophobicContact CG2-CB 4.47Å; I137-H165 PolarHBondContact O-ND1 3.4Å; I137-L166 HydrophobicContact CG2-CD2 3.65Å; I137-L166 HydrophobicContact CG2-CG 4.15Å; I137-L175 HydrophobicContact CD1-CD2 4.4Å
138	G	87.9	Confident	92.9	Very high	13 Å²	13	38.5 Å²	38.5	13%	0.134	21%	0.214	C	C	.	.			trans	-78	172.2	175.9	0	0	0	0	0	113.4	A136 L140 H165	A136-G138 PolarHBondContact O-N 2.88Å; G138-L140 PolarHBondContact O-N 2.88Å; G138-L140 VanDerWaalsContact O-N 3.15Å; G138-H165 WeakPolarHBondContact O-CB 3.4Å
139	D	90.1	Very high	92.9	Very high	53 Å²	53	38.3 Å²	38.3	28%	0.283	21%	0.213	S	C	.	.			trans	-64.6	109.6	179.5	172.8	27.7	0	0	0	111.7	T141 K142	D139-T141 WeakPolarHBondContact OD1-CB 3.25Å; D139-T141 WeakPolarHBondContact OD1-CG2 3.46Å; D139-T141 PolarHBondContact OD1-N 3.01Å; D139-T141 PolarHBondContact OD1-OG1 2.88Å; D139-K142 IonicContact OD2-NZ 2.82Å; D139-K142 PolarHBondContact OD2-NZ 2.89Å
140	L	91.3	Very high	92.9	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.005	22%	0.219	C	C	.	.			trans	-114	11.3	173.5	-61.5	-173.7	0	0	0	112.3	I115 L118 L127 G138 K142 L143 L146 L149 H165 L166	I115-L140 HydrophobicContact CG2-CD2 3.63Å; I115-L140 HydrophobicContact CG2-CG 4.31Å; L118-L140 HydrophobicContact CB-CD2 4.27Å; L118-L140 HydrophobicContact CD1-CD2 3.75Å; L127-L140 HydrophobicContact CD2-CD1 4.2Å; G138-L140 PolarHBondContact O-N 2.88Å; G138-L140 VanDerWaalsContact O-N 3.15Å; L140-K142 PolarHBondContact O-N 2.96Å; L140-L143 HydrophobicContact CB-CD1 4.2Å; L140-L143 HydrophobicContact CD2-CD1 3.8Å; L140-L143 HydrophobicContact CG-CD1 4.4Å; L140-L143 WeakPolarHBondContact O-CB 3.18Å; L140-L143 PolarHBondContact O-N 3.01Å; L140-L146 HydrophobicContact CD1-CD2 4.31Å; L140-L149 HydrophobicContact CD1-CD1 4.25Å; L140-L149 HydrophobicContact CD1-CD2 3.97Å; L140-H165 CarbonylContact C-O 3.17Å; L140-H165 VanDerWaalsContact CA-O 3.3Å; L140-H165 WeakPolarHBondContact CA-O 3.42Å; L140-H165 WeakPolarHBondContact CB-O 3.47Å; L140-H165 PolarHBondContact N-O 3.31Å; L140-L166 HydrophobicContact CB-CD2 4.29Å; L140-L166 HydrophobicContact CD1-CD2 3.96Å; L140-L166 HydrophobicContact CG-CD2 4.46Å
141	T	88.9	Confident	92.9	Very high	61 Å²	61	39.3 Å²	39.3	37%	0.374	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-27.1	-173.4	54.4	0	0	0	0	114.3	D139 L143 A164 H165	D139-T141 WeakPolarHBondContact OD1-CB 3.25Å; D139-T141 WeakPolarHBondContact OD1-CG2 3.46Å; D139-T141 PolarHBondContact OD1-N 3.01Å; D139-T141 PolarHBondContact OD1-OG1 2.88Å; T141-L143 VanDerWaalsContact C-N 3.32Å; T141-A164 WeakPolarHBondContact CG2-O 3.03Å; T141-H165 PolarHBondContact N-O 2.59Å
142	K	88.6	Confident	92.8	Very high	87 Å²	87	37.9 Å²	37.9	38%	0.378	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-2.9	-178.8	-53.9	-177.1	-161.3	63.2	0	113.6	N119 D139 L140 E144	N119-K142 HydrophobicContact CB-CD 4.19Å; N119-K142 PolarHBondContact ND2-NZ 3Å; N119-K142 WeakPolarHBondContact OD1-CD 3.45Å; N119-K142 PolarHBondContact OD1-NZ 2.77Å; D139-K142 IonicContact OD2-NZ 2.82Å; D139-K142 PolarHBondContact OD2-NZ 2.89Å; L140-K142 PolarHBondContact O-N 2.96Å; K142-E144 PolarHBondContact O-N 3.28Å; K142-E144 VanDerWaalsContact O-N 3.15Å
143	L	91.4	Very high	92.7	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.005	22%	0.217	C	C	.	.			trans	-86.8	62.7	173.1	-56.5	-174.3	0	0	0	109.7	L118 C121 L124 L127 L140 T141 A145 L146	L118-L143 HydrophobicContact CB-CD1 4.44Å; L118-L143 WeakPolarHBondContact O-CD2 3.39Å; C121-L143 HydrophobicContact CB-CD2 4.31Å; C121-L143 VanDerWaalsContact O-CD2 3.28Å; C121-L143 WeakPolarHBondContact O-CD2 3.33Å; L124-L143 HydrophobicContact CB-CD2 4.35Å; L124-L143 HydrophobicContact CD2-CD1 4.09Å; L127-L143 HydrophobicContact CD2-CD1 4.49Å; L140-L143 HydrophobicContact CB-CD1 4.2Å; L140-L143 HydrophobicContact CD2-CD1 3.8Å; L140-L143 HydrophobicContact CG-CD1 4.4Å; L140-L143 WeakPolarHBondContact O-CB 3.18Å; L140-L143 PolarHBondContact O-N 3.01Å; T141-L143 VanDerWaalsContact C-N 3.32Å; L143-A145 PolarHBondContact O-N 3.28Å; L143-A145 VanDerWaalsContact O-N 3.08Å; L143-L146 HydrophobicContact CB-CB 3.85Å; L143-L146 HydrophobicContact CB-CD2 4.39Å; L143-L146 HydrophobicContact CD1-CD2 4.1Å; L143-L146 VanDerWaalsContact O-CB 3.25Å; L143-L146 WeakPolarHBondContact O-CB 3.47Å; L143-L146 PolarHBondContact O-N 3.31Å
144	E	88.3	Confident	92.7	Very high	141 Å²	141	35.8 Å²	35.8	66%	0.659	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-25.8	-174.8	-64	177.5	-177.5	0	0	113.1	K142	K142-E144 PolarHBondContact O-N 3.28Å; K142-E144 VanDerWaalsContact O-N 3.15Å
145	A	92	Very high	92.7	Very high	31 Å²	31	37.6 Å²	37.6	26%	0.256	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-3.1	177.9	0	0	0	0	0	115.1	V122 L124 Q125 L143 K147	V122-A145 WeakPolarHBondContact O-CB 3.31Å; L124-A145 CarbonylContact O-C 3.33Å; L124-A145 VanDerWaalsContact O-C 3.31Å; Q125-A145 WeakPolarHBondContact CA-O 3.24Å; Q125-A145 HydrophobicContact CG-CB 4.24Å; L143-A145 PolarHBondContact O-N 3.28Å; L143-A145 VanDerWaalsContact O-N 3.08Å; A145-K147 PolarHBondContact O-N 3.35Å
146	L	94.5	Very high	92.8	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.192	C	C	.	.			trans	-73.8	114.2	-169.2	-172.9	72.7	0	0	0	112.4	L124 L127 L140 L143 L149 P167 L170	L124-L146 HydrophobicContact CD2-CD1 4.48Å; L124-L146 HydrophobicContact CG-CD1 4.48Å; L124-L146 WeakPolarHBondContact O-CA 3.3Å; L124-L146 PolarHBondContact O-N 2.89Å; L127-L146 HydrophobicContact CB-CD1 3.84Å; L140-L146 HydrophobicContact CD1-CD2 4.31Å; L143-L146 HydrophobicContact CB-CB 3.85Å; L143-L146 HydrophobicContact CB-CD2 4.39Å; L143-L146 HydrophobicContact CD1-CD2 4.1Å; L143-L146 VanDerWaalsContact O-CB 3.25Å; L143-L146 WeakPolarHBondContact O-CB 3.47Å; L143-L146 PolarHBondContact O-N 3.31Å; L146-L149 HydrophobicContact CD2-CB 4.38Å; L146-P167 HydrophobicContact CB-CG 4.13Å; L146-P167 HydrophobicContact CD2-CG 4.38Å; L146-L170 HydrophobicContact CD2-CD1 4.17Å; L146-L170 HydrophobicContact CG-CD1 4.05Å
147	K	94.9	Very high	92.9	Very high	122 Å²	122	35.2 Å²	35.2	53%	0.53	19%	0.192	S	C	.	.			trans	-103.2	-32.4	178.5	-63.5	-174.1	177.8	-170.7	0	113.1	Q125 A145 S171 I172	Q125-K147 PolarHBondContact O-N 3.48Å; A145-K147 PolarHBondContact O-N 3.35Å; K147-S171 PolarHBondContact O-N 3.34Å; K147-I172 PolarHBondContact O-N 2.86Å
148	T	96	Very high	92.9	Very high	21 Å²	21	37 Å²	37	13%	0.129	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	121	-174.5	-56.5	0	0	0	0	111.2	Q125 H126 L127 L150 I172	Q125-T148 PolarHBondContact O-N 3.39Å; H126-T148 WeakPolarHBondContact CA-O 3.46Å; L127-T148 PolarHBondContact N-O 2.83Å; T148-L150 HydrophobicContact CG2-CD2 4.13Å; T148-L150 HydrophobicContact CG2-CG 4.14Å; T148-I172 WeakPolarHBondContact CA-O 3.35Å; T148-I172 HydrophobicContact CG2-CB 4.1Å; T148-I172 HydrophobicContact CG2-CG2 4.07Å
149	L	96.7	Very high	93.1	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	111.3	176.1	178.4	56.5	0	0	0	110.2	L127 L140 L146 L151 L166 L170 I172 L173 S174	L127-L149 HydrophobicContact CB-CD1 4.15Å; L127-L149 HydrophobicContact CD2-CD1 3.92Å; L127-L149 HydrophobicContact CG-CD1 4.02Å; L127-L149 WeakPolarHBondContact O-CA 3.29Å; L140-L149 HydrophobicContact CD1-CD1 4.25Å; L140-L149 HydrophobicContact CD1-CD2 3.97Å; L146-L149 HydrophobicContact CD2-CB 4.38Å; L149-L151 HydrophobicContact CD1-CD1 4.12Å; L149-L151 HydrophobicContact CD1-CD2 4.37Å; L149-L151 HydrophobicContact CD1-CG 3.98Å; L149-L151 HydrophobicContact CD2-CD1 3.89Å; L149-L151 HydrophobicContact CG-CD1 3.86Å; L149-L151 HydrophobicContact CG-CG 4.04Å; L149-L166 HydrophobicContact CD2-CD1 4.18Å; L149-L166 HydrophobicContact CD2-CD2 3.61Å; L149-L170 HydrophobicContact CB-CD1 3.78Å; L149-L170 HydrophobicContact CB-CD2 4.18Å; L149-L170 HydrophobicContact CD2-CD2 4.34Å; L149-I172 PolarHBondContact N-O 2.95Å; L149-L173 HydrophobicContact CB-CD1 4.29Å; L149-L173 HydrophobicContact CD2-CD1 4.1Å; L149-L173 HydrophobicContact CG-CD1 4.14Å; L149-L173 WeakPolarHBondContact O-CA 3.28Å; L149-S174 PolarHBondContact O-N 2.82Å
150	L	96.4	Very high	93.1	Very high	23 Å²	23	39.8 Å²	39.8	12%	0.12	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	119	177.2	-52	-178.8	0	0	0	109.7	L127 D128 L129 S130 T148 I172	L127-L150 PolarHBondContact O-N 2.87Å; D128-L150 HydrophobicContact CB-CD1 4.45Å; L129-L150 CarbonylContact C-O 3.44Å; L129-L150 WeakPolarHBondContact CA-O 3.12Å; L129-L150 PolarHBondContact N-O 2.64Å; S130-L150 PolarHBondContact N-O 2.83Å; T148-L150 HydrophobicContact CG2-CD2 4.13Å; T148-L150 HydrophobicContact CG2-CG 4.14Å; L150-I172 HydrophobicContact CD2-CG2 4.33Å
151	L	95.8	Very high	93	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.218	C	C	.	.			trans	-130.8	22.6	-178.6	-68.8	167.4	0	0	0	111.4	I115 L129 I134 I137 L149 N154 I156 S174 L175 N178	I115-L151 HydrophobicContact CD1-CD2 3.89Å; L129-L151 HydrophobicContact CB-CD2 3.77Å; L129-L151 HydrophobicContact CD1-CD2 4.21Å; I134-L151 HydrophobicContact CD1-CD2 4Å; I137-L151 HydrophobicContact CD1-CD1 4.39Å; I137-L151 HydrophobicContact CG1-CD1 4.16Å; L149-L151 HydrophobicContact CD1-CD1 4.12Å; L149-L151 HydrophobicContact CD1-CD2 4.37Å; L149-L151 HydrophobicContact CD1-CG 3.98Å; L149-L151 HydrophobicContact CD2-CD1 3.89Å; L149-L151 HydrophobicContact CG-CD1 3.86Å; L149-L151 HydrophobicContact CG-CG 4.04Å; L151-N154 PolarHBondContact O-ND2 2.99Å; L151-I156 HydrophobicContact CB-CD1 4.02Å; L151-I156 HydrophobicContact CD1-CD1 4.04Å; L151-I156 HydrophobicContact CG-CD1 4.45Å; L151-S174 CarbonylContact C-O 3.47Å; L151-S174 VanDerWaalsContact CA-O 3.32Å; L151-S174 WeakPolarHBondContact CA-O 3.19Å; L151-S174 WeakPolarHBondContact CB-O 3.39Å; L151-S174 PolarHBondContact N-O 2.69Å; L151-L175 HydrophobicContact CB-CD2 4.36Å; L151-L175 HydrophobicContact CD1-CD2 4.34Å; L151-N178 PolarHBondContact O-ND2 2.96Å
152	H	94.4	Very high	93	Very high	50 Å²	50	38.9 Å²	38.9	23%	0.231	20%	0.2	C	C	.	.			trans	-66.6	158.3	176.8	61.3	83.2	0	0	0	112.2	S130 D131 N154 S174 A176	S130-H152 CarbonylContact C-O 3.6Å; S130-H152 WeakPolarHBondContact CA-O 3.43Å; S130-H152 WeakPolarHBondContact CB-CE1 3.22Å; S130-H152 VanDerWaalsContact CB-ND1 3.35Å; S130-H152 WeakPolarHBondContact CB-ND1 3.41Å; S130-H152 WeakPolarHBondContact CB-NE2 3.39Å; D131-H152 PolarHBondContact N-O 2.66Å; D131-H152 IonicContact OD1-CE1 3.74Å; D131-H152 IonicContact OD1-ND1 3.71Å; D131-H152 PolarHBondContact OD1-ND1 2.93Å; H152-N154 PolarHBondContact O-ND2 2.76Å; H152-S174 PolarHBondContact N-O 2.58Å; H152-A176 CarbonylContact C-O 3.56Å; H152-A176 WeakPolarHBondContact CA-O 3.32Å; H152-A176 HydrophobicContact CB-CB 4.02Å; H152-A176 WeakPolarHBondContact CB-O 3.3Å
153	G	93.4	Very high	93	Very high	19 Å²	19	37.9 Å²	37.9	20%	0.196	20%	0.203	C	C	.	.	S	Bend	trans	62.3	48.3	179.2	0	0	0	0	0	112.6	D131 N132 A176 E177	D131-G153 CarbonylContact C-O 3.33Å; D131-G153 WeakPolarHBondContact CA-O 3.45Å; D131-G153 PolarHBondContact N-O 2.74Å; N132-G153 PolarHBondContact N-O 2.66Å; G153-A176 PolarHBondContact N-O 3.42Å; G153-A176 VanDerWaalsContact N-O 3.16Å; G153-E177 VanDerWaalsContact CA-O 3.27Å; G153-E177 WeakPolarHBondContact CA-O 3.42Å; G153-E177 PolarHBondContact N-O 3.29Å
154	N	96.3	Very high	92.9	Very high	10 Å²	10	41 Å²	41	5%	0.053	23%	0.228	C	C	.	.	S	Bend	trans	-134.4	-177.4	-178	-86.7	-88.3	0	0	0	110.8	L129 N132 I134 L151 H152 I156 E177 N178	L129-N154 PolarHBondContact O-ND2 3.42Å; N132-N154 VanDerWaalsContact CB-OD1 3.25Å; N132-N154 WeakPolarHBondContact CB-OD1 3.49Å; N132-N154 PolarHBondContact O-OD1 2.93Å; I134-N154 WeakPolarHBondContact CB-OD1 3.12Å; I134-N154 WeakPolarHBondContact CG1-OD1 3.37Å; I134-N154 PolarHBondContact N-OD1 2.85Å; L151-N154 PolarHBondContact O-ND2 2.99Å; H152-N154 PolarHBondContact O-ND2 2.76Å; N154-I156 HydrophobicContact CB-CG1 4.4Å; N154-E177 PolarHBondContact N-O 3.15Å; N154-E177 VanDerWaalsContact N-O 3.16Å; N154-N178 VanDerWaalsContact CB-OD1 3.25Å; N154-N178 WeakPolarHBondContact CB-OD1 3.36Å; N154-N178 WeakPolarHBondContact O-CA 3.45Å; N154-N178 PolarHBondContact O-OD1 2.89Å
155	S	95.3	Very high	93	Very high	38 Å²	38	36.9 Å²	36.9	27%	0.266	21%	0.209	S	C	.	.			trans	-109.7	29.5	-175.6	-53.2	0	0	0	0	112.7	I134 S135 T157	I134-S155 CarbonylContact O-C 3.31Å; I134-S155 VanDerWaalsContact O-C 3.29Å; I134-S155 WeakPolarHBondContact O-CA 3.47Å; I134-S155 PolarHBondContact O-N 3.15Å; S135-S155 WeakPolarHBondContact CA-O 3.31Å; S155-T157 PolarHBondContact O-N 2.7Å
156	I	95.3	Very high	92.9	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.2	C	C	.	.			trans	-71.1	123.5	-176.7	-57.2	169.8	0	0	0	109.5	I134 I137 L151 N154 L159 L175 N178 E179 I180	I134-I156 PolarHBondContact O-N 3.06Å; I137-I156 HydrophobicContact CG1-CD1 4.04Å; L151-I156 HydrophobicContact CB-CD1 4.02Å; L151-I156 HydrophobicContact CD1-CD1 4.04Å; L151-I156 HydrophobicContact CG-CD1 4.45Å; N154-I156 HydrophobicContact CB-CG1 4.4Å; I156-L159 HydrophobicContact CG2-CD2 4.34Å; I156-L175 HydrophobicContact CD1-CD2 4.15Å; I156-N178 HydrophobicContact CB-CB 4.48Å; I156-N178 WeakPolarHBondContact CB-OD1 3.3Å; I156-N178 VanDerWaalsContact CG1-OD1 3.3Å; I156-N178 WeakPolarHBondContact CG1-OD1 3.43Å; I156-N178 PolarHBondContact N-OD1 3.36Å; I156-E179 CarbonylContact O-C 3.4Å; I156-E179 VanDerWaalsContact O-C 3.26Å; I156-E179 WeakPolarHBondContact O-CA 3.38Å; I156-E179 PolarHBondContact O-N 2.89Å; I156-I180 PolarHBondContact O-N 2.95Å
157	T	91.6	Very high	92.6	Very high	66 Å²	66	36.5 Å²	36.5	41%	0.405	20%	0.203	S	C	.	.			trans	-104.4	-20.8	-176	51.1	0	0	0	0	114.3	S155 E179	S155-T157 PolarHBondContact O-N 2.7Å; T157-E179 HydrophobicContact CG2-CB 3.78Å
158	T	90.9	Very high	92.2	Very high	39 Å²	39	33.3 Å²	33.3	24%	0.239	20%	0.2	C	C	.	.			trans	-149.3	146.9	-174.2	177.3	0	0	0	0	111.7	R160 E185	T158-R160 WeakPolarHBondContact OG1-CD 3.27Å; T158-R160 VanDerWaalsContact OG1-CG 3.25Å; T158-R160 WeakPolarHBondContact OG1-CG 3.2Å; T158-R160 PolarHBondContact OG1-N 3.25Å; T158-R160 PolarHBondContact OG1-NE 2.96Å; T158-E185 VanDerWaalsContact CA-OE2 3.28Å; T158-E185 WeakPolarHBondContact CA-OE2 3.46Å; T158-E185 WeakPolarHBondContact CB-OE2 3.18Å; T158-E185 PolarHBondContact OG1-OE2 3.36Å
159	L	92.3	Very high	91.8	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	22%	0.216	C	C	.	.			trans	-106.3	6.3	179.3	-56	178.8	0	0	0	112.6	I137 I156 T161 V162 L175 I180 E185 Y188 L189	I137-L159 HydrophobicContact CD1-CD2 4.15Å; I156-L159 HydrophobicContact CG2-CD2 4.34Å; L159-T161 PolarHBondContact O-N 3.16Å; L159-V162 HydrophobicContact CB-CG2 4.12Å; L159-V162 HydrophobicContact CD2-CG2 4.33Å; L159-V162 WeakPolarHBondContact O-CB 3.4Å; L159-V162 WeakPolarHBondContact O-CG2 3.42Å; L159-V162 PolarHBondContact O-N 3.38Å; L159-L175 HydrophobicContact CD1-CD1 4.04Å; L159-L175 HydrophobicContact CD2-CD1 3.74Å; L159-L175 HydrophobicContact CD2-CD2 4.24Å; L159-I180 HydrophobicContact CD1-CD1 4.13Å; L159-I180 HydrophobicContact CD2-CD1 4.03Å; L159-I180 HydrophobicContact CG-CD1 4.17Å; L159-E185 HydrophobicContact CB-CB 4.28Å; L159-E185 HydrophobicContact CD1-CB 4.29Å; L159-E185 HydrophobicContact CG-CB 4.28Å; L159-E185 PolarHBondContact N-OE2 3.36Å; L159-Y188 HydrophobicContact CB-CD2 4.41Å; L159-Y188 WeakPolarHBondContact O-CB 3.25Å; L159-L189 HydrophobicContact CD1-CD1 4.35Å; L159-L189 HydrophobicContact CD1-CD2 4.07Å; L159-L189 HydrophobicContact CD1-CG 4.17Å
160	R	90.3	Very high	91.6	Very high	125 Å²	125	37.1 Å²	37.1	47%	0.472	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.7	-27	-178.8	-74.5	162.3	-157.4	-107.8	0.5	114.8	T158 E185 Y188	T158-R160 WeakPolarHBondContact OG1-CD 3.27Å; T158-R160 VanDerWaalsContact OG1-CG 3.25Å; T158-R160 WeakPolarHBondContact OG1-CG 3.2Å; T158-R160 PolarHBondContact OG1-N 3.25Å; T158-R160 PolarHBondContact OG1-NE 2.96Å; R160-E185 IonicContact CZ-OE1 2.66Å; R160-E185 IonicContact NE-OE1 3.17Å; R160-E185 PolarHBondContact NE-OE1 2.79Å; R160-E185 IonicContact NE-OE2 2.88Å; R160-E185 IonicContact NH2-OE1 2.76Å; R160-E185 PolarHBondContact NH2-OE1 3.31Å; R160-Y188 HydrophobicContact CB-CE2 4.27Å; R160-Y188 HydrophobicContact CG-CD2 3.97Å; R160-Y188 HydrophobicContact CG-CE1 4.32Å; R160-Y188 HydrophobicContact CG-CE2 3.31Å
161	T	89.2	Confident	91.5	Very high	43 Å²	43	37.3 Å²	37.3	26%	0.264	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-18.3	178.2	52.6	0	0	0	0	113.7	I137 L159 A164 H165	I137-T161 PolarHBondContact O-OG1 2.89Å; L159-T161 PolarHBondContact O-N 3.16Å; T161-A164 CarbonylContact O-C 3.13Å; T161-A164 PolarHBondContact O-N 2.85Å; T161-H165 WeakPolarHBondContact O-CB 3.16Å; T161-H165 PolarHBondContact O-N 3.02Å
162	V	90.2	Very high	91.5	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-51.6	-49.4	-175.2	167.5	0	0	0	0	113.3	I137 L159 A164 H165 L166 L189 L192	I137-V162 HydrophobicContact CD1-CG2 3.63Å; L159-V162 HydrophobicContact CB-CG2 4.12Å; L159-V162 HydrophobicContact CD2-CG2 4.33Å; L159-V162 WeakPolarHBondContact O-CB 3.4Å; L159-V162 WeakPolarHBondContact O-CG2 3.42Å; L159-V162 PolarHBondContact O-N 3.38Å; V162-A164 PolarHBondContact O-N 3.42Å; V162-H165 PolarHBondContact O-N 3.44Å; V162-L166 HydrophobicContact CB-CD1 4.39Å; V162-L166 HydrophobicContact CG1-CB 4.25Å; V162-L166 HydrophobicContact CG1-CD1 3.82Å; V162-L166 HydrophobicContact CG1-CG 4.14Å; V162-L166 HydrophobicContact CG2-CD1 3.97Å; V162-L166 HydrophobicContact CG2-CG 4.37Å; V162-L166 PolarHBondContact O-N 3.16Å; V162-L189 HydrophobicContact CB-CD2 4.29Å; V162-L189 HydrophobicContact CG1-CD2 3.82Å; V162-L189 HydrophobicContact CG2-CD2 4.08Å; V162-L192 HydrophobicContact CG1-CD1 4.01Å; V162-L192 HydrophobicContact CG1-CG 4.42Å
163	P	88.4	Confident	91.6	Very high	67 Å²	67	37.1 Å²	37.1	44%	0.435	22%	0.219	S	C	.	.	H	α-helix	trans	-61.2	-17.5	179.5	-25.1	35	0	0	0	115.3	Y188 P191	P163-Y188 HydrophobicContact CG-CD1 4.23Å; P163-Y188 WeakPolarHBondContact CG-O 3.47Å; P163-P191 HydrophobicContact CB-CG 4.13Å; P163-P191 HydrophobicContact CG-CG 4.26Å
164	A	88.9	Confident	91.7	Very high	65 Å²	65	36.9 Å²	36.9	54%	0.537	22%	0.215	S	C	.	.	H	α-helix	trans	-109.7	-17.1	-178.1	0	0	0	0	0	113.2	T141 T161 V162	T141-A164 WeakPolarHBondContact CG2-O 3.03Å; T161-A164 CarbonylContact O-C 3.13Å; T161-A164 PolarHBondContact O-N 2.85Å; V162-A164 PolarHBondContact O-N 3.42Å
165	H	89.3	Confident	91.6	Very high	55 Å²	55	36.4 Å²	36.4	26%	0.255	21%	0.212	S	C	.	.	H	α-helix	trans	-120.2	-21.6	-169.7	-74.3	-170.8	0	0	0	114.5	I137 G138 L140 T141 T161 V162	I137-H165 HydrophobicContact CG2-CB 4.47Å; I137-H165 PolarHBondContact O-ND1 3.4Å; G138-H165 WeakPolarHBondContact O-CB 3.4Å; L140-H165 CarbonylContact C-O 3.17Å; L140-H165 VanDerWaalsContact CA-O 3.3Å; L140-H165 WeakPolarHBondContact CA-O 3.42Å; L140-H165 WeakPolarHBondContact CB-O 3.47Å; L140-H165 PolarHBondContact N-O 3.31Å; T141-H165 PolarHBondContact N-O 2.59Å; T161-H165 WeakPolarHBondContact O-CB 3.16Å; T161-H165 PolarHBondContact O-N 3.02Å; V162-H165 PolarHBondContact O-N 3.44Å
166	L	90.6	Very high	91.5	Very high	14 Å²	14	34.9 Å²	34.9	7%	0.073	20%	0.202	C	C	.	.	S	Bend	trans	-101	146.2	177.9	-64.1	-169.1	0	0	0	112.3	I137 L140 L149 V162 L170 L173 L192	I137-L166 HydrophobicContact CG2-CD2 3.65Å; I137-L166 HydrophobicContact CG2-CG 4.15Å; L140-L166 HydrophobicContact CB-CD2 4.29Å; L140-L166 HydrophobicContact CD1-CD2 3.96Å; L140-L166 HydrophobicContact CG-CD2 4.46Å; L149-L166 HydrophobicContact CD2-CD1 4.18Å; L149-L166 HydrophobicContact CD2-CD2 3.61Å; V162-L166 HydrophobicContact CB-CD1 4.39Å; V162-L166 HydrophobicContact CG1-CB 4.25Å; V162-L166 HydrophobicContact CG1-CD1 3.82Å; V162-L166 HydrophobicContact CG1-CG 4.14Å; V162-L166 HydrophobicContact CG2-CD1 3.97Å; V162-L166 HydrophobicContact CG2-CG 4.37Å; V162-L166 PolarHBondContact O-N 3.16Å; L166-L170 HydrophobicContact CD1-CD2 4.02Å; L166-L173 HydrophobicContact CD1-CD2 4.42Å; L166-L192 HydrophobicContact CB-CD2 4.39Å; L166-L192 HydrophobicContact CD1-CD1 4.45Å
167	P	88.6	Confident	91.5	Very high	10 Å²	10	40.3 Å²	40.3	7%	0.065	23%	0.227	C	C	.	.			trans	-72.6	146.8	173.7	30.4	-33.7	0	0	0	111.5	L146 H169 L170 L192	L146-P167 HydrophobicContact CB-CG 4.13Å; L146-P167 HydrophobicContact CD2-CG 4.38Å; P167-H169 VanDerWaalsContact C-N 3.3Å; P167-H169 PolarHBondContact O-N 3.5Å; P167-L170 PolarHBondContact O-N 2.87Å; P167-L192 WeakPolarHBondContact O-CD2 3.29Å
168	A	85.5	Confident	91.6	Very high	55 Å²	55	37.5 Å²	37.5	46%	0.455	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-23.7	-175.8	0	0	0	0	0	114.5	L170	A168-L170 PolarHBondContact O-N 2.84Å
169	H	87.9	Confident	91.8	Very high	100 Å²	100	39 Å²	39	46%	0.463	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	15.5	-179.3	-58.4	-64.4	0	0	0	114	P167 S171 E194	P167-H169 VanDerWaalsContact C-N 3.3Å; P167-H169 PolarHBondContact O-N 3.5Å; H169-S171 PolarHBondContact O-N 3.25Å; H169-E194 WeakPolarHBondContact CA-OE2 3.16Å; H169-E194 WeakPolarHBondContact CB-OE2 3.35Å; H169-E194 IonicContact CE1-OE1 2.78Å; H169-E194 PolarHBondContact CE1-OE1 3.37Å; H169-E194 IonicContact CG-OE2 2.83Å; H169-E194 IonicContact ND1-OE1 2.7Å; H169-E194 PolarHBondContact ND1-OE1 3.32Å; H169-E194 IonicContact ND1-OE2 3.39Å; H169-E194 PolarHBondContact ND1-OE2 3.35Å
170	L	93.3	Very high	91.9	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.214	C	C	.	.			trans	-73.9	118.1	179.9	-171.4	73	0	0	0	110.4	L146 L149 L166 P167 A168 L173 L192 E194 L195	L146-L170 HydrophobicContact CD2-CD1 4.17Å; L146-L170 HydrophobicContact CG-CD1 4.05Å; L149-L170 HydrophobicContact CB-CD1 3.78Å; L149-L170 HydrophobicContact CB-CD2 4.18Å; L149-L170 HydrophobicContact CD2-CD2 4.34Å; L166-L170 HydrophobicContact CD1-CD2 4.02Å; P167-L170 PolarHBondContact O-N 2.87Å; A168-L170 PolarHBondContact O-N 2.84Å; L170-L173 HydrophobicContact CD2-CB 4Å; L170-L173 HydrophobicContact CD2-CD1 4.16Å; L170-L173 HydrophobicContact CD2-CD2 4.34Å; L170-L173 HydrophobicContact CD2-CG 4.39Å; L170-L192 HydrophobicContact CD2-CD1 4.43Å; L170-E194 CarbonylContact O-C 3.26Å; L170-L195 WeakPolarHBondContact O-CA 3.4Å; L170-L195 PolarHBondContact O-N 2.88Å
171	S	94.6	Very high	91.9	Very high	27 Å²	27	39.3 Å²	39.3	19%	0.189	22%	0.215	C	C	.	.			trans	-98.5	-31.1	-173.4	-175.5	0	0	0	0	113.5	K147 H169 E194 E196 Q197	K147-S171 PolarHBondContact O-N 3.34Å; H169-S171 PolarHBondContact O-N 3.25Å; S171-E194 WeakPolarHBondContact CA-O 3.22Å; S171-E196 PolarHBondContact O-N 3.4Å; S171-Q197 PolarHBondContact O-N 2.82Å
172	I	95.6	Very high	92	Very high	45 Å²	45	39 Å²	39	23%	0.231	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	120	-179.3	-55.5	-179.5	0	0	0	109.1	K147 T148 L149 L150 Q197	K147-I172 PolarHBondContact O-N 2.86Å; T148-I172 WeakPolarHBondContact CA-O 3.35Å; T148-I172 HydrophobicContact CG2-CB 4.1Å; T148-I172 HydrophobicContact CG2-CG2 4.07Å; L149-I172 PolarHBondContact N-O 2.95Å; L150-I172 HydrophobicContact CD2-CG2 4.33Å; I172-Q197 WeakPolarHBondContact CA-O 3.37Å; I172-Q197 HydrophobicContact CB-CB 4.33Å; I172-Q197 HydrophobicContact CG1-CB 4.05Å; I172-Q197 HydrophobicContact CG1-CG 4.08Å; I172-Q197 HydrophobicContact CG2-CB 4.14Å
173	L	96	Very high	92	Very high	2 Å²	2	39 Å²	39	1%	0.01	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	120.8	176.6	178	56.9	0	0	0	110.5	L149 L166 L170 L175 L189 L192 L195 Q197 L198 S199	L149-L173 HydrophobicContact CB-CD1 4.29Å; L149-L173 HydrophobicContact CD2-CD1 4.1Å; L149-L173 HydrophobicContact CG-CD1 4.14Å; L149-L173 WeakPolarHBondContact O-CA 3.28Å; L166-L173 HydrophobicContact CD1-CD2 4.42Å; L170-L173 HydrophobicContact CD2-CB 4Å; L170-L173 HydrophobicContact CD2-CD1 4.16Å; L170-L173 HydrophobicContact CD2-CD2 4.34Å; L170-L173 HydrophobicContact CD2-CG 4.39Å; L173-L175 HydrophobicContact CD1-CD2 4.28Å; L173-L175 HydrophobicContact CD1-CG 4.11Å; L173-L175 HydrophobicContact CD2-CD1 3.93Å; L173-L175 HydrophobicContact CD2-CG 4.34Å; L173-L175 HydrophobicContact CG-CD1 4.15Å; L173-L175 HydrophobicContact CG-CG 4.02Å; L173-L189 HydrophobicContact CD2-CD2 4.05Å; L173-L192 HydrophobicContact CD2-CD1 4.2Å; L173-L195 HydrophobicContact CB-CD1 3.7Å; L173-Q197 PolarHBondContact N-O 3.43Å; L173-L198 HydrophobicContact CB-CD1 4.18Å; L173-L198 HydrophobicContact CD2-CD1 4.16Å; L173-L198 HydrophobicContact CG-CD1 4.09Å; L173-L198 CarbonylContact O-C 3.56Å; L173-L198 VanDerWaalsContact O-CA 3.28Å; L173-L198 WeakPolarHBondContact O-CA 3.3Å; L173-S199 PolarHBondContact O-N 3.3Å; L173-S199 VanDerWaalsContact O-N 3.09Å
174	S	95.4	Very high	92.1	Very high	14 Å²	14	35.8 Å²	35.8	10%	0.098	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	118.6	171.4	-169.6	0	0	0	0	111.2	L149 L151 H152	L149-S174 PolarHBondContact O-N 2.82Å; L151-S174 CarbonylContact C-O 3.47Å; L151-S174 VanDerWaalsContact CA-O 3.32Å; L151-S174 WeakPolarHBondContact CA-O 3.19Å; L151-S174 WeakPolarHBondContact CB-O 3.39Å; L151-S174 PolarHBondContact N-O 2.69Å; H152-S174 PolarHBondContact N-O 2.58Å
175	L	94.9	Very high	92.2	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.166	C	C	.	.			trans	-119.7	15.6	175.8	-64.6	167.8	0	0	0	111.4	I137 L151 I156 L159 L173 N178 I180 L189 L198 S199 N203	I137-L175 HydrophobicContact CD1-CD2 4.4Å; L151-L175 HydrophobicContact CB-CD2 4.36Å; L151-L175 HydrophobicContact CD1-CD2 4.34Å; I156-L175 HydrophobicContact CD1-CD2 4.15Å; L159-L175 HydrophobicContact CD1-CD1 4.04Å; L159-L175 HydrophobicContact CD2-CD1 3.74Å; L159-L175 HydrophobicContact CD2-CD2 4.24Å; L173-L175 HydrophobicContact CD1-CD2 4.28Å; L173-L175 HydrophobicContact CD1-CG 4.11Å; L173-L175 HydrophobicContact CD2-CD1 3.93Å; L173-L175 HydrophobicContact CD2-CG 4.34Å; L173-L175 HydrophobicContact CG-CD1 4.15Å; L173-L175 HydrophobicContact CG-CG 4.02Å; L175-N178 PolarHBondContact O-ND2 2.94Å; L175-I180 HydrophobicContact CB-CD1 4.36Å; L175-L189 HydrophobicContact CD1-CD1 4.47Å; L175-L198 HydrophobicContact CD1-CD1 4.46Å; L175-S199 CarbonylContact C-O 3.53Å; L175-S199 WeakPolarHBondContact CA-O 3.32Å; L175-S199 WeakPolarHBondContact CB-O 3.12Å; L175-S199 PolarHBondContact N-O 3.39Å; L175-N203 PolarHBondContact O-ND2 2.97Å
176	A	93.5	Very high	92.3	Very high	5 Å²	5	30.3 Å²	30.3	4%	0.041	15%	0.154	C	C	.	.			trans	-59	157.1	177.5	0	0	0	0	0	112.1	H152 G153 N178 S199 M201	H152-A176 CarbonylContact C-O 3.56Å; H152-A176 WeakPolarHBondContact CA-O 3.32Å; H152-A176 HydrophobicContact CB-CB 4.02Å; H152-A176 WeakPolarHBondContact CB-O 3.3Å; G153-A176 PolarHBondContact N-O 3.42Å; G153-A176 VanDerWaalsContact N-O 3.16Å; A176-N178 VanDerWaalsContact C-N 3.34Å; A176-N178 PolarHBondContact O-N 3Å; A176-N178 PolarHBondContact O-ND2 3.26Å; A176-S199 PolarHBondContact N-O 2.78Å; A176-M201 CarbonylContact C-O 3.57Å; A176-M201 VanDerWaalsContact CA-O 3.25Å; A176-M201 WeakPolarHBondContact CA-O 3.35Å; A176-M201 HydrophobicContact CB-CG 3.71Å
177	E	93.8	Very high	92.3	Very high	114 Å²	114	30.9 Å²	30.9	53%	0.533	16%	0.16	S	C	.	.	S	Bend	trans	50.9	53.1	174.9	-64.1	178.5	-113.2	0	0	112.1	G153 N154 M201 C202	G153-E177 VanDerWaalsContact CA-O 3.27Å; G153-E177 WeakPolarHBondContact CA-O 3.42Å; G153-E177 PolarHBondContact N-O 3.29Å; N154-E177 PolarHBondContact N-O 3.15Å; N154-E177 VanDerWaalsContact N-O 3.16Å; E177-M201 PolarHBondContact N-O 2.88Å; E177-C202 HydrophobicContact CB-CB 4.42Å; E177-C202 HydrophobicContact CG-CB 3.51Å
178	N	95.4	Very high	92.5	Very high	7 Å²	7	33.3 Å²	33.3	4%	0.037	17%	0.168	C	C	.	.	S	Bend	trans	-127.2	-179.8	177.1	-88.8	-95	0	0	0	111	L151 N154 I156 L175 A176 N203 P204	L151-N178 PolarHBondContact O-ND2 2.96Å; N154-N178 VanDerWaalsContact CB-OD1 3.25Å; N154-N178 WeakPolarHBondContact CB-OD1 3.36Å; N154-N178 WeakPolarHBondContact O-CA 3.45Å; N154-N178 PolarHBondContact O-OD1 2.89Å; I156-N178 HydrophobicContact CB-CB 4.48Å; I156-N178 WeakPolarHBondContact CB-OD1 3.3Å; I156-N178 VanDerWaalsContact CG1-OD1 3.3Å; I156-N178 WeakPolarHBondContact CG1-OD1 3.43Å; I156-N178 PolarHBondContact N-OD1 3.36Å; L175-N178 PolarHBondContact O-ND2 2.94Å; A176-N178 VanDerWaalsContact C-N 3.34Å; A176-N178 PolarHBondContact O-N 3Å; A176-N178 PolarHBondContact O-ND2 3.26Å; N178-N203 WeakPolarHBondContact CA-OD1 3.39Å; N178-N203 WeakPolarHBondContact CB-OD1 3.29Å; N178-N203 PolarHBondContact O-OD1 2.88Å; N178-N203 VanDerWaalsContact O-OD1 3.05Å; N178-P204 WeakPolarHBondContact O-CD 3.33Å
179	E	94.1	Very high	92.8	Very high	72 Å²	72	30.7 Å²	30.7	34%	0.336	15%	0.146	S	C	.	.			trans	-98.1	22.7	-173.9	-83.5	-154.7	-124.6	0	0	114.3	I156 T157 R181	I156-E179 CarbonylContact O-C 3.4Å; I156-E179 VanDerWaalsContact O-C 3.26Å; I156-E179 WeakPolarHBondContact O-CA 3.38Å; I156-E179 PolarHBondContact O-N 2.89Å; T157-E179 HydrophobicContact CG2-CB 3.78Å; E179-R181 PolarHBondContact O-N 2.99Å; E179-R181 PolarHBondContact O-NH1 2.93Å; E179-R181 IonicContact OE2-CZ 2.77Å; E179-R181 IonicContact OE2-NH1 3.57Å; E179-R181 PolarHBondContact OE2-NH1 3.44Å; E179-R181 IonicContact OE2-NH2 2.7Å; E179-R181 PolarHBondContact OE2-NH2 3.1Å
180	I	93.7	Very high	92.8	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.135	C	C	.	.			trans	-68.9	115.6	-179.7	-53.9	169.5	0	0	0	109	I156 L159 L175 E185 I200 N203 P204 C205	I156-I180 PolarHBondContact O-N 2.95Å; L159-I180 HydrophobicContact CD1-CD1 4.13Å; L159-I180 HydrophobicContact CD2-CD1 4.03Å; L159-I180 HydrophobicContact CG-CD1 4.17Å; L175-I180 HydrophobicContact CB-CD1 4.36Å; I180-E185 HydrophobicContact CG2-CB 4.33Å; I180-I200 HydrophobicContact CD1-CD1 4.44Å; I180-N203 HydrophobicContact CB-CB 4.27Å; I180-N203 VanDerWaalsContact CB-OD1 3.22Å; I180-N203 WeakPolarHBondContact CB-OD1 3.36Å; I180-N203 VanDerWaalsContact CG1-OD1 3.25Å; I180-N203 WeakPolarHBondContact CG1-OD1 3.41Å; I180-N203 PolarHBondContact N-OD1 3.16Å; I180-N203 VanDerWaalsContact N-OD1 3.1Å; I180-P204 WeakPolarHBondContact O-CD 3.35Å; I180-C205 HydrophobicContact CG2-CB 4.47Å; I180-C205 VanDerWaalsContact O-CB 3.29Å; I180-C205 WeakPolarHBondContact O-CB 3.36Å; I180-C205 PolarHBondContact O-N 2.94Å; I180-C205 PolarHBondContact O-SG 2.86Å; I180-C205 VanDerWaalsContact O-SG 3.37Å
181	R	90.8	Very high	92.7	Very high	131 Å²	131	30 Å²	30	49%	0.494	15%	0.153	S	C	.	.			trans	-98.2	-22.7	-177.4	-71.7	166.9	178.3	84	-7.6	114.2	E179 P204 H261	E179-R181 PolarHBondContact O-N 2.99Å; E179-R181 PolarHBondContact O-NH1 2.93Å; E179-R181 IonicContact OE2-CZ 2.77Å; E179-R181 IonicContact OE2-NH1 3.57Å; E179-R181 PolarHBondContact OE2-NH1 3.44Å; E179-R181 IonicContact OE2-NH2 2.7Å; E179-R181 PolarHBondContact OE2-NH2 3.1Å; R181-P204 HydrophobicContact CG-CB 3.98Å; R181-P204 HydrophobicContact CG-CG 4.36Å; R181-H261 PolarHBondContact O-CD2 2.91Å
182	D	90.8	Very high	92.5	Very high	35 Å²	35	29 Å²	29	19%	0.187	15%	0.146	C	C	.	.			trans	-110.9	112	-178.9	-88.3	-8.8	0	0	0	111.5	N184 E185 G259 H261	D182-N184 PolarHBondContact O-N 3.25Å; D182-N184 VanDerWaalsContact O-N 3.15Å; D182-E185 HydrophobicContact CB-CG 3.77Å; D182-E185 VanDerWaalsContact O-CB 3.3Å; D182-E185 WeakPolarHBondContact O-CB 3.43Å; D182-E185 WeakPolarHBondContact O-CG 3.35Å; D182-E185 PolarHBondContact O-N 3.12Å; D182-G259 WeakPolarHBondContact OD2-CA 3.43Å; D182-G259 PolarHBondContact OD2-N 2.92Å; D182-H261 HydrophobicContact CB-CB 4.46Å; D182-H261 WeakPolarHBondContact OD1-CB 3.49Å
183	L	90.5	Very high	92.1	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	16%	0.164	C	C	.	.	G	3₁₀ helix	trans	-61.3	-24.8	175.7	-176.6	61.7	0	0	0	112.7	E185 V186 C205 V206 F215 Y220 I221 L264 L268	L183-E185 PolarHBondContact O-N 3.16Å; L183-V186 HydrophobicContact CD1-CG2 4.11Å; L183-V186 WeakPolarHBondContact O-CB 3.26Å; L183-V186 WeakPolarHBondContact O-CG2 3.34Å; L183-V186 PolarHBondContact O-N 3.32Å; L183-C205 HydrophobicContact CB-CB 4.14Å; L183-V206 HydrophobicContact CD1-CG2 4.17Å; L183-F215 HydrophobicContact CD2-CE2 3.63Å; L183-F215 HydrophobicContact CD2-CZ 4.09Å; L183-Y220 HydrophobicContact CD1-CD1 4.46Å; L183-Y220 HydrophobicContact CD2-CD1 3.87Å; L183-Y220 HydrophobicContact CD2-CE1 4.28Å; L183-Y220 HydrophobicContact CG-CD1 3.89Å; L183-Y220 HydrophobicContact CG-CE1 3.93Å; L183-I221 HydrophobicContact CD1-CD1 4.08Å; L183-I221 HydrophobicContact CD1-CG1 4.15Å; L183-L264 HydrophobicContact CB-CD2 4.07Å; L183-L264 HydrophobicContact CD2-CD2 4.16Å; L183-L264 HydrophobicContact CG-CD2 4.17Å; L183-L268 HydrophobicContact CD2-CD1 3.86Å
184	N	90.8	Very high	91.8	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.185	C	C	.	.	G	3₁₀ helix	trans	-62.1	-19.4	173	-74.5	-74	0	0	0	113.5	D182 V186 S187 Y220 Y256 R257 P258	D182-N184 PolarHBondContact O-N 3.25Å; D182-N184 VanDerWaalsContact O-N 3.15Å; N184-V186 PolarHBondContact O-N 3.4Å; N184-S187 WeakPolarHBondContact O-CB 3.47Å; N184-S187 PolarHBondContact O-N 3.29Å; N184-S187 VanDerWaalsContact O-N 3.1Å; N184-S187 PolarHBondContact O-OG 3.11Å; N184-Y220 PolarHBondContact OD1-OH 3.08Å; N184-Y256 WeakPolarHBondContact OD1-CB 3.48Å; N184-R257 PolarHBondContact ND2-O 2.59Å; N184-P258 HydrophobicContact CB-CB 4.44Å; N184-P258 HydrophobicContact CB-CG 4.09Å
185	E	91.3	Very high	91.8	Very high	5 Å²	5	37.2 Å²	37.2	2%	0.023	18%	0.181	C	C	.	.	G	3₁₀ helix	trans	-63.8	-20.8	176	-65.6	-86.5	140.2	0	0	112	T158 L159 R160 I180 D182 L183 S187 Y188	T158-E185 VanDerWaalsContact CA-OE2 3.28Å; T158-E185 WeakPolarHBondContact CA-OE2 3.46Å; T158-E185 WeakPolarHBondContact CB-OE2 3.18Å; T158-E185 PolarHBondContact OG1-OE2 3.36Å; L159-E185 HydrophobicContact CB-CB 4.28Å; L159-E185 HydrophobicContact CD1-CB 4.29Å; L159-E185 HydrophobicContact CG-CB 4.28Å; L159-E185 PolarHBondContact N-OE2 3.36Å; R160-E185 IonicContact CZ-OE1 2.66Å; R160-E185 IonicContact NE-OE1 3.17Å; R160-E185 PolarHBondContact NE-OE1 2.79Å; R160-E185 IonicContact NE-OE2 2.88Å; R160-E185 IonicContact NH2-OE1 2.76Å; R160-E185 PolarHBondContact NH2-OE1 3.31Å; I180-E185 HydrophobicContact CG2-CB 4.33Å; D182-E185 HydrophobicContact CB-CG 3.77Å; D182-E185 VanDerWaalsContact O-CB 3.3Å; D182-E185 WeakPolarHBondContact O-CB 3.43Å; D182-E185 WeakPolarHBondContact O-CG 3.35Å; D182-E185 PolarHBondContact O-N 3.12Å; L183-E185 PolarHBondContact O-N 3.16Å; E185-S187 PolarHBondContact O-N 2.99Å; E185-S187 VanDerWaalsContact O-N 3.16Å; E185-Y188 HydrophobicContact CB-CD2 4.35Å; E185-Y188 WeakPolarHBondContact O-CB 3.41Å; E185-Y188 VanDerWaalsContact O-CD2 3.3Å; E185-Y188 WeakPolarHBondContact O-CD2 3.38Å; E185-Y188 PolarHBondContact O-N 3.47Å
186	V	91.8	Very high	91.7	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-59	-24.2	172.3	175.2	0	0	0	0	112.2	L183 N184 Y188 L189 I200 I221 W224	L183-V186 HydrophobicContact CD1-CG2 4.11Å; L183-V186 WeakPolarHBondContact O-CB 3.26Å; L183-V186 WeakPolarHBondContact O-CG2 3.34Å; L183-V186 PolarHBondContact O-N 3.32Å; N184-V186 PolarHBondContact O-N 3.4Å; V186-Y188 PolarHBondContact O-N 3.38Å; V186-Y188 VanDerWaalsContact O-N 3.1Å; V186-L189 HydrophobicContact CG1-CD1 4.4Å; V186-L189 WeakPolarHBondContact O-CB 3.14Å; V186-L189 PolarHBondContact O-N 3.33Å; V186-I200 HydrophobicContact CG2-CD1 3.67Å; V186-I221 HydrophobicContact CG1-CB 4.36Å; V186-I221 HydrophobicContact CG1-CG1 4.16Å; V186-I221 HydrophobicContact CG1-CG2 4.08Å; V186-I221 HydrophobicContact CG2-CD1 4.22Å; V186-I221 HydrophobicContact CG2-CG1 4.23Å; V186-W224 HydrophobicContact CG1-CB 4.23Å; V186-W224 HydrophobicContact CG1-CG 4.4Å
187	S	90.7	Very high	91.8	Very high	27 Å²	27	44 Å²	44	19%	0.189	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-59.8	-20.5	172.9	64.5	0	0	0	0	113.9	N184 E185 L189 A190	N184-S187 WeakPolarHBondContact O-CB 3.47Å; N184-S187 PolarHBondContact O-N 3.29Å; N184-S187 VanDerWaalsContact O-N 3.1Å; N184-S187 PolarHBondContact O-OG 3.11Å; E185-S187 PolarHBondContact O-N 2.99Å; E185-S187 VanDerWaalsContact O-N 3.16Å; S187-L189 VanDerWaalsContact C-N 3.32Å; S187-A190 WeakPolarHBondContact O-CB 3.38Å
188	Y	92.2	Very high	91.9	Very high	60 Å²	60	38.8 Å²	38.8	24%	0.235	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-78.2	-10.5	172.8	-61.9	-59.6	0	0	0	113.9	L159 R160 P163 E185 V186 P191 P258	L159-Y188 HydrophobicContact CB-CD2 4.41Å; L159-Y188 WeakPolarHBondContact O-CB 3.25Å; R160-Y188 HydrophobicContact CB-CE2 4.27Å; R160-Y188 HydrophobicContact CG-CD2 3.97Å; R160-Y188 HydrophobicContact CG-CE1 4.32Å; R160-Y188 HydrophobicContact CG-CE2 3.31Å; P163-Y188 HydrophobicContact CG-CD1 4.23Å; P163-Y188 WeakPolarHBondContact CG-O 3.47Å; E185-Y188 HydrophobicContact CB-CD2 4.35Å; E185-Y188 WeakPolarHBondContact O-CB 3.41Å; E185-Y188 VanDerWaalsContact O-CD2 3.3Å; E185-Y188 WeakPolarHBondContact O-CD2 3.38Å; E185-Y188 PolarHBondContact O-N 3.47Å; V186-Y188 PolarHBondContact O-N 3.38Å; V186-Y188 VanDerWaalsContact O-N 3.1Å; Y188-P191 WeakPolarHBondContact O-CD 3.41Å; Y188-P258 HydrophobicContact CE2-CB 4.5Å; Y188-P258 HydrophobicContact CE2-CG 3.72Å
189	L	91.4	Very high	91.8	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-85.1	-13.3	173.2	-55.1	-173.6	0	0	0	113.1	L159 V162 L173 L175 V186 S187 P191 L192 L198	L159-L189 HydrophobicContact CD1-CD1 4.35Å; L159-L189 HydrophobicContact CD1-CD2 4.07Å; L159-L189 HydrophobicContact CD1-CG 4.17Å; V162-L189 HydrophobicContact CB-CD2 4.29Å; V162-L189 HydrophobicContact CG1-CD2 3.82Å; V162-L189 HydrophobicContact CG2-CD2 4.08Å; L173-L189 HydrophobicContact CD2-CD2 4.05Å; L175-L189 HydrophobicContact CD1-CD1 4.47Å; V186-L189 HydrophobicContact CG1-CD1 4.4Å; V186-L189 WeakPolarHBondContact O-CB 3.14Å; V186-L189 PolarHBondContact O-N 3.33Å; S187-L189 VanDerWaalsContact C-N 3.32Å; L189-P191 VanDerWaalsContact C-N 3.3Å; L189-P191 WeakPolarHBondContact O-CD 3.4Å; L189-P191 VanDerWaalsContact O-N 3.11Å; L189-L192 HydrophobicContact CD2-CD1 4.31Å; L189-L192 WeakPolarHBondContact O-CB 3.36Å; L189-L192 PolarHBondContact O-N 3.18Å; L189-L198 HydrophobicContact CD1-CD1 3.99Å; L189-L198 HydrophobicContact CD1-CD2 3.79Å
190	A	89.2	Confident	91.8	Very high	28 Å²	28	35.8 Å²	35.8	23%	0.231	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-27.1	-176.8	0	0	0	0	0	116.8	S187 L192 H193 W224	S187-A190 WeakPolarHBondContact O-CB 3.38Å; A190-L192 VanDerWaalsContact C-N 3.27Å; A190-L192 PolarHBondContact O-N 3.01Å; A190-H193 PolarHBondContact O-CE1 3.16Å; A190-H193 PolarHBondContact O-ND1 3.21Å; A190-H193 VanDerWaalsContact O-ND1 3.16Å; A190-W224 HydrophobicContact CB-CE3 4.11Å
191	P	89.9	Confident	91.7	Very high	57 Å²	57	39.3 Å²	39.3	37%	0.37	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-14.9	172.6	-20.6	34.4	0	0	0	115.1	P163 Y188 L189 H193	P163-P191 HydrophobicContact CB-CG 4.13Å; P163-P191 HydrophobicContact CG-CG 4.26Å; Y188-P191 WeakPolarHBondContact O-CD 3.41Å; L189-P191 VanDerWaalsContact C-N 3.3Å; L189-P191 WeakPolarHBondContact O-CD 3.4Å; L189-P191 VanDerWaalsContact O-N 3.11Å; P191-H193 VanDerWaalsContact C-N 3.28Å; P191-H193 PolarHBondContact O-N 2.85Å
192	L	89.8	Confident	91.6	Very high	8 Å²	8	35.9 Å²	35.9	4%	0.042	19%	0.188	C	C	.	.			trans	-82.9	71.9	-177.6	-56.1	179.8	0	0	0	110.2	V162 L166 P167 L170 L173 L189 A190 E194 L195	V162-L192 HydrophobicContact CG1-CD1 4.01Å; V162-L192 HydrophobicContact CG1-CG 4.42Å; L166-L192 HydrophobicContact CB-CD2 4.39Å; L166-L192 HydrophobicContact CD1-CD1 4.45Å; P167-L192 WeakPolarHBondContact O-CD2 3.29Å; L170-L192 HydrophobicContact CD2-CD1 4.43Å; L173-L192 HydrophobicContact CD2-CD1 4.2Å; L189-L192 HydrophobicContact CD2-CD1 4.31Å; L189-L192 WeakPolarHBondContact O-CB 3.36Å; L189-L192 PolarHBondContact O-N 3.18Å; A190-L192 VanDerWaalsContact C-N 3.27Å; A190-L192 PolarHBondContact O-N 3.01Å; L192-E194 PolarHBondContact O-N 3.05Å; L192-L195 HydrophobicContact CB-CB 4.05Å; L192-L195 VanDerWaalsContact O-CB 3.26Å; L192-L195 WeakPolarHBondContact O-CB 3.25Å; L192-L195 PolarHBondContact O-N 3.1Å
193	H	87.9	Confident	91.6	Very high	134 Å²	134	34.2 Å²	34.2	62%	0.62	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-20.5	-173.4	-58.7	-32.3	0	0	0	114.2	A190 P191 N227	A190-H193 PolarHBondContact O-CE1 3.16Å; A190-H193 PolarHBondContact O-ND1 3.21Å; A190-H193 VanDerWaalsContact O-ND1 3.16Å; P191-H193 VanDerWaalsContact C-N 3.28Å; P191-H193 PolarHBondContact O-N 2.85Å; H193-N227 PolarHBondContact O-ND2 3.3Å
194	E	91	Very high	91.5	Very high	96 Å²	96	36.5 Å²	36.5	45%	0.449	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.6	7.6	178.1	-68.5	176.8	-157.6	0	0	113.4	H169 L170 S171 L192 E196	H169-E194 WeakPolarHBondContact CA-OE2 3.16Å; H169-E194 WeakPolarHBondContact CB-OE2 3.35Å; H169-E194 IonicContact CE1-OE1 2.78Å; H169-E194 PolarHBondContact CE1-OE1 3.37Å; H169-E194 IonicContact CG-OE2 2.83Å; H169-E194 IonicContact ND1-OE1 2.7Å; H169-E194 PolarHBondContact ND1-OE1 3.32Å; H169-E194 IonicContact ND1-OE2 3.39Å; H169-E194 PolarHBondContact ND1-OE2 3.35Å; L170-E194 CarbonylContact O-C 3.26Å; S171-E194 WeakPolarHBondContact CA-O 3.22Å; L192-E194 PolarHBondContact O-N 3.05Å; E194-E196 PolarHBondContact O-N 2.99Å; E194-E196 VanDerWaalsContact O-N 3.08Å
195	L	93.8	Very high	91.3	Very high	2 Å²	2	36.6 Å²	36.6	1%	0.01	19%	0.194	C	C	.	.			trans	-71.6	101.2	-177.7	-171.8	69.6	0	0	0	111.9	L170 L173 L192 Q197 L198 L228	L170-L195 WeakPolarHBondContact O-CA 3.4Å; L170-L195 PolarHBondContact O-N 2.88Å; L173-L195 HydrophobicContact CB-CD1 3.7Å; L192-L195 HydrophobicContact CB-CB 4.05Å; L192-L195 VanDerWaalsContact O-CB 3.26Å; L192-L195 WeakPolarHBondContact O-CB 3.25Å; L192-L195 PolarHBondContact O-N 3.1Å; L195-Q197 WeakPolarHBondContact CD1-O 3.39Å; L195-L198 HydrophobicContact CD2-CB 4.31Å; L195-L198 HydrophobicContact CD2-CD1 4.42Å; L195-L198 HydrophobicContact CD2-CD2 4.43Å; L195-L228 WeakPolarHBondContact O-CA 3.19Å
196	E	94.3	Very high	91	Very high	69 Å²	69	37.3 Å²	37.3	32%	0.322	20%	0.199	S	C	.	.			trans	-89	-28.3	178.4	-55	-159.9	163.3	0	0	112.9	S171 E194 K229 V230	S171-E196 PolarHBondContact O-N 3.4Å; E194-E196 PolarHBondContact O-N 2.99Å; E194-E196 VanDerWaalsContact O-N 3.08Å; E196-K229 HydrophobicContact CB-CD 4.3Å; E196-K229 HydrophobicContact CB-CG 4.39Å; E196-K229 VanDerWaalsContact CD-CE 3.4Å; E196-K229 HydrophobicContact CG-CD 4.45Å; E196-K229 PolarHBondContact O-N 2.89Å; E196-K229 WeakPolarHBondContact OE1-CE 3.25Å; E196-K229 IonicContact OE1-NZ 2.79Å; E196-K229 PolarHBondContact OE1-NZ 2.79Å; E196-K229 WeakPolarHBondContact OE2-CE 3.34Å; E196-K229 IonicContact OE2-NZ 2.69Å; E196-K229 PolarHBondContact OE2-NZ 3.47Å; E196-V230 PolarHBondContact O-N 3.4Å; E196-V230 VanDerWaalsContact O-N 3.09Å
197	Q	95	Very high	90.4	Very high	78 Å²	78	42.5 Å²	42.5	36%	0.364	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	128.1	-177.3	-51.4	-166.7	-16	0	0	111.8	S171 I172 L173 L195 V230	S171-Q197 PolarHBondContact O-N 2.82Å; I172-Q197 WeakPolarHBondContact CA-O 3.37Å; I172-Q197 HydrophobicContact CB-CB 4.33Å; I172-Q197 HydrophobicContact CG1-CB 4.05Å; I172-Q197 HydrophobicContact CG1-CG 4.08Å; I172-Q197 HydrophobicContact CG2-CB 4.14Å; L173-Q197 PolarHBondContact N-O 3.43Å; L195-Q197 WeakPolarHBondContact CD1-O 3.39Å; Q197-V230 WeakPolarHBondContact CA-O 3.4Å; Q197-V230 HydrophobicContact CB-CB 4.39Å; Q197-V230 HydrophobicContact CG-CB 4Å; Q197-V230 HydrophobicContact CG-CG2 4.26Å
198	L	95.6	Very high	89.2	Confident	5 Å²	5	45.9 Å²	45.9	3%	0.026	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	147.9	175.6	-177.4	58.2	0	0	0	110.2	L173 L175 L189 L195 I221 L228 V230 L231 D232	L173-L198 HydrophobicContact CB-CD1 4.18Å; L173-L198 HydrophobicContact CD2-CD1 4.16Å; L173-L198 HydrophobicContact CG-CD1 4.09Å; L173-L198 CarbonylContact O-C 3.56Å; L173-L198 VanDerWaalsContact O-CA 3.28Å; L173-L198 WeakPolarHBondContact O-CA 3.3Å; L175-L198 HydrophobicContact CD1-CD1 4.46Å; L189-L198 HydrophobicContact CD1-CD1 3.99Å; L189-L198 HydrophobicContact CD1-CD2 3.79Å; L195-L198 HydrophobicContact CD2-CB 4.31Å; L195-L198 HydrophobicContact CD2-CD1 4.42Å; L195-L198 HydrophobicContact CD2-CD2 4.43Å; L198-I221 HydrophobicContact CD2-CG2 3.65Å; L198-L228 HydrophobicContact CB-CD1 3.74Å; L198-L228 HydrophobicContact CB-CG 4.31Å; L198-L228 HydrophobicContact CD2-CD1 4.01Å; L198-V230 PolarHBondContact N-O 2.91Å; L198-L231 HydrophobicContact CB-CD1 4.02Å; L198-L231 HydrophobicContact CD2-CD1 4.33Å; L198-L231 HydrophobicContact CG-CD1 4.17Å; L198-L231 CarbonylContact O-C 3.38Å; L198-L231 WeakPolarHBondContact O-CA 3.11Å; L198-D232 PolarHBondContact O-N 2.92Å
199	S	94.1	Very high	87.9	Confident	16 Å²	16	45.8 Å²	45.8	11%	0.112	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	137.6	163.2	-169.4	0	0	0	0	110.5	L173 L175 A176 D232	L173-S199 PolarHBondContact O-N 3.3Å; L173-S199 VanDerWaalsContact O-N 3.09Å; L175-S199 CarbonylContact C-O 3.53Å; L175-S199 WeakPolarHBondContact CA-O 3.32Å; L175-S199 WeakPolarHBondContact CB-O 3.12Å; L175-S199 PolarHBondContact N-O 3.39Å; A176-S199 PolarHBondContact N-O 2.78Å; S199-D232 WeakPolarHBondContact CA-OD1 3.43Å; S199-D232 PolarHBondContact OG-OD1 3.19Å; S199-D232 VanDerWaalsContact OG-OD1 3.13Å
200	I	93.5	Very high	86.5	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	30%	0.304	C	S	.	.			trans	-142.6	-0.1	-178.5	-163.6	163.4	0	0	0	111.9	I180 V186 N203 V206 Y217 I221 D232	I180-I200 HydrophobicContact CD1-CD1 4.44Å; V186-I200 HydrophobicContact CG2-CD1 3.67Å; I200-N203 HydrophobicContact CG1-CB 4.4Å; I200-N203 WeakPolarHBondContact O-CB 3.28Å; I200-N203 PolarHBondContact O-N 2.92Å; I200-N203 PolarHBondContact O-ND2 3.21Å; I200-V206 HydrophobicContact CG2-CG2 4.28Å; I200-Y217 HydrophobicContact CG2-CE2 4.14Å; I200-I221 HydrophobicContact CD1-CD1 4.35Å; I200-I221 HydrophobicContact CG2-CD1 3.51Å; I200-D232 PolarHBondContact N-OD1 3.32Å
201	M	90.6	Very high	85.3	Confident	75 Å²	75	56 Å²	56	37%	0.369	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.8	154.5	175	63.5	-176.3	-69.5	0	0	112.7	A176 E177 N203 D232	A176-M201 CarbonylContact C-O 3.57Å; A176-M201 VanDerWaalsContact CA-O 3.25Å; A176-M201 WeakPolarHBondContact CA-O 3.35Å; A176-M201 HydrophobicContact CB-CG 3.71Å; E177-M201 PolarHBondContact N-O 2.88Å; M201-N203 PolarHBondContact O-N 2.7Å; M201-N203 VanDerWaalsContact O-N 3.12Å; M201-N203 PolarHBondContact O-ND2 3.15Å; M201-D232 HydrophobicContact CB-CB 4.24Å; M201-D232 WeakPolarHBondContact CB-OD1 3.35Å; M201-D232 HydrophobicContact CG-CB 4.49Å; M201-D232 PolarHBondContact N-OD1 2.78Å; M201-D232 HydrophobicContact SD-CB 4.31Å
202	C	88.6	Confident	84.2	Confident	59 Å²	59	55.1 Å²	55.1	40%	0.399	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.3	17.6	-177.8	-55.9	0	0	0	0	115.3	E177	E177-C202 HydrophobicContact CB-CB 4.42Å; E177-C202 HydrophobicContact CG-CB 3.51Å
203	N	91.9	Very high	83.3	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	34%	0.338	C	S	.	.	S	Bend	trans	-87.6	145.7	165.2	-80.7	-99.2	0	0	0	111.4	L175 N178 I180 I200 M201 C205 V206 M207	L175-N203 PolarHBondContact O-ND2 2.97Å; N178-N203 WeakPolarHBondContact CA-OD1 3.39Å; N178-N203 WeakPolarHBondContact CB-OD1 3.29Å; N178-N203 PolarHBondContact O-OD1 2.88Å; N178-N203 VanDerWaalsContact O-OD1 3.05Å; I180-N203 HydrophobicContact CB-CB 4.27Å; I180-N203 VanDerWaalsContact CB-OD1 3.22Å; I180-N203 WeakPolarHBondContact CB-OD1 3.36Å; I180-N203 VanDerWaalsContact CG1-OD1 3.25Å; I180-N203 WeakPolarHBondContact CG1-OD1 3.41Å; I180-N203 PolarHBondContact N-OD1 3.16Å; I180-N203 VanDerWaalsContact N-OD1 3.1Å; I200-N203 HydrophobicContact CG1-CB 4.4Å; I200-N203 WeakPolarHBondContact O-CB 3.28Å; I200-N203 PolarHBondContact O-N 2.92Å; I200-N203 PolarHBondContact O-ND2 3.21Å; M201-N203 PolarHBondContact O-N 2.7Å; M201-N203 VanDerWaalsContact O-N 3.12Å; M201-N203 PolarHBondContact O-ND2 3.15Å; N203-C205 PolarHBondContact O-N 2.8Å; N203-V206 PolarHBondContact O-N 3.09Å; N203-M207 WeakPolarHBondContact O-CG 3.41Å; N203-M207 PolarHBondContact O-N 3.38Å
204	P	88.7	Confident	82.7	Confident	47 Å²	47	53.1 Å²	53.1	31%	0.305	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-28.8	176.6	-29.1	34.5	0	0	0	115.7	N178 I180 R181 V206	N178-P204 WeakPolarHBondContact O-CD 3.33Å; I180-P204 WeakPolarHBondContact O-CD 3.35Å; R181-P204 HydrophobicContact CG-CB 3.98Å; R181-P204 HydrophobicContact CG-CG 4.36Å; P204-V206 PolarHBondContact O-N 3.42Å
205	C	87	Confident	82.5	Confident	2 Å²	2	49.5 Å²	49.5	1%	0.014	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-13.6	177.1	63.8	0	0	0	0	115.2	I180 L183 N203 H261	I180-C205 HydrophobicContact CG2-CB 4.47Å; I180-C205 VanDerWaalsContact O-CB 3.29Å; I180-C205 WeakPolarHBondContact O-CB 3.36Å; I180-C205 PolarHBondContact O-N 2.94Å; I180-C205 PolarHBondContact O-SG 2.86Å; I180-C205 VanDerWaalsContact O-SG 3.37Å; L183-C205 HydrophobicContact CB-CB 4.14Å; N203-C205 PolarHBondContact O-N 2.8Å; C205-H261 PolarHBondContact O-CE1 2.94Å; C205-H261 VanDerWaalsContact O-CE1 3.32Å
206	V	84.9	Confident	82.2	Confident	21 Å²	21	51 Å²	51	13%	0.127	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.1	-28.2	-175.7	159.5	0	0	0	0	111.4	L183 I200 N203 P204 Y217	L183-V206 HydrophobicContact CD1-CG2 4.17Å; I200-V206 HydrophobicContact CG2-CG2 4.28Å; N203-V206 PolarHBondContact O-N 3.09Å; P204-V206 PolarHBondContact O-N 3.42Å; V206-Y217 HydrophobicContact CG1-CD1 3.84Å; V206-Y217 HydrophobicContact CG1-CD2 4.25Å; V206-Y217 HydrophobicContact CG1-CE1 3.46Å; V206-Y217 VanDerWaalsContact CG1-CE1 3.46Å; V206-Y217 HydrophobicContact CG1-CE2 3.87Å; V206-Y217 HydrophobicContact CG1-CG 4.23Å; V206-Y217 VanDerWaalsContact CG1-CZ 3.46Å; V206-Y217 HydrophobicContact CG2-CD1 4.31Å; V206-Y217 HydrophobicContact CG2-CD2 3.74Å; V206-Y217 HydrophobicContact CG2-CE2 4.02Å; V206-Y217 HydrophobicContact CG2-CG 3.89Å
207	M	79.4	Confident	82	Confident	109 Å²	109	49.6 Å²	49.6	54%	0.537	31%	0.306	S	S	.	.	S	Bend	trans	-63.6	136.8	177.3	-70.9	174.9	75.6	0	0	112.1	N203 T209	N203-M207 WeakPolarHBondContact O-CG 3.41Å; N203-M207 PolarHBondContact O-N 3.38Å; M207-T209 PolarHBondContact O-N 2.67Å; M207-T209 PolarHBondContact O-OG1 3.1Å
208	A	64.2	Low	81.9	Confident	97 Å²	97	47.2 Å²	47.2	80%	0.802	29%	0.294	S	S	*	.			trans	-60.5	96.7	179.2	0	0	0	0	0	111.7
209	T	66.1	Low	81.7	Confident	58 Å²	58	47 Å²	47	36%	0.356	29%	0.293	S	S	.	.			trans	-81.1	123.2	177.7	-62.7	0	0	0	0	109.1	M207 S211 L212	M207-T209 PolarHBondContact O-N 2.67Å; M207-T209 PolarHBondContact O-OG1 3.1Å; T209-S211 PolarHBondContact O-N 3.24Å; T209-L212 PolarHBondContact O-N 3.47Å
210	P	60.5	Low	81.5	Confident	142 Å²	142	46.2 Å²	46.2	92%	0.922	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-5.4	-171.8	-27.1	35.3	0	0	0	117.3
211	S	64.3	Low	81.5	Confident	101 Å²	101	46.2 Å²	46.2	71%	0.706	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.3	-0.5	174.7	59.9	0	0	0	0	114.1	T209	T209-S211 PolarHBondContact O-N 3.24Å
212	L	66.6	Low	81.5	Confident	39 Å²	39	43 Å²	43	20%	0.204	27%	0.272	C	S	.	.	S	Bend	trans	-125.2	141.9	-176.7	-62.6	175.1	0	0	0	110.6	T209 V262 V265	T209-L212 PolarHBondContact O-N 3.47Å; L212-V262 HydrophobicContact CD2-CG1 4.13Å; L212-V265 HydrophobicContact CB-CG1 3.96Å; L212-V265 HydrophobicContact CD1-CB 4.41Å; L212-V265 HydrophobicContact CD1-CG1 4Å; L212-V265 HydrophobicContact CD1-CG2 4.49Å; L212-V265 HydrophobicContact CD2-CG1 4.36Å; L212-V265 HydrophobicContact CG-CG1 4.32Å
213	P	71.1	Confident	81.7	Confident	70 Å²	70	40.3 Å²	40.3	46%	0.455	25%	0.253	S	S	.	.			trans	-65.6	147.5	174.4	28.2	-35.4	0	0	0	111.6	F215 A269	P213-F215 PolarHBondContact O-N 3.21Å; P213-A269 HydrophobicContact CB-CB 3.83Å; P213-A269 HydrophobicContact CG-CB 3.4Å; P213-A269 VanDerWaalsContact CG-CB 3.4Å
214	G	76	Confident	81.6	Confident	30 Å²	30	41.9 Å²	41.9	31%	0.309	26%	0.259	S	S	.	.			trans	-67.7	127.1	178.2	0	0	0	0	0	112.4	L274	G214-L274 PolarHBondContact O-N 3.03Å
215	F	86.4	Confident	81.8	Confident	19 Å²	19	40 Å²	40	8%	0.083	25%	0.247	C	C	.	.	B	Isolated β-bridge	trans	-135.8	141.2	-177.9	71.6	-76.9	0	0	0	110.4	L183 P213 V265 L268 A269 C272 L274	L183-F215 HydrophobicContact CD2-CE2 3.63Å; L183-F215 HydrophobicContact CD2-CZ 4.09Å; P213-F215 PolarHBondContact O-N 3.21Å; F215-V265 HydrophobicContact CD1-CB 4.41Å; F215-V265 HydrophobicContact CD1-CG1 3.55Å; F215-V265 HydrophobicContact CD1-CG2 4.31Å; F215-V265 HydrophobicContact CE1-CB 4.22Å; F215-V265 HydrophobicContact CE1-CG1 3.62Å; F215-V265 HydrophobicContact CE1-CG2 3.66Å; F215-V265 HydrophobicContact CE2-CG2 4.36Å; F215-V265 HydrophobicContact CG-CG1 4.34Å; F215-V265 HydrophobicContact CZ-CG1 4.44Å; F215-V265 HydrophobicContact CZ-CG2 3.7Å; F215-L268 HydrophobicContact CB-CB 4.02Å; F215-L268 HydrophobicContact CD2-CB 3.6Å; F215-L268 HydrophobicContact CD2-CD1 3.66Å; F215-L268 HydrophobicContact CD2-CG 4.29Å; F215-L268 HydrophobicContact CE2-CB 4.44Å; F215-L268 HydrophobicContact CE2-CD1 3.73Å; F215-L268 HydrophobicContact CG-CB 4.05Å; F215-A269 HydrophobicContact CB-CB 4.11Å; F215-C272 CarbonylContact C-O 3.31Å; F215-C272 VanDerWaalsContact CA-O 3.29Å; F215-C272 WeakPolarHBondContact CA-O 3.42Å; F215-L274 VanDerWaalsContact C-CG 3.46Å
216	D	87.6	Confident	81.7	Confident	34 Å²	34	44.5 Å²	44.5	18%	0.182	27%	0.27	C	S	.	.			trans	-79	123.3	170.6	179.3	17.6	0	0	0	108.9	R218 P219 C272 L274	D216-R218 WeakPolarHBondContact OD1-CB 3.47Å; D216-R218 WeakPolarHBondContact OD1-CG 3.41Å; D216-R218 PolarHBondContact OD1-N 2.88Å; D216-P219 VanDerWaalsContact CG-CD 3.47Å; D216-P219 WeakPolarHBondContact OD2-CD 3.43Å; D216-C272 HydrophobicContact CB-CB 4.19Å; D216-C272 PolarHBondContact N-O 2.91Å; D216-C272 WeakPolarHBondContact O-CB 3.33Å; D216-L274 HydrophobicContact CB-CD2 4.13Å
217	Y	90.6	Very high	81.9	Confident	39 Å²	39	48.6 Å²	48.6	15%	0.153	29%	0.291	C	S	.	.			trans	-93.9	-14.4	-178.6	59.9	-83	0	0	0	112	I200 V206 Y220 I221 D232	I200-Y217 HydrophobicContact CG2-CE2 4.14Å; V206-Y217 HydrophobicContact CG1-CD1 3.84Å; V206-Y217 HydrophobicContact CG1-CD2 4.25Å; V206-Y217 HydrophobicContact CG1-CE1 3.46Å; V206-Y217 VanDerWaalsContact CG1-CE1 3.46Å; V206-Y217 HydrophobicContact CG1-CE2 3.87Å; V206-Y217 HydrophobicContact CG1-CG 4.23Å; V206-Y217 VanDerWaalsContact CG1-CZ 3.46Å; V206-Y217 HydrophobicContact CG2-CD1 4.31Å; V206-Y217 HydrophobicContact CG2-CD2 3.74Å; V206-Y217 HydrophobicContact CG2-CE2 4.02Å; V206-Y217 HydrophobicContact CG2-CG 3.89Å; Y217-Y220 WeakPolarHBondContact O-CB 3.34Å; Y217-Y220 PolarHBondContact O-N 3.14Å; Y217-I221 HydrophobicContact CD2-CD1 3.76Å; Y217-I221 HydrophobicContact CD2-CG1 4.46Å; Y217-I221 HydrophobicContact CE2-CD1 4.39Å; Y217-I221 WeakPolarHBondContact O-CG1 3.47Å; Y217-I221 PolarHBondContact O-N 2.9Å; Y217-D232 WeakPolarHBondContact CE2-OD2 3.4Å; Y217-D232 PolarHBondContact OH-OD2 3.37Å
218	R	92.1	Very high	82.5	Confident	29 Å²	29	43.7 Å²	43.7	11%	0.109	27%	0.268	C	S	.	.	H	α-helix	trans	-66.6	-49.5	-169.6	-65.1	166.7	54.7	81.6	3.9	112.4	D216 Y220 I221 M222 L231 E240	D216-R218 WeakPolarHBondContact OD1-CB 3.47Å; D216-R218 WeakPolarHBondContact OD1-CG 3.41Å; D216-R218 PolarHBondContact OD1-N 2.88Å; R218-Y220 PolarHBondContact O-N 2.72Å; R218-I221 PolarHBondContact O-N 3.03Å; R218-M222 WeakPolarHBondContact O-CG 3.34Å; R218-M222 PolarHBondContact O-N 3.22Å; R218-L231 HydrophobicContact CB-CD2 3.75Å; R218-L231 HydrophobicContact CG-CD2 3.82Å; R218-L231 HydrophobicContact CG-CG 4.39Å; R218-L231 PolarHBondContact NH1-O 2.94Å; R218-E240 IonicContact CZ-OE1 2.7Å; R218-E240 IonicContact NE-OE1 3.14Å; R218-E240 PolarHBondContact NE-OE1 2.8Å; R218-E240 IonicContact NH2-OE1 3.44Å; R218-E240 PolarHBondContact NH2-OE1 3.08Å; R218-E240 IonicContact NH2-OE2 3.95Å
219	P	90.6	Very high	83.9	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-59.6	-31.9	172	-25.1	35	0	0	0	113.4	D216 S223 K243 A244 L247	D216-P219 VanDerWaalsContact CG-CD 3.47Å; D216-P219 WeakPolarHBondContact OD2-CD 3.43Å; P219-S223 WeakPolarHBondContact O-CB 3.35Å; P219-S223 PolarHBondContact O-N 3.06Å; P219-K243 HydrophobicContact CB-CB 3.9Å; P219-K243 HydrophobicContact CG-CB 4.02Å; P219-A244 HydrophobicContact CB-CB 4.39Å; P219-A244 WeakPolarHBondContact O-CA 3.28Å; P219-A244 VanDerWaalsContact O-CB 3.25Å; P219-A244 WeakPolarHBondContact O-CB 3.43Å; P219-L247 HydrophobicContact CB-CD1 3.78Å
220	Y	91.8	Very high	85.2	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-67.5	-44.7	176.9	178.1	-99.6	0	0	0	112.1	L183 N184 Y217 R218 S223 W224 G253 L264 L268	L183-Y220 HydrophobicContact CD1-CD1 4.46Å; L183-Y220 HydrophobicContact CD2-CD1 3.87Å; L183-Y220 HydrophobicContact CD2-CE1 4.28Å; L183-Y220 HydrophobicContact CG-CD1 3.89Å; L183-Y220 HydrophobicContact CG-CE1 3.93Å; N184-Y220 PolarHBondContact OD1-OH 3.08Å; Y217-Y220 WeakPolarHBondContact O-CB 3.34Å; Y217-Y220 PolarHBondContact O-N 3.14Å; R218-Y220 PolarHBondContact O-N 2.72Å; Y220-S223 WeakPolarHBondContact O-CB 3.27Å; Y220-S223 PolarHBondContact O-N 2.67Å; Y220-S223 PolarHBondContact O-OG 2.95Å; Y220-W224 AromaticContact CE1-CD1 3.98Å; Y220-W224 AromaticContact CE1-NE1 3.58Å; Y220-W224 AromaticContact CE2-NE1 3.74Å; Y220-W224 AromaticContact CZ-NE1 3.22Å; Y220-W224 PolarHBondContact OH-NE1 3.09Å; Y220-W224 VanDerWaalsContact OH-NE1 3.14Å; Y220-G253 WeakPolarHBondContact CE2-O 3.44Å; Y220-G253 PolarHBondContact OH-O 3.39Å; Y220-L264 HydrophobicContact CD1-CD2 4.39Å; Y220-L264 HydrophobicContact CD2-CD1 4.08Å; Y220-L264 HydrophobicContact CE1-CD1 4.48Å; Y220-L264 HydrophobicContact CE1-CD2 3.69Å; Y220-L264 HydrophobicContact CE2-CD1 3.51Å; Y220-L264 HydrophobicContact CE2-CD2 4.2Å; Y220-L264 HydrophobicContact CE2-CG 4.48Å; Y220-L268 HydrophobicContact CD1-CD1 4.27Å; Y220-L268 HydrophobicContact CD2-CD1 4.17Å; Y220-L268 HydrophobicContact CD2-CD2 3.84Å; Y220-L268 HydrophobicContact CG-CD1 3.82Å; Y220-L268 HydrophobicContact CG-CD2 4.09Å
221	I	92.3	Very high	86.8	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-64.1	-45.3	177	-68.3	-170.6	0	0	0	110.8	L183 V186 L198 I200 Y217 R218 S223 W224 C225 L228 L231	L183-I221 HydrophobicContact CD1-CD1 4.08Å; L183-I221 HydrophobicContact CD1-CG1 4.15Å; V186-I221 HydrophobicContact CG1-CB 4.36Å; V186-I221 HydrophobicContact CG1-CG1 4.16Å; V186-I221 HydrophobicContact CG1-CG2 4.08Å; V186-I221 HydrophobicContact CG2-CD1 4.22Å; V186-I221 HydrophobicContact CG2-CG1 4.23Å; L198-I221 HydrophobicContact CD2-CG2 3.65Å; I200-I221 HydrophobicContact CD1-CD1 4.35Å; I200-I221 HydrophobicContact CG2-CD1 3.51Å; Y217-I221 HydrophobicContact CD2-CD1 3.76Å; Y217-I221 HydrophobicContact CD2-CG1 4.46Å; Y217-I221 HydrophobicContact CE2-CD1 4.39Å; Y217-I221 WeakPolarHBondContact O-CG1 3.47Å; Y217-I221 PolarHBondContact O-N 2.9Å; R218-I221 PolarHBondContact O-N 3.03Å; I221-S223 PolarHBondContact O-N 3.31Å; I221-W224 PolarHBondContact O-N 2.92Å; I221-C225 PolarHBondContact O-N 3.48Å; I221-C225 VanDerWaalsContact O-N 3.14Å; I221-L228 HydrophobicContact CG2-CD1 4.36Å; I221-L231 HydrophobicContact CB-CD2 4.18Å; I221-L231 HydrophobicContact CG2-CD1 4.15Å; I221-L231 HydrophobicContact CG2-CD2 4.13Å
222	M	91.7	Very high	88	Confident	8 Å²	8	31.7 Å²	31.7	4%	0.039	17%	0.168	C	C	.	.	H	α-helix	trans	-60.6	-31.5	175.2	-68.8	163.3	49.3	0	0	112.4	R218 W224 C225 L226 L231 V236 E240 A244	R218-M222 WeakPolarHBondContact O-CG 3.34Å; R218-M222 PolarHBondContact O-N 3.22Å; M222-W224 PolarHBondContact O-N 3.24Å; M222-W224 VanDerWaalsContact O-N 3.11Å; M222-C225 CarbonylContact O-C 3.59Å; M222-C225 PolarHBondContact O-N 3.49Å; M222-C225 VanDerWaalsContact O-N 3.08Å; M222-L226 WeakPolarHBondContact O-CD2 3.33Å; M222-L226 PolarHBondContact O-N 3.26Å; M222-L231 HydrophobicContact CG-CD2 4.33Å; M222-V236 HydrophobicContact CE-CG1 3.24Å; M222-V236 HydrophobicContact SD-CB 4.45Å; M222-V236 HydrophobicContact SD-CG1 3.69Å; M222-V236 HydrophobicContact SD-CG2 3.93Å; M222-E240 HydrophobicContact CE-CB 3.74Å; M222-E240 WeakPolarHBondContact CE-O 3.4Å; M222-E240 HydrophobicContact SD-CB 3.89Å; M222-A244 HydrophobicContact CB-CB 3.52Å; M222-A244 HydrophobicContact CE-CB 3.92Å
223	S	91.6	Very high	88.9	Confident	2 Å²	2	33 Å²	33	1%	0.014	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-8.5	173.6	83.8	0	0	0	0	114.4	P219 Y220 I221 A244 Y248	P219-S223 WeakPolarHBondContact O-CB 3.35Å; P219-S223 PolarHBondContact O-N 3.06Å; Y220-S223 WeakPolarHBondContact O-CB 3.27Å; Y220-S223 PolarHBondContact O-N 2.67Å; Y220-S223 PolarHBondContact O-OG 2.95Å; I221-S223 PolarHBondContact O-N 3.31Å; S223-A244 WeakPolarHBondContact CB-O 3.43Å; S223-Y248 WeakPolarHBondContact O-CD2 3.39Å
224	W	91.1	Very high	89.8	Confident	33 Å²	33	37.5 Å²	37.5	13%	0.125	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.3	-29.5	166.9	-66.1	103.9	0	0	0	113.2	V186 A190 Y220 I221 M222 R254	V186-W224 HydrophobicContact CG1-CB 4.23Å; V186-W224 HydrophobicContact CG1-CG 4.4Å; A190-W224 HydrophobicContact CB-CE3 4.11Å; Y220-W224 AromaticContact CE1-CD1 3.98Å; Y220-W224 AromaticContact CE1-NE1 3.58Å; Y220-W224 AromaticContact CE2-NE1 3.74Å; Y220-W224 AromaticContact CZ-NE1 3.22Å; Y220-W224 PolarHBondContact OH-NE1 3.09Å; Y220-W224 VanDerWaalsContact OH-NE1 3.14Å; I221-W224 PolarHBondContact O-N 2.92Å; M222-W224 PolarHBondContact O-N 3.24Å; M222-W224 VanDerWaalsContact O-N 3.11Å; W224-R254 HydrophobicContact CH2-CB 3.77Å; W224-R254 HydrophobicContact CH2-CG 3.97Å; W224-R254 HydrophobicContact CZ2-CB 3.78Å; W224-R254 HydrophobicContact CZ2-CG 3.69Å
225	C	90.9	Very high	90.5	Very high	8 Å²	8	42.5 Å²	42.5	5%	0.054	22%	0.218	C	C	.	.			trans	-125.9	83.5	-177.3	-62.6	0	0	0	0	110.3	I221 M222 N227 L228	I221-C225 PolarHBondContact O-N 3.48Å; I221-C225 VanDerWaalsContact O-N 3.14Å; M222-C225 CarbonylContact O-C 3.59Å; M222-C225 PolarHBondContact O-N 3.49Å; M222-C225 VanDerWaalsContact O-N 3.08Å; C225-N227 PolarHBondContact O-N 3.26Å; C225-L228 HydrophobicContact CB-CB 4.27Å; C225-L228 HydrophobicContact CB-CD1 3.69Å; C225-L228 WeakPolarHBondContact O-CB 3.37Å
226	L	85.1	Confident	90.7	Very high	95 Å²	95	43 Å²	43	50%	0.497	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73	-22.1	-169.8	-65.9	169.1	0	0	0	114.8	M222 L228 Y248	M222-L226 WeakPolarHBondContact O-CD2 3.33Å; M222-L226 PolarHBondContact O-N 3.26Å; L226-L228 VanDerWaalsContact C-N 3.26Å; L226-L228 PolarHBondContact O-N 3.05Å; L226-Y248 HydrophobicContact CD1-CD2 4.14Å; L226-Y248 HydrophobicContact CD1-CE2 4.07Å
227	N	90.3	Very high	90.8	Very high	107 Å²	107	44 Å²	44	57%	0.572	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.7	9.6	-178.8	-68.5	-19.6	0	0	0	113.7	H193 C225	H193-N227 PolarHBondContact O-ND2 3.3Å; C225-N227 PolarHBondContact O-N 3.26Å
228	L	92	Very high	90.5	Very high	7 Å²	7	47.4 Å²	47.4	4%	0.037	25%	0.247	C	C	.	.			trans	-82.8	118.2	-169	-163.6	167.2	0	0	0	110.1	L195 L198 I221 C225 L226 V230 L231 V236	L195-L228 WeakPolarHBondContact O-CA 3.19Å; L198-L228 HydrophobicContact CB-CD1 3.74Å; L198-L228 HydrophobicContact CB-CG 4.31Å; L198-L228 HydrophobicContact CD2-CD1 4.01Å; I221-L228 HydrophobicContact CG2-CD1 4.36Å; C225-L228 HydrophobicContact CB-CB 4.27Å; C225-L228 HydrophobicContact CB-CD1 3.69Å; C225-L228 WeakPolarHBondContact O-CB 3.37Å; L226-L228 VanDerWaalsContact C-N 3.26Å; L226-L228 PolarHBondContact O-N 3.05Å; L228-V230 VanDerWaalsContact CD2-O 3.24Å; L228-V230 WeakPolarHBondContact CD2-O 3.49Å; L228-L231 HydrophobicContact CD2-CB 3.73Å; L228-V236 HydrophobicContact CD2-CG2 3.95Å; L228-V236 WeakPolarHBondContact O-CG2 3.4Å
229	K	92.3	Very high	90.2	Very high	109 Å²	109	48.5 Å²	48.5	47%	0.474	25%	0.252	S	S	.	.			trans	-98.4	-27.9	-173.9	-55.1	178.7	-169	166.1	0	113.5	E196 V236	E196-K229 HydrophobicContact CB-CD 4.3Å; E196-K229 HydrophobicContact CB-CG 4.39Å; E196-K229 VanDerWaalsContact CD-CE 3.4Å; E196-K229 HydrophobicContact CG-CD 4.45Å; E196-K229 PolarHBondContact O-N 2.89Å; E196-K229 WeakPolarHBondContact OE1-CE 3.25Å; E196-K229 IonicContact OE1-NZ 2.79Å; E196-K229 PolarHBondContact OE1-NZ 2.79Å; E196-K229 WeakPolarHBondContact OE2-CE 3.34Å; E196-K229 IonicContact OE2-NZ 2.69Å; E196-K229 PolarHBondContact OE2-NZ 3.47Å; K229-V236 PolarHBondContact O-N 3.12Å
230	V	93.8	Very high	90.1	Very high	28 Å²	28	49.6 Å²	49.6	17%	0.17	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	120.8	179.1	-174.7	0	0	0	0	109.6	E196 Q197 L198 L228 Y234	E196-V230 PolarHBondContact O-N 3.4Å; E196-V230 VanDerWaalsContact O-N 3.09Å; Q197-V230 WeakPolarHBondContact CA-O 3.4Å; Q197-V230 HydrophobicContact CB-CB 4.39Å; Q197-V230 HydrophobicContact CG-CB 4Å; Q197-V230 HydrophobicContact CG-CG2 4.26Å; L198-V230 PolarHBondContact N-O 2.91Å; L228-V230 VanDerWaalsContact CD2-O 3.24Å; L228-V230 WeakPolarHBondContact CD2-O 3.49Å; V230-Y234 WeakPolarHBondContact CA-O 3.36Å
231	L	94.1	Very high	89.9	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	126.1	176.1	-176.3	52.3	0	0	0	108.9	L198 R218 I221 M222 L228 G233 Y234 V236	L198-L231 HydrophobicContact CB-CD1 4.02Å; L198-L231 HydrophobicContact CD2-CD1 4.33Å; L198-L231 HydrophobicContact CG-CD1 4.17Å; L198-L231 CarbonylContact O-C 3.38Å; L198-L231 WeakPolarHBondContact O-CA 3.11Å; R218-L231 HydrophobicContact CB-CD2 3.75Å; R218-L231 HydrophobicContact CG-CD2 3.82Å; R218-L231 HydrophobicContact CG-CG 4.39Å; R218-L231 PolarHBondContact NH1-O 2.94Å; I221-L231 HydrophobicContact CB-CD2 4.18Å; I221-L231 HydrophobicContact CG2-CD1 4.15Å; I221-L231 HydrophobicContact CG2-CD2 4.13Å; M222-L231 HydrophobicContact CG-CD2 4.33Å; L228-L231 HydrophobicContact CD2-CB 3.73Å; L231-G233 PolarHBondContact O-N 2.96Å; L231-G233 VanDerWaalsContact O-N 3.16Å; L231-Y234 PolarHBondContact N-O 2.9Å; L231-Y234 PolarHBondContact O-N 3.38Å; L231-Y234 VanDerWaalsContact O-O 3.11Å; L231-V236 HydrophobicContact CB-CG2 4.17Å
232	D	89.9	Confident	89.7	Confident	9 Å²	9	51.9 Å²	51.9	5%	0.048	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	55	32.6	178.4	-58.4	-62.2	0	0	0	114	L198 S199 I200 M201 Y217 Y234	L198-D232 PolarHBondContact O-N 2.92Å; S199-D232 WeakPolarHBondContact CA-OD1 3.43Å; S199-D232 PolarHBondContact OG-OD1 3.19Å; S199-D232 VanDerWaalsContact OG-OD1 3.13Å; I200-D232 PolarHBondContact N-OD1 3.32Å; M201-D232 HydrophobicContact CB-CB 4.24Å; M201-D232 WeakPolarHBondContact CB-OD1 3.35Å; M201-D232 HydrophobicContact CG-CB 4.49Å; M201-D232 PolarHBondContact N-OD1 2.78Å; M201-D232 HydrophobicContact SD-CB 4.31Å; Y217-D232 WeakPolarHBondContact CE2-OD2 3.4Å; Y217-D232 PolarHBondContact OH-OD2 3.37Å; D232-Y234 VanDerWaalsContact C-N 3.26Å; D232-Y234 HydrophobicContact CB-CD2 4.45Å; D232-Y234 VanDerWaalsContact O-CD2 3.24Å; D232-Y234 WeakPolarHBondContact O-CD2 3.45Å; D232-Y234 PolarHBondContact O-N 3.06Å
233	G	86.2	Confident	89.5	Confident	65 Å²	65	54.2 Å²	54.2	67%	0.67	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.5	-9.3	-176.5	0	0	0	0	0	115.1	L231	L231-G233 PolarHBondContact O-N 2.96Å; L231-G233 VanDerWaalsContact O-N 3.16Å
234	Y	89.9	Confident	89.4	Confident	166 Å²	166	54.2 Å²	54.2	65%	0.651	29%	0.285	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.2	133.7	176.7	-59.8	-87.1	0	0	0	111.1	V230 L231 D232 V236	V230-Y234 WeakPolarHBondContact CA-O 3.36Å; L231-Y234 PolarHBondContact N-O 2.9Å; L231-Y234 PolarHBondContact O-N 3.38Å; L231-Y234 VanDerWaalsContact O-O 3.11Å; D232-Y234 VanDerWaalsContact C-N 3.26Å; D232-Y234 HydrophobicContact CB-CD2 4.45Å; D232-Y234 VanDerWaalsContact O-CD2 3.24Å; D232-Y234 WeakPolarHBondContact O-CD2 3.45Å; D232-Y234 PolarHBondContact O-N 3.06Å; Y234-V236 PolarHBondContact O-N 3.38Å
235	I	90.8	Very high	89.3	Confident	135 Å²	135	58.4 Å²	58.4	69%	0.692	31%	0.306	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60	137.4	172.5	-61.1	173.2	0	0	0	108.9	T237	I235-T237 PolarHBondContact O-N 2.96Å
236	V	90.7	Very high	89.1	Confident	30 Å²	30	63.6 Å²	63.6	18%	0.182	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-75	119.9	176.4	167.6	0	0	0	0	109.9	M222 L228 K229 L231 Y234	M222-V236 HydrophobicContact CE-CG1 3.24Å; M222-V236 HydrophobicContact SD-CB 4.45Å; M222-V236 HydrophobicContact SD-CG1 3.69Å; M222-V236 HydrophobicContact SD-CG2 3.93Å; L228-V236 HydrophobicContact CD2-CG2 3.95Å; L228-V236 WeakPolarHBondContact O-CG2 3.4Å; K229-V236 PolarHBondContact O-N 3.12Å; L231-V236 HydrophobicContact CB-CG2 4.17Å; Y234-V236 PolarHBondContact O-N 3.38Å
237	T	88.6	Confident	89.2	Confident	54 Å²	54	59.1 Å²	59.1	33%	0.331	30%	0.301	S	S	.	.	P	Polyproline II helix	trans	-80.5	157.5	179.6	66.9	0	0	0	0	112.2	I235 K239 E240 G241	I235-T237 PolarHBondContact O-N 2.96Å; T237-K239 PolarHBondContact O-N 2.78Å; T237-E240 VanDerWaalsContact CB-OE2 3.28Å; T237-E240 WeakPolarHBondContact CB-OE2 3.48Å; T237-E240 WeakPolarHBondContact CG2-OE2 3.34Å; T237-E240 PolarHBondContact N-OE2 3.4Å; T237-E240 PolarHBondContact O-N 2.86Å; T237-E240 WeakPolarHBondContact OG1-CG 3.35Å; T237-E240 PolarHBondContact OG1-N 3.21Å; T237-E240 PolarHBondContact OG1-OE2 2.74Å; T237-G241 PolarHBondContact O-N 3.13Å
238	Q	85.6	Confident	89.1	Confident	111 Å²	111	59.3 Å²	59.3	52%	0.519	29%	0.294	S	S	.	.	H	α-helix	trans	-60.5	-27.8	173.9	-63.3	-176.2	-17.8	0	0	112.8	L242 L292	Q238-L242 PolarHBondContact O-N 3.35Å; Q238-L242 VanDerWaalsContact O-N 3.1Å; Q238-L292 HydrophobicContact CB-CD1 3.86Å; Q238-L292 HydrophobicContact CB-CD2 3.73Å; Q238-L292 HydrophobicContact CB-CG 4.48Å
239	K	85.2	Confident	88.8	Confident	51 Å²	51	63 Å²	63	22%	0.222	32%	0.32	C	S	.	.	H	α-helix	trans	-69.6	-47.2	175.4	-75.3	173.8	176.5	138	0	111.9	T237 G241 L242 K243 E289 L292	T237-K239 PolarHBondContact O-N 2.78Å; K239-G241 VanDerWaalsContact C-N 3.28Å; K239-G241 PolarHBondContact O-N 2.88Å; K239-L242 PolarHBondContact O-N 3.29Å; K239-K243 WeakPolarHBondContact O-CG 3.48Å; K239-K243 PolarHBondContact O-N 3.12Å; K239-E289 WeakPolarHBondContact CE-OE1 3.24Å; K239-E289 IonicContact NZ-OE1 2.69Å; K239-E289 PolarHBondContact NZ-OE1 3.32Å; K239-L292 HydrophobicContact CG-CD1 4.15Å
240	E	88.4	Confident	88.2	Confident	24 Å²	24	62.7 Å²	62.7	11%	0.112	32%	0.32	C	S	.	.	H	α-helix	trans	-62.1	-39.3	174.1	-68.5	159.9	110.2	0	0	111	R218 M222 T237 K243 A244	R218-E240 IonicContact CZ-OE1 2.7Å; R218-E240 IonicContact NE-OE1 3.14Å; R218-E240 PolarHBondContact NE-OE1 2.8Å; R218-E240 IonicContact NH2-OE1 3.44Å; R218-E240 PolarHBondContact NH2-OE1 3.08Å; R218-E240 IonicContact NH2-OE2 3.95Å; M222-E240 HydrophobicContact CE-CB 3.74Å; M222-E240 WeakPolarHBondContact CE-O 3.4Å; M222-E240 HydrophobicContact SD-CB 3.89Å; T237-E240 VanDerWaalsContact CB-OE2 3.28Å; T237-E240 WeakPolarHBondContact CB-OE2 3.48Å; T237-E240 WeakPolarHBondContact CG2-OE2 3.34Å; T237-E240 PolarHBondContact N-OE2 3.4Å; T237-E240 PolarHBondContact O-N 2.86Å; T237-E240 WeakPolarHBondContact OG1-CG 3.35Å; T237-E240 PolarHBondContact OG1-N 3.21Å; T237-E240 PolarHBondContact OG1-OE2 2.74Å; E240-K243 PolarHBondContact O-N 3.05Å; E240-A244 VanDerWaalsContact O-CB 3.31Å; E240-A244 WeakPolarHBondContact O-CB 3.47Å; E240-A244 PolarHBondContact O-N 3.47Å
241	G	88.5	Confident	87.6	Confident	21 Å²	21	62.9 Å²	62.9	22%	0.216	33%	0.328	C	S	.	.	H	α-helix	trans	-56	-53.7	175.6	0	0	0	0	0	112.2	T237 K239 K243 A244 E245	T237-G241 PolarHBondContact O-N 3.13Å; K239-G241 VanDerWaalsContact C-N 3.28Å; K239-G241 PolarHBondContact O-N 2.88Å; G241-K243 PolarHBondContact O-N 3.16Å; G241-A244 WeakPolarHBondContact O-CB 3.41Å; G241-A244 PolarHBondContact O-N 3.14Å; G241-A244 VanDerWaalsContact O-N 3.15Å; G241-E245 PolarHBondContact O-N 3.21Å
242	L	87.1	Confident	86.8	Confident	27 Å²	27	68.7 Å²	68.7	14%	0.141	35%	0.353	C	S	.	.	H	α-helix	trans	-63.1	-38.6	176.2	-71.2	179.6	0	0	0	113	Q238 K239 A244 W246 L288 I291 L292	Q238-L242 PolarHBondContact O-N 3.35Å; Q238-L242 VanDerWaalsContact O-N 3.1Å; K239-L242 PolarHBondContact O-N 3.29Å; L242-A244 VanDerWaalsContact C-N 3.29Å; L242-A244 PolarHBondContact O-N 3Å; L242-W246 VanDerWaalsContact O-CB 3.28Å; L242-W246 WeakPolarHBondContact O-CB 3.14Å; L242-W246 PolarHBondContact O-N 2.9Å; L242-L288 HydrophobicContact CB-CD2 3.79Å; L242-L288 HydrophobicContact CD1-CD2 3.96Å; L242-I291 HydrophobicContact CD1-CB 4.25Å; L242-I291 HydrophobicContact CD1-CG2 3.79Å; L242-I291 HydrophobicContact CD2-CG2 4.41Å; L242-L292 HydrophobicContact CD1-CD1 4.35Å; L242-L292 HydrophobicContact CD1-CD2 3.53Å; L242-L292 HydrophobicContact CD1-CG 3.66Å; L242-L292 HydrophobicContact CG-CD2 4.2Å
243	K	87.2	Confident	86.2	Confident	57 Å²	57	68.3 Å²	68.3	25%	0.248	35%	0.352	C	S	.	.	H	α-helix	trans	-62.7	-36.9	174.3	-71.3	178.6	-172.7	179.3	0	110.9	P219 K239 E240 G241 L247 D285 L288	P219-K243 HydrophobicContact CB-CB 3.9Å; P219-K243 HydrophobicContact CG-CB 4.02Å; K239-K243 WeakPolarHBondContact O-CG 3.48Å; K239-K243 PolarHBondContact O-N 3.12Å; E240-K243 PolarHBondContact O-N 3.05Å; G241-K243 PolarHBondContact O-N 3.16Å; K243-L247 WeakPolarHBondContact O-CB 3.46Å; K243-L247 WeakPolarHBondContact O-CG 3.45Å; K243-L247 PolarHBondContact O-N 3.11Å; K243-D285 WeakPolarHBondContact CE-OD1 3.33Å; K243-D285 IonicContact NZ-OD1 3.49Å; K243-D285 PolarHBondContact NZ-OD1 3.15Å; K243-L288 HydrophobicContact CD-CD1 4.14Å; K243-L288 HydrophobicContact CG-CD1 3.89Å
244	A	89.8	Confident	86	Confident	2 Å²	2	68.6 Å²	68.6	2%	0.017	33%	0.333	C	S	.	.	H	α-helix	trans	-73	-43.1	177.2	0	0	0	0	0	113.8	P219 M222 S223 E240 G241 L242 W246 L247 Y248	P219-A244 HydrophobicContact CB-CB 4.39Å; P219-A244 WeakPolarHBondContact O-CA 3.28Å; P219-A244 VanDerWaalsContact O-CB 3.25Å; P219-A244 WeakPolarHBondContact O-CB 3.43Å; M222-A244 HydrophobicContact CB-CB 3.52Å; M222-A244 HydrophobicContact CE-CB 3.92Å; S223-A244 WeakPolarHBondContact CB-O 3.43Å; E240-A244 VanDerWaalsContact O-CB 3.31Å; E240-A244 WeakPolarHBondContact O-CB 3.47Å; E240-A244 PolarHBondContact O-N 3.47Å; G241-A244 WeakPolarHBondContact O-CB 3.41Å; G241-A244 PolarHBondContact O-N 3.14Å; G241-A244 VanDerWaalsContact O-N 3.15Å; L242-A244 VanDerWaalsContact C-N 3.29Å; L242-A244 PolarHBondContact O-N 3Å; A244-W246 VanDerWaalsContact C-N 3.33Å; A244-L247 PolarHBondContact O-N 3.05Å; A244-Y248 WeakPolarHBondContact O-CB 3.42Å; A244-Y248 PolarHBondContact O-N 3.24Å
245	E	88.9	Confident	85.7	Confident	121 Å²	121	64 Å²	64	57%	0.565	33%	0.325	S	S	*	.	H	α-helix	trans	-62.5	-40.8	173.3	-73.9	-176	169.3	0	0	111.4	G241 Y248 S249	G241-E245 PolarHBondContact O-N 3.21Å; E245-Y248 WeakPolarHBondContact O-CB 3.41Å; E245-Y248 PolarHBondContact O-N 2.88Å; E245-S249 PolarHBondContact O-N 2.67Å
246	W	87.4	Confident	85.5	Confident	116 Å²	116	59.5 Å²	59.5	44%	0.439	30%	0.299	S	S	.	.	H	α-helix	trans	-63.9	-46.8	174	177	90.5	0	0	0	111.1	L242 A244 Y248 S249 Q250 V271	L242-W246 VanDerWaalsContact O-CB 3.28Å; L242-W246 WeakPolarHBondContact O-CB 3.14Å; L242-W246 PolarHBondContact O-N 2.9Å; A244-W246 VanDerWaalsContact C-N 3.33Å; W246-Y248 VanDerWaalsContact C-N 3.28Å; W246-Y248 PolarHBondContact O-N 3.09Å; W246-S249 PolarHBondContact O-N 3.05Å; W246-S249 VanDerWaalsContact O-N 3.1Å; W246-S249 PolarHBondContact O-OG 2.65Å; W246-Q250 HydrophobicContact CD2-CG 3.9Å; W246-Q250 HydrophobicContact CE3-CG 4.19Å; W246-Q250 HydrophobicContact CH2-CG 3.89Å; W246-Q250 HydrophobicContact CZ2-CG 3.58Å; W246-Q250 HydrophobicContact CZ3-CG 4.17Å; W246-Q250 WeakPolarHBondContact O-CG 3.16Å; W246-Q250 PolarHBondContact O-N 3.23Å; W246-V271 HydrophobicContact CH2-CG1 3.81Å; W246-V271 HydrophobicContact CZ3-CG1 3.4Å; W246-V271 VanDerWaalsContact CZ3-CG1 3.4Å
247	L	87.1	Confident	85.3	Confident	1 Å²	1	64.8 Å²	64.8	1%	0.005	32%	0.316	C	S	.	.	H	α-helix	trans	-57.3	-39.7	173.7	-83.3	170.2	0	0	0	112.6	P219 K243 A244 G251 Y267 V271	P219-L247 HydrophobicContact CB-CD1 3.78Å; K243-L247 WeakPolarHBondContact O-CB 3.46Å; K243-L247 WeakPolarHBondContact O-CG 3.45Å; K243-L247 PolarHBondContact O-N 3.11Å; A244-L247 PolarHBondContact O-N 3.05Å; L247-G251 PolarHBondContact O-N 3.42Å; L247-Y267 HydrophobicContact CD2-CE1 4.26Å; L247-V271 HydrophobicContact CD2-CG1 3.82Å
248	Y	86.8	Confident	85.2	Confident	112 Å²	112	63.5 Å²	63.5	44%	0.439	31%	0.309	S	S	.	.	H	α-helix	trans	-61.5	-47.7	174.3	-178.5	-82.2	0	0	0	111	S223 L226 A244 E245 W246 Q250 G251	S223-Y248 WeakPolarHBondContact O-CD2 3.39Å; L226-Y248 HydrophobicContact CD1-CD2 4.14Å; L226-Y248 HydrophobicContact CD1-CE2 4.07Å; A244-Y248 WeakPolarHBondContact O-CB 3.42Å; A244-Y248 PolarHBondContact O-N 3.24Å; E245-Y248 WeakPolarHBondContact O-CB 3.41Å; E245-Y248 PolarHBondContact O-N 2.88Å; W246-Y248 VanDerWaalsContact C-N 3.28Å; W246-Y248 PolarHBondContact O-N 3.09Å; Y248-Q250 PolarHBondContact O-N 3.11Å; Y248-G251 PolarHBondContact O-N 2.96Å
249	S	86.4	Confident	85.1	Confident	83 Å²	83	61.2 Å²	61.2	58%	0.58	32%	0.315	S	S	*	.	H	α-helix	trans	-64.2	-37.3	179.9	78.6	0	0	0	0	113.3	E245 W246 G251	E245-S249 PolarHBondContact O-N 2.67Å; W246-S249 PolarHBondContact O-N 3.05Å; W246-S249 VanDerWaalsContact O-N 3.1Å; W246-S249 PolarHBondContact O-OG 2.65Å; S249-G251 VanDerWaalsContact C-N 3.27Å; S249-G251 PolarHBondContact O-N 3.28Å
250	Q	80.9	Confident	85.3	Confident	103 Å²	103	62 Å²	62	48%	0.481	32%	0.319	S	S	.	.	H	α-helix	trans	-68.8	-25.7	179.8	-70.5	-62.6	-61.2	0	0	112.7	W246 Y248 K252	W246-Q250 HydrophobicContact CD2-CG 3.9Å; W246-Q250 HydrophobicContact CE3-CG 4.19Å; W246-Q250 HydrophobicContact CH2-CG 3.89Å; W246-Q250 HydrophobicContact CZ2-CG 3.58Å; W246-Q250 HydrophobicContact CZ3-CG 4.17Å; W246-Q250 WeakPolarHBondContact O-CG 3.16Å; W246-Q250 PolarHBondContact O-N 3.23Å; Y248-Q250 PolarHBondContact O-N 3.11Å; Q250-K252 PolarHBondContact O-N 2.98Å
251	G	79.8	Confident	85.3	Confident	32 Å²	32	61.9 Å²	61.9	33%	0.33	32%	0.319	S	S	.	.			trans	65.8	-23.6	179.7	0	0	0	0	0	115.9	L247 Y248 S249 G253 R254 S255	L247-G251 PolarHBondContact O-N 3.42Å; Y248-G251 PolarHBondContact O-N 2.96Å; S249-G251 VanDerWaalsContact C-N 3.27Å; S249-G251 PolarHBondContact O-N 3.28Å; G251-G253 PolarHBondContact O-N 3.41Å; G251-R254 CarbonylContact O-C 3.13Å; G251-R254 WeakPolarHBondContact O-CA 3.24Å; G251-R254 WeakPolarHBondContact O-CB 3.49Å; G251-R254 PolarHBondContact O-N 2.74Å; G251-S255 PolarHBondContact O-N 3.26Å
252	K	77.9	Confident	85.3	Confident	122 Å²	122	64.4 Å²	64.4	53%	0.53	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-58.5	-44.5	-174.4	-170.9	170	177.7	179.3	0	112.6	Q250 R254 S255 Y256 Y267	Q250-K252 PolarHBondContact O-N 2.98Å; K252-R254 PolarHBondContact O-N 3.37Å; K252-S255 WeakPolarHBondContact O-CB 3.38Å; K252-S255 PolarHBondContact O-N 3.32Å; K252-S255 VanDerWaalsContact O-N 3.11Å; K252-S255 PolarHBondContact O-OG 3.48Å; K252-Y256 WeakPolarHBondContact O-CD2 3.44Å; K252-Y256 WeakPolarHBondContact O-CE2 3.35Å; K252-Y267 HydrophobicContact CB-CE2 4.37Å; K252-Y267 HydrophobicContact CD-CD2 4.32Å; K252-Y267 HydrophobicContact CD-CE2 3.72Å; K252-Y267 HydrophobicContact CG-CD2 4.44Å; K252-Y267 HydrophobicContact CG-CE2 3.93Å
253	G	76.2	Confident	85.4	Confident	2 Å²	2	67.6 Å²	67.6	2%	0.021	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-61.3	-26.1	172.4	0	0	0	0	0	114.2	Y220 G251 Y267	Y220-G253 WeakPolarHBondContact CE2-O 3.44Å; Y220-G253 PolarHBondContact OH-O 3.39Å; G251-G253 PolarHBondContact O-N 3.41Å; G253-Y267 VanDerWaalsContact CA-CE1 3.47Å
254	R	82.1	Confident	85.5	Confident	71 Å²	71	64.9 Å²	64.9	27%	0.268	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-95	1.1	179.2	-54.9	179.1	69.5	-154.1	7.7	112.9	W224 G251 K252 R257	W224-R254 HydrophobicContact CH2-CB 3.77Å; W224-R254 HydrophobicContact CH2-CG 3.97Å; W224-R254 HydrophobicContact CZ2-CB 3.78Å; W224-R254 HydrophobicContact CZ2-CG 3.69Å; G251-R254 CarbonylContact O-C 3.13Å; G251-R254 WeakPolarHBondContact O-CA 3.24Å; G251-R254 WeakPolarHBondContact O-CB 3.49Å; G251-R254 PolarHBondContact O-N 2.74Å; K252-R254 PolarHBondContact O-N 3.37Å; R254-R257 PolarHBondContact O-NH1 3.33Å
255	S	84	Confident	85.4	Confident	69 Å²	69	64.8 Å²	64.8	48%	0.483	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-31.3	172	74.9	0	0	0	0	112.4	G251 K252 R257	G251-S255 PolarHBondContact O-N 3.26Å; K252-S255 WeakPolarHBondContact O-CB 3.38Å; K252-S255 PolarHBondContact O-N 3.32Å; K252-S255 VanDerWaalsContact O-N 3.11Å; K252-S255 PolarHBondContact O-OG 3.48Å; S255-R257 PolarHBondContact O-NH1 2.96Å
256	Y	87.3	Confident	85.4	Confident	40 Å²	40	64.3 Å²	64.3	16%	0.157	33%	0.329	C	S	.	.			trans	-62.9	156	174.9	-58.4	-72.7	0	0	0	111.8	N184 K252 Q260 Q263 L264 Y267	N184-Y256 WeakPolarHBondContact OD1-CB 3.48Å; K252-Y256 WeakPolarHBondContact O-CD2 3.44Å; K252-Y256 WeakPolarHBondContact O-CE2 3.35Å; Y256-Q260 HydrophobicContact CD1-CB 4.4Å; Y256-Q263 HydrophobicContact CD1-CB 4.08Å; Y256-Q263 HydrophobicContact CE1-CB 3.81Å; Y256-L264 HydrophobicContact CD2-CB 4.26Å; Y256-L264 HydrophobicContact CD2-CD1 3.78Å; Y256-L264 HydrophobicContact CE2-CD1 4.36Å; Y256-L264 HydrophobicContact CG-CB 4.23Å; Y256-L264 HydrophobicContact CG-CD1 4.46Å; Y256-Y267 AromaticContact CE2-CD1 3.83Å; Y256-Y267 HydrophobicContact CE2-CD1 3.83Å; Y256-Y267 AromaticContact CE2-CG 3.97Å; Y256-Y267 HydrophobicContact CE2-CG 3.97Å
257	R	86.6	Confident	85.4	Confident	141 Å²	141	59.7 Å²	59.7	53%	0.532	31%	0.312	S	S	.	.			trans	-128	157.6	-179.6	-63.2	-67.9	174	-100	5.2	110.6	N184 R254 S255 G259 Q260	N184-R257 PolarHBondContact ND2-O 2.59Å; R254-R257 PolarHBondContact O-NH1 3.33Å; S255-R257 PolarHBondContact O-NH1 2.96Å; R257-G259 PolarHBondContact O-N 3.46Å; R257-Q260 VanDerWaalsContact O-CB 3.29Å; R257-Q260 WeakPolarHBondContact O-CB 3.32Å; R257-Q260 PolarHBondContact O-N 3.43Å
258	P	85.6	Confident	85.5	Confident	28 Å²	28	59.6 Å²	59.6	18%	0.182	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.1	134.3	167.2	-28.2	36.9	0	0	0	111.4	N184 Y188	N184-P258 HydrophobicContact CB-CB 4.44Å; N184-P258 HydrophobicContact CB-CG 4.09Å; Y188-P258 HydrophobicContact CE2-CB 4.5Å; Y188-P258 HydrophobicContact CE2-CG 3.72Å
259	G	84.6	Confident	85.4	Confident	63 Å²	63	55.2 Å²	55.2	65%	0.649	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	98.4	-18	-164.2	0	0	0	0	0	114.7	D182 R257	D182-G259 WeakPolarHBondContact OD2-CA 3.43Å; D182-G259 PolarHBondContact OD2-N 2.92Å; R257-G259 PolarHBondContact O-N 3.46Å
260	Q	89.1	Confident	85.3	Confident	66 Å²	66	56.4 Å²	56.4	31%	0.308	30%	0.302	S	S	.	.			trans	-104.1	28.1	-177.6	-58.4	-178.5	-75.3	0	0	113.8	Y256 R257 V262 Q263 L264	Y256-Q260 HydrophobicContact CD1-CB 4.4Å; R257-Q260 VanDerWaalsContact O-CB 3.29Å; R257-Q260 WeakPolarHBondContact O-CB 3.32Å; R257-Q260 PolarHBondContact O-N 3.43Å; Q260-V262 PolarHBondContact O-N 3.41Å; Q260-Q263 HydrophobicContact CB-CB 4.47Å; Q260-Q263 PolarHBondContact O-N 3.27Å; Q260-Q263 VanDerWaalsContact O-N 3.12Å; Q260-L264 PolarHBondContact O-N 3.41Å
261	H	88.9	Confident	85.3	Confident	22 Å²	22	53.2 Å²	53.2	10%	0.102	29%	0.29	C	S	.	.	H	α-helix	trans	-55.2	-45.5	-174.5	170.7	57.8	0	0	0	113.9	R181 D182 C205 Q263 L264 V265	R181-H261 PolarHBondContact O-CD2 2.91Å; D182-H261 HydrophobicContact CB-CB 4.46Å; D182-H261 WeakPolarHBondContact OD1-CB 3.49Å; C205-H261 PolarHBondContact O-CE1 2.94Å; C205-H261 VanDerWaalsContact O-CE1 3.32Å; H261-Q263 VanDerWaalsContact C-N 3.29Å; H261-Q263 PolarHBondContact O-N 3.43Å; H261-L264 PolarHBondContact O-N 3.42Å; H261-V265 WeakPolarHBondContact CE1-CG2 3.46Å; H261-V265 WeakPolarHBondContact O-CG2 3.46Å; H261-V265 PolarHBondContact O-N 3.1Å
262	V	88.3	Confident	85.6	Confident	75 Å²	75	52.2 Å²	52.2	46%	0.455	28%	0.278	S	S	.	.	H	α-helix	trans	-59.2	-38.6	178.2	176.6	0	0	0	0	112.5	L212 Q260 V265 Q266	L212-V262 HydrophobicContact CD2-CG1 4.13Å; Q260-V262 PolarHBondContact O-N 3.41Å; V262-V265 PolarHBondContact O-N 2.87Å; V262-Q266 VanDerWaalsContact O-CG 3.3Å; V262-Q266 WeakPolarHBondContact O-CG 3.24Å; V262-Q266 PolarHBondContact O-N 3.38Å
263	Q	88.6	Confident	85.7	Confident	94 Å²	94	48.7 Å²	48.7	44%	0.439	27%	0.267	S	S	.	.	H	α-helix	trans	-72.2	-38.4	180	-63.5	174.6	-13	0	0	111.4	Y256 Q260 H261 Y267	Y256-Q263 HydrophobicContact CD1-CB 4.08Å; Y256-Q263 HydrophobicContact CE1-CB 3.81Å; Q260-Q263 HydrophobicContact CB-CB 4.47Å; Q260-Q263 PolarHBondContact O-N 3.27Å; Q260-Q263 VanDerWaalsContact O-N 3.12Å; H261-Q263 VanDerWaalsContact C-N 3.29Å; H261-Q263 PolarHBondContact O-N 3.43Å; Q263-Y267 PolarHBondContact O-N 3Å; Q263-Y267 VanDerWaalsContact O-N 3.15Å
264	L	89.4	Confident	85.5	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-62.2	-47.9	171.4	173.1	66.6	0	0	0	111	L183 Y220 Y256 Q260 H261 Q266 Y267 L268	L183-L264 HydrophobicContact CB-CD2 4.07Å; L183-L264 HydrophobicContact CD2-CD2 4.16Å; L183-L264 HydrophobicContact CG-CD2 4.17Å; Y220-L264 HydrophobicContact CD1-CD2 4.39Å; Y220-L264 HydrophobicContact CD2-CD1 4.08Å; Y220-L264 HydrophobicContact CE1-CD1 4.48Å; Y220-L264 HydrophobicContact CE1-CD2 3.69Å; Y220-L264 HydrophobicContact CE2-CD1 3.51Å; Y220-L264 HydrophobicContact CE2-CD2 4.2Å; Y220-L264 HydrophobicContact CE2-CG 4.48Å; Y256-L264 HydrophobicContact CD2-CB 4.26Å; Y256-L264 HydrophobicContact CD2-CD1 3.78Å; Y256-L264 HydrophobicContact CE2-CD1 4.36Å; Y256-L264 HydrophobicContact CG-CB 4.23Å; Y256-L264 HydrophobicContact CG-CD1 4.46Å; Q260-L264 PolarHBondContact O-N 3.41Å; H261-L264 PolarHBondContact O-N 3.42Å; L264-Q266 VanDerWaalsContact C-N 3.34Å; L264-Q266 PolarHBondContact O-N 3.01Å; L264-Y267 HydrophobicContact CD1-CD1 4.5Å; L264-Y267 WeakPolarHBondContact O-CB 3.47Å; L264-Y267 PolarHBondContact O-N 3.33Å; L264-Y267 VanDerWaalsContact O-N 3.12Å; L264-L268 HydrophobicContact CD1-CD1 3.94Å; L264-L268 HydrophobicContact CD1-CD2 4.36Å; L264-L268 HydrophobicContact CD1-CG 3.89Å; L264-L268 HydrophobicContact CD2-CD1 4.35Å; L264-L268 HydrophobicContact CG-CD1 3.88Å; L264-L268 HydrophobicContact CG-CG 4.19Å; L264-L268 WeakPolarHBondContact O-CG 3.3Å; L264-L268 PolarHBondContact O-N 2.79Å
265	V	88.8	Confident	84.4	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-61.8	-41.6	-179.7	169.1	0	0	0	0	111.7	L212 F215 H261 V262 Y267 L268 A269	L212-V265 HydrophobicContact CB-CG1 3.96Å; L212-V265 HydrophobicContact CD1-CB 4.41Å; L212-V265 HydrophobicContact CD1-CG1 4Å; L212-V265 HydrophobicContact CD1-CG2 4.49Å; L212-V265 HydrophobicContact CD2-CG1 4.36Å; L212-V265 HydrophobicContact CG-CG1 4.32Å; F215-V265 HydrophobicContact CD1-CB 4.41Å; F215-V265 HydrophobicContact CD1-CG1 3.55Å; F215-V265 HydrophobicContact CD1-CG2 4.31Å; F215-V265 HydrophobicContact CE1-CB 4.22Å; F215-V265 HydrophobicContact CE1-CG1 3.62Å; F215-V265 HydrophobicContact CE1-CG2 3.66Å; F215-V265 HydrophobicContact CE2-CG2 4.36Å; F215-V265 HydrophobicContact CG-CG1 4.34Å; F215-V265 HydrophobicContact CZ-CG1 4.44Å; F215-V265 HydrophobicContact CZ-CG2 3.7Å; H261-V265 WeakPolarHBondContact CE1-CG2 3.46Å; H261-V265 WeakPolarHBondContact O-CG2 3.46Å; H261-V265 PolarHBondContact O-N 3.1Å; V262-V265 PolarHBondContact O-N 2.87Å; V265-Y267 VanDerWaalsContact C-N 3.31Å; V265-Y267 PolarHBondContact O-N 3.38Å; V265-L268 PolarHBondContact O-N 3.44Å; V265-A269 WeakPolarHBondContact O-CB 3.34Å; V265-A269 PolarHBondContact O-N 2.84Å
266	Q	87.8	Confident	83	Confident	110 Å²	110	53.8 Å²	53.8	51%	0.514	30%	0.302	S	S	.	.	H	α-helix	trans	-60.7	-39.7	174.1	-75.1	172.3	-12.7	0	0	112.3	V262 L264	V262-Q266 VanDerWaalsContact O-CG 3.3Å; V262-Q266 WeakPolarHBondContact O-CG 3.24Å; V262-Q266 PolarHBondContact O-N 3.38Å; L264-Q266 VanDerWaalsContact C-N 3.34Å; L264-Q266 PolarHBondContact O-N 3.01Å
267	Y	88.1	Confident	81.4	Confident	19 Å²	19	55 Å²	55	8%	0.075	32%	0.316	C	S	.	.	H	α-helix	trans	-67.8	-47.8	174.1	168.9	-108.8	0	0	0	112.2	L247 K252 G253 Y256 Q263 L264 V265 A269 T270 V271	L247-Y267 HydrophobicContact CD2-CE1 4.26Å; K252-Y267 HydrophobicContact CB-CE2 4.37Å; K252-Y267 HydrophobicContact CD-CD2 4.32Å; K252-Y267 HydrophobicContact CD-CE2 3.72Å; K252-Y267 HydrophobicContact CG-CD2 4.44Å; K252-Y267 HydrophobicContact CG-CE2 3.93Å; G253-Y267 VanDerWaalsContact CA-CE1 3.47Å; Y256-Y267 AromaticContact CE2-CD1 3.83Å; Y256-Y267 HydrophobicContact CE2-CD1 3.83Å; Y256-Y267 AromaticContact CE2-CG 3.97Å; Y256-Y267 HydrophobicContact CE2-CG 3.97Å; Q263-Y267 PolarHBondContact O-N 3Å; Q263-Y267 VanDerWaalsContact O-N 3.15Å; L264-Y267 HydrophobicContact CD1-CD1 4.5Å; L264-Y267 WeakPolarHBondContact O-CB 3.47Å; L264-Y267 PolarHBondContact O-N 3.33Å; L264-Y267 VanDerWaalsContact O-N 3.12Å; V265-Y267 VanDerWaalsContact C-N 3.31Å; V265-Y267 PolarHBondContact O-N 3.38Å; Y267-A269 VanDerWaalsContact C-N 3.32Å; Y267-A269 PolarHBondContact O-N 3.5Å; Y267-T270 PolarHBondContact O-N 3.02Å; Y267-T270 PolarHBondContact O-OG1 2.7Å; Y267-V271 HydrophobicContact CD2-CG2 4.08Å; Y267-V271 HydrophobicContact CE2-CG2 3.63Å; Y267-V271 PolarHBondContact O-N 3.28Å
268	L	87.9	Confident	80	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-62	-37.8	178.7	-67.1	179.7	0	0	0	111.8	L183 F215 Y220 L264 V265 T270 V271 C272	L183-L268 HydrophobicContact CD2-CD1 3.86Å; F215-L268 HydrophobicContact CB-CB 4.02Å; F215-L268 HydrophobicContact CD2-CB 3.6Å; F215-L268 HydrophobicContact CD2-CD1 3.66Å; F215-L268 HydrophobicContact CD2-CG 4.29Å; F215-L268 HydrophobicContact CE2-CB 4.44Å; F215-L268 HydrophobicContact CE2-CD1 3.73Å; F215-L268 HydrophobicContact CG-CB 4.05Å; Y220-L268 HydrophobicContact CD1-CD1 4.27Å; Y220-L268 HydrophobicContact CD2-CD1 4.17Å; Y220-L268 HydrophobicContact CD2-CD2 3.84Å; Y220-L268 HydrophobicContact CG-CD1 3.82Å; Y220-L268 HydrophobicContact CG-CD2 4.09Å; L264-L268 HydrophobicContact CD1-CD1 3.94Å; L264-L268 HydrophobicContact CD1-CD2 4.36Å; L264-L268 HydrophobicContact CD1-CG 3.89Å; L264-L268 HydrophobicContact CD2-CD1 4.35Å; L264-L268 HydrophobicContact CG-CD1 3.88Å; L264-L268 HydrophobicContact CG-CG 4.19Å; L264-L268 WeakPolarHBondContact O-CG 3.3Å; L264-L268 PolarHBondContact O-N 2.79Å; V265-L268 PolarHBondContact O-N 3.44Å; L268-T270 PolarHBondContact O-N 2.94Å; L268-V271 PolarHBondContact O-N 3.37Å; L268-C272 CarbonylContact O-C 3.51Å; L268-C272 VanDerWaalsContact O-C 3.31Å; L268-C272 WeakPolarHBondContact O-CA 3.41Å; L268-C272 PolarHBondContact O-N 3.27Å
269	A	85.4	Confident	78.6	Confident	19 Å²	19	54.6 Å²	54.6	16%	0.157	34%	0.338	C	S	.	.	H	α-helix	trans	-65.1	-17.9	174.4	0	0	0	0	0	114.5	P213 F215 V265 Y267	P213-A269 HydrophobicContact CB-CB 3.83Å; P213-A269 HydrophobicContact CG-CB 3.4Å; P213-A269 VanDerWaalsContact CG-CB 3.4Å; F215-A269 HydrophobicContact CB-CB 4.11Å; V265-A269 WeakPolarHBondContact O-CB 3.34Å; V265-A269 PolarHBondContact O-N 2.84Å; Y267-A269 VanDerWaalsContact C-N 3.32Å; Y267-A269 PolarHBondContact O-N 3.5Å
270	T	83.7	Confident	77.3	Confident	108 Å²	108	57.1 Å²	57.1	66%	0.663	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-6.4	172.8	59.3	0	0	0	0	114.2	Y267 L268	Y267-T270 PolarHBondContact O-N 3.02Å; Y267-T270 PolarHBondContact O-OG1 2.7Å; L268-T270 PolarHBondContact O-N 2.94Å
271	V	82.5	Confident	76.1	Confident	36 Å²	36	58.2 Å²	58.2	22%	0.218	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-132	-28.5	-166.2	170.2	0	0	0	0	112.9	W246 L247 Y267 L268	W246-V271 HydrophobicContact CH2-CG1 3.81Å; W246-V271 HydrophobicContact CZ3-CG1 3.4Å; W246-V271 VanDerWaalsContact CZ3-CG1 3.4Å; L247-V271 HydrophobicContact CD2-CG1 3.82Å; Y267-V271 HydrophobicContact CD2-CG2 4.08Å; Y267-V271 HydrophobicContact CE2-CG2 3.63Å; Y267-V271 PolarHBondContact O-N 3.28Å; L268-V271 PolarHBondContact O-N 3.37Å
272	C	84.4	Confident	74.8	Confident	12 Å²	12	61.5 Å²	61.5	8%	0.081	36%	0.363	C	S	.	.	S	Bend	trans	-140.7	66	173.3	-56.2	0	0	0	0	108.2	F215 D216 L268	F215-C272 CarbonylContact C-O 3.31Å; F215-C272 VanDerWaalsContact CA-O 3.29Å; F215-C272 WeakPolarHBondContact CA-O 3.42Å; D216-C272 HydrophobicContact CB-CB 4.19Å; D216-C272 PolarHBondContact N-O 2.91Å; D216-C272 WeakPolarHBondContact O-CB 3.33Å; L268-C272 CarbonylContact O-C 3.51Å; L268-C272 VanDerWaalsContact O-C 3.31Å; L268-C272 WeakPolarHBondContact O-CA 3.41Å; L268-C272 PolarHBondContact O-N 3.27Å
273	P	80.7	Confident	74	Confident	47 Å²	47	60.1 Å²	60.1	31%	0.305	36%	0.359	S	S	.	.	B	Isolated β-bridge	trans	-68.7	140.3	177.4	28.4	-34.8	0	0	0	111.9	T275 A276	P273-T275 PolarHBondContact O-N 2.7Å; P273-A276 HydrophobicContact CG-CB 4.15Å
274	L	72.8	Confident	73.2	Confident	106 Å²	106	60.6 Å²	60.6	56%	0.555	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-18.3	168.3	-76.3	172	0	0	0	113	G214 F215 D216	G214-L274 PolarHBondContact O-N 3.03Å; F215-L274 VanDerWaalsContact C-CG 3.46Å; D216-L274 HydrophobicContact CB-CD2 4.13Å
275	T	57.7	Low	72.4	Confident	113 Å²	113	62.4 Å²	62.4	69%	0.693	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130.3	60	-175.2	62.3	0	0	0	0	109.7	P273	P273-T275 PolarHBondContact O-N 2.7Å
276	A	55.6	Low	71.8	Confident	30 Å²	30	65.3 Å²	65.3	25%	0.248	40%	0.395	C	S	.	.			trans	-59.9	155	162.8	0	0	0	0	0	110	P273 E281	P273-A276 HydrophobicContact CG-CB 4.15Å; A276-E281 HydrophobicContact CB-CB 3.83Å; A276-E281 HydrophobicContact CB-CG 4.37Å
277	S	54.1	Low	71.5	Confident	65 Å²	65	66.6 Å²	66.6	46%	0.455	40%	0.399	S	S	.	.			trans	-67	133.7	158	176.2	0	0	0	0	107.3	A279 L280 E281	S277-A279 PolarHBondContact O-N 2.69Å; S277-L280 PolarHBondContact O-N 3.38Å; S277-E281 PolarHBondContact O-N 2.86Å; S277-E281 VanDerWaalsContact O-N 3.08Å
278	P	56.5	Low	71.2	Confident	92 Å²	92	66.8 Å²	66.8	60%	0.597	40%	0.401	S	S	*	.	H	α-helix	trans	-59.8	-22.1	-177.3	21.8	-33	0	0	0	112.8	T282	P278-T282 WeakPolarHBondContact O-CB 3.44Å; P278-T282 VanDerWaalsContact O-CG2 3.27Å; P278-T282 WeakPolarHBondContact O-CG2 3.45Å; P278-T282 PolarHBondContact O-N 2.85Å; P278-T282 VanDerWaalsContact O-N 3.1Å; P278-T282 PolarHBondContact O-OG1 3.02Å
279	A	55.3	Low	70.8	Confident	70 Å²	70	69.1 Å²	69.1	58%	0.579	41%	0.412	S	S	*	.	H	α-helix	trans	-75.7	-17.4	173.6	0	0	0	0	0	114.8	S277	S277-A279 PolarHBondContact O-N 2.69Å
280	L	57	Low	70.8	Confident	115 Å²	115	75.2 Å²	75.2	60%	0.602	44%	0.435	S	S	*	.	H	α-helix	trans	-93.4	-43.6	172.1	-71.2	171.7	0	0	0	110.7	S277 T282 A283 E284	S277-L280 PolarHBondContact O-N 3.38Å; L280-T282 PolarHBondContact O-N 3.44Å; L280-A283 WeakPolarHBondContact O-CA 3.39Å; L280-A283 WeakPolarHBondContact O-CB 3.5Å; L280-A283 PolarHBondContact O-N 3.47Å; L280-E284 PolarHBondContact O-N 2.75Å
281	E	64.3	Low	70.9	Confident	89 Å²	89	74.2 Å²	74.2	42%	0.416	43%	0.425	S	S	.	.	H	α-helix	trans	-56.6	-50.1	176.6	-167.3	167.8	-157.5	0	0	111.4	A276 S277 A283 E284 D285	A276-E281 HydrophobicContact CB-CB 3.83Å; A276-E281 HydrophobicContact CB-CG 4.37Å; S277-E281 PolarHBondContact O-N 2.86Å; S277-E281 VanDerWaalsContact O-N 3.08Å; E281-A283 PolarHBondContact O-N 3.35Å; E281-E284 PolarHBondContact O-N 2.93Å; E281-E284 VanDerWaalsContact O-N 3.15Å; E281-D285 WeakPolarHBondContact O-CB 3.35Å; E281-D285 PolarHBondContact O-N 3.39Å
282	T	62.7	Low	70.8	Confident	92 Å²	92	72.7 Å²	72.7	56%	0.564	42%	0.415	S	S	*	.	H	α-helix	trans	-61.1	-26.8	174.2	50.1	0	0	0	0	113.6	P278 L280 A286	P278-T282 WeakPolarHBondContact O-CB 3.44Å; P278-T282 VanDerWaalsContact O-CG2 3.27Å; P278-T282 WeakPolarHBondContact O-CG2 3.45Å; P278-T282 PolarHBondContact O-N 2.85Å; P278-T282 VanDerWaalsContact O-N 3.1Å; P278-T282 PolarHBondContact O-OG1 3.02Å; L280-T282 PolarHBondContact O-N 3.44Å; T282-A286 WeakPolarHBondContact O-CB 3.07Å; T282-A286 PolarHBondContact O-N 3.42Å
283	A	70.3	Confident	70.6	Confident	46 Å²	46	74.9 Å²	74.9	38%	0.38	43%	0.43	S	S	.	.	H	α-helix	trans	-80.7	-26.3	177.8	0	0	0	0	0	113.1	L280 E281 K287	L280-A283 WeakPolarHBondContact O-CA 3.39Å; L280-A283 WeakPolarHBondContact O-CB 3.5Å; L280-A283 PolarHBondContact O-N 3.47Å; E281-A283 PolarHBondContact O-N 3.35Å; A283-K287 WeakPolarHBondContact O-CD 3.31Å; A283-K287 WeakPolarHBondContact O-CE 3.44Å; A283-K287 WeakPolarHBondContact O-CG 3.49Å
284	E	71.8	Confident	70.9	Confident	104 Å²	104	79.3 Å²	79.3	49%	0.486	45%	0.445	S	S	.	.	H	α-helix	trans	-84.2	-44.8	172.6	-67.4	-172.6	166.9	0	0	111.3	L280 E281 A286 K287 L288	L280-E284 PolarHBondContact O-N 2.75Å; E281-E284 PolarHBondContact O-N 2.93Å; E281-E284 VanDerWaalsContact O-N 3.15Å; E284-A286 VanDerWaalsContact C-N 3.3Å; E284-A286 PolarHBondContact O-N 2.82Å; E284-K287 WeakPolarHBondContact O-CA 3.44Å; E284-K287 WeakPolarHBondContact O-CB 3.25Å; E284-K287 PolarHBondContact O-N 3.25Å; E284-L288 PolarHBondContact O-N 2.88Å
285	D	72.6	Confident	71.5	Confident	38 Å²	38	79.5 Å²	79.5	20%	0.203	44%	0.443	C	S	.	.	H	α-helix	trans	-66.7	-30.2	176.7	-81.2	12	0	0	0	112.1	K243 E281 K287 L288 E289	K243-D285 WeakPolarHBondContact CE-OD1 3.33Å; K243-D285 IonicContact NZ-OD1 3.49Å; K243-D285 PolarHBondContact NZ-OD1 3.15Å; E281-D285 WeakPolarHBondContact O-CB 3.35Å; E281-D285 PolarHBondContact O-N 3.39Å; D285-K287 VanDerWaalsContact C-N 3.34Å; D285-L288 PolarHBondContact O-N 2.78Å; D285-E289 PolarHBondContact O-N 3.12Å
286	A	76.1	Confident	72.7	Confident	61 Å²	61	78.5 Å²	78.5	50%	0.504	43%	0.427	S	S	.	.	H	α-helix	trans	-67.8	-29.6	169.1	0	0	0	0	0	113.3	T282 E284 K290	T282-A286 WeakPolarHBondContact O-CB 3.07Å; T282-A286 PolarHBondContact O-N 3.42Å; E284-A286 VanDerWaalsContact C-N 3.3Å; E284-A286 PolarHBondContact O-N 2.82Å; A286-K290 WeakPolarHBondContact O-CB 3.36Å; A286-K290 PolarHBondContact O-N 3.17Å
287	K	81.9	Confident	74.2	Confident	136 Å²	136	83.2 Å²	83.2	59%	0.591	44%	0.442	S	S	*	.	H	α-helix	trans	-70.4	-41.4	170.5	-66.6	164.5	-170.1	168.9	0	110.3	A283 E284 D285 K290 I291	A283-K287 WeakPolarHBondContact O-CD 3.31Å; A283-K287 WeakPolarHBondContact O-CE 3.44Å; A283-K287 WeakPolarHBondContact O-CG 3.49Å; E284-K287 WeakPolarHBondContact O-CA 3.44Å; E284-K287 WeakPolarHBondContact O-CB 3.25Å; E284-K287 PolarHBondContact O-N 3.25Å; D285-K287 VanDerWaalsContact C-N 3.34Å; K287-K290 WeakPolarHBondContact O-CB 3.3Å; K287-K290 PolarHBondContact O-N 3.03Å; K287-I291 WeakPolarHBondContact O-CG1 3.32Å; K287-I291 PolarHBondContact O-N 3.38Å
288	L	81.6	Confident	75.7	Confident	23 Å²	23	84.9 Å²	84.9	12%	0.12	44%	0.442	C	S	.	.	H	α-helix	trans	-65.1	-43.3	177	-68	168.5	0	0	0	111.7	L242 K243 E284 D285 K290 I291 L292	L242-L288 HydrophobicContact CB-CD2 3.79Å; L242-L288 HydrophobicContact CD1-CD2 3.96Å; K243-L288 HydrophobicContact CD-CD1 4.14Å; K243-L288 HydrophobicContact CG-CD1 3.89Å; E284-L288 PolarHBondContact O-N 2.88Å; D285-L288 PolarHBondContact O-N 2.78Å; L288-K290 VanDerWaalsContact C-N 3.29Å; L288-K290 PolarHBondContact O-N 2.7Å; L288-I291 HydrophobicContact CD2-CD1 4.45Å; L288-I291 WeakPolarHBondContact O-CB 3.42Å; L288-I291 PolarHBondContact O-N 3.5Å; L288-I291 VanDerWaalsContact O-N 3.09Å; L288-L292 WeakPolarHBondContact O-CG 3.42Å; L288-L292 PolarHBondContact O-N 2.88Å
289	E	80.3	Confident	77.1	Confident	50 Å²	50	86.3 Å²	86.3	23%	0.234	44%	0.441	C	S	.	.	H	α-helix	trans	-64.5	-31.6	171	-75.8	-60	163.2	0	0	112.6	K239 D285 I291 L292 S293 R296	K239-E289 WeakPolarHBondContact CE-OE1 3.24Å; K239-E289 IonicContact NZ-OE1 2.69Å; K239-E289 PolarHBondContact NZ-OE1 3.32Å; D285-E289 PolarHBondContact O-N 3.12Å; E289-I291 VanDerWaalsContact C-N 3.3Å; E289-I291 PolarHBondContact O-N 2.83Å; E289-L292 PolarHBondContact O-N 3.47Å; E289-S293 WeakPolarHBondContact O-CB 3.35Å; E289-S293 PolarHBondContact O-N 2.75Å; E289-S293 PolarHBondContact O-OG 3.39Å; E289-R296 IonicContact OE2-CZ 3.75Å; E289-R296 IonicContact OE2-NH1 2.72Å; E289-R296 PolarHBondContact OE2-NH1 2.9Å; E289-R296 IonicContact OE2-NH2 2.88Å
290	K	85.2	Confident	78.4	Confident	146 Å²	146	89.7 Å²	89.7	64%	0.635	44%	0.439	S	S	*	.	H	α-helix	trans	-68	-29.7	172.1	-166.4	172.3	-177	179.1	0	112.5	A286 K287 L288 S293 K294	A286-K290 WeakPolarHBondContact O-CB 3.36Å; A286-K290 PolarHBondContact O-N 3.17Å; K287-K290 WeakPolarHBondContact O-CB 3.3Å; K287-K290 PolarHBondContact O-N 3.03Å; L288-K290 VanDerWaalsContact C-N 3.29Å; L288-K290 PolarHBondContact O-N 2.7Å; K290-S293 WeakPolarHBondContact CA-OG 3.35Å; K290-S293 PolarHBondContact O-OG 2.95Å; K290-K294 WeakPolarHBondContact O-CB 3.37Å; K290-K294 WeakPolarHBondContact O-CG 3.36Å; K290-K294 PolarHBondContact O-N 3.47Å
291	I	84.8	Confident	80	Confident	88 Å²	88	87.9 Å²	87.9	45%	0.451	43%	0.427	S	S	.	.	H	α-helix	trans	-74	-50.9	171.9	-67	162.3	0	0	0	110	L242 K287 L288 E289 S293 K294 Q295	L242-I291 HydrophobicContact CD1-CB 4.25Å; L242-I291 HydrophobicContact CD1-CG2 3.79Å; L242-I291 HydrophobicContact CD2-CG2 4.41Å; K287-I291 WeakPolarHBondContact O-CG1 3.32Å; K287-I291 PolarHBondContact O-N 3.38Å; L288-I291 HydrophobicContact CD2-CD1 4.45Å; L288-I291 WeakPolarHBondContact O-CB 3.42Å; L288-I291 PolarHBondContact O-N 3.5Å; L288-I291 VanDerWaalsContact O-N 3.09Å; E289-I291 VanDerWaalsContact C-N 3.3Å; E289-I291 PolarHBondContact O-N 2.83Å; I291-S293 PolarHBondContact O-N 3.41Å; I291-K294 PolarHBondContact O-N 3.45Å; I291-Q295 WeakPolarHBondContact O-CB 3.44Å; I291-Q295 PolarHBondContact O-N 3.15Å
292	L	81.1	Confident	81	Confident	3 Å²	3	87.4 Å²	87.4	2%	0.016	43%	0.427	C	S	.	.	H	α-helix	trans	-62.9	-41.4	-179.6	-67.1	172.1	0	0	0	112.3	Q238 K239 L242 L288 E289 Q295 R296	Q238-L292 HydrophobicContact CB-CD1 3.86Å; Q238-L292 HydrophobicContact CB-CD2 3.73Å; Q238-L292 HydrophobicContact CB-CG 4.48Å; K239-L292 HydrophobicContact CG-CD1 4.15Å; L242-L292 HydrophobicContact CD1-CD1 4.35Å; L242-L292 HydrophobicContact CD1-CD2 3.53Å; L242-L292 HydrophobicContact CD1-CG 3.66Å; L242-L292 HydrophobicContact CG-CD2 4.2Å; L288-L292 WeakPolarHBondContact O-CG 3.42Å; L288-L292 PolarHBondContact O-N 2.88Å; E289-L292 PolarHBondContact O-N 3.47Å; L292-Q295 PolarHBondContact O-N 2.98Å; L292-R296 WeakPolarHBondContact O-CB 3.19Å; L292-R296 WeakPolarHBondContact O-CG 3.29Å; L292-R296 PolarHBondContact O-N 3.27Å
293	S	79.5	Confident	81.7	Confident	58 Å²	58	87.8 Å²	87.8	41%	0.406	43%	0.425	S	S	.	.	H	α-helix	trans	-65.1	-38.7	174.6	56	0	0	0	0	112.5	E289 K290 I291 F297	E289-S293 WeakPolarHBondContact O-CB 3.35Å; E289-S293 PolarHBondContact O-N 2.75Å; E289-S293 PolarHBondContact O-OG 3.39Å; K290-S293 WeakPolarHBondContact CA-OG 3.35Å; K290-S293 PolarHBondContact O-OG 2.95Å; I291-S293 PolarHBondContact O-N 3.41Å; S293-F297 VanDerWaalsContact O-CB 3.29Å; S293-F297 WeakPolarHBondContact O-CB 3.28Å; S293-F297 PolarHBondContact O-N 3.32Å
294	K	88.3	Confident	82.1	Confident	140 Å²	140	91.9 Å²	91.9	61%	0.609	44%	0.436	S	S	*	.	H	α-helix	trans	-62.6	-42.3	169.9	-83.9	-166.1	169.7	-158.6	0	112	K290 I291 F297 H298	K290-K294 WeakPolarHBondContact O-CB 3.37Å; K290-K294 WeakPolarHBondContact O-CG 3.36Å; K290-K294 PolarHBondContact O-N 3.47Å; I291-K294 PolarHBondContact O-N 3.45Å; K294-F297 PolarHBondContact O-N 2.71Å; K294-H298 WeakPolarHBondContact O-CB 3.36Å; K294-H298 PolarHBondContact O-N 3.1Å
295	Q	84.1	Confident	82.1	Confident	110 Å²	110	92.6 Å²	92.6	51%	0.514	44%	0.44	S	S	.	.	H	α-helix	trans	-64.1	-48.3	177.2	-171.3	179.4	10.8	0	0	111.7	I291 L292 F297 H298 Q299	I291-Q295 WeakPolarHBondContact O-CB 3.44Å; I291-Q295 PolarHBondContact O-N 3.15Å; L292-Q295 PolarHBondContact O-N 2.98Å; Q295-F297 PolarHBondContact O-N 2.86Å; Q295-H298 PolarHBondContact O-N 2.99Å; Q295-Q299 WeakPolarHBondContact O-CB 3.28Å; Q295-Q299 PolarHBondContact O-N 2.87Å
296	R	84.6	Confident	81.6	Confident	92 Å²	92	96.5 Å²	96.5	35%	0.347	47%	0.465	S	S	.	.	H	α-helix	trans	-63.5	-25.4	174.7	-66.3	165.9	-167.5	149	1.7	112.7	E289 L292 R300	E289-R296 IonicContact OE2-CZ 3.75Å; E289-R296 IonicContact OE2-NH1 2.72Å; E289-R296 PolarHBondContact OE2-NH1 2.9Å; E289-R296 IonicContact OE2-NH2 2.88Å; L292-R296 WeakPolarHBondContact O-CB 3.19Å; L292-R296 WeakPolarHBondContact O-CG 3.29Å; L292-R296 PolarHBondContact O-N 3.27Å; R296-R300 PolarHBondContact O-NE 3.32Å
297	F	85.9	Confident	80.6	Confident	129 Å²	129	104 Å²	104	57%	0.566	48%	0.48	S	S	*	.	H	α-helix	trans	-77.4	-51.5	172.4	179.8	-92.9	0	0	0	111	S293 K294 Q295 Q299 R300 Q301	S293-F297 VanDerWaalsContact O-CB 3.29Å; S293-F297 WeakPolarHBondContact O-CB 3.28Å; S293-F297 PolarHBondContact O-N 3.32Å; K294-F297 PolarHBondContact O-N 2.71Å; Q295-F297 PolarHBondContact O-N 2.86Å; F297-Q299 VanDerWaalsContact C-N 3.32Å; F297-Q299 PolarHBondContact O-N 3.45Å; F297-R300 WeakPolarHBondContact O-CB 3.33Å; F297-R300 PolarHBondContact O-N 2.69Å; F297-R300 VanDerWaalsContact O-N 3.07Å; F297-Q301 PolarHBondContact O-N 3.32Å
298	H	86.1	Confident	78.8	Confident	100 Å²	100	99.7 Å²	99.7	46%	0.463	48%	0.475	S	S	.	.	H	α-helix	trans	-60.3	-39.5	178.2	-179.8	49	0	0	0	112.5	K294 Q295 R300 Q301 L302	K294-H298 WeakPolarHBondContact O-CB 3.36Å; K294-H298 PolarHBondContact O-N 3.1Å; Q295-H298 PolarHBondContact O-N 2.99Å; H298-R300 VanDerWaalsContact C-N 3.32Å; H298-R300 PolarHBondContact O-N 2.98Å; H298-Q301 WeakPolarHBondContact O-CB 3.37Å; H298-Q301 PolarHBondContact O-N 2.95Å; H298-L302 WeakPolarHBondContact O-CG 3.42Å; H298-L302 PolarHBondContact O-N 3.38Å
299	Q	84.6	Confident	76.8	Confident	122 Å²	122	106.4 Å²	106.4	57%	0.57	51%	0.511	S	S	*	.	H	α-helix	trans	-63.2	-36.2	175	-170.4	177.3	17.1	0	0	112.4	Q295 F297 L303	Q295-Q299 WeakPolarHBondContact O-CB 3.28Å; Q295-Q299 PolarHBondContact O-N 2.87Å; F297-Q299 VanDerWaalsContact C-N 3.32Å; F297-Q299 PolarHBondContact O-N 3.45Å; Q299-L303 WeakPolarHBondContact O-CD1 3.41Å; Q299-L303 VanDerWaalsContact O-CG 3.29Å; Q299-L303 WeakPolarHBondContact O-CG 3.32Å; Q299-L303 PolarHBondContact O-N 3.49Å; Q299-L303 VanDerWaalsContact O-N 3.14Å
300	R	84.4	Confident	74.4	Confident	141 Å²	141	109.6 Å²	109.6	53%	0.532	54%	0.537	S	S	.	.	H	α-helix	trans	-68.3	-44.4	172.2	-83.3	178.7	-74.8	172.7	-3.9	111.7	R296 F297 H298 L302 L303 E304	R296-R300 PolarHBondContact O-NE 3.32Å; F297-R300 WeakPolarHBondContact O-CB 3.33Å; F297-R300 PolarHBondContact O-N 2.69Å; F297-R300 VanDerWaalsContact O-N 3.07Å; H298-R300 VanDerWaalsContact C-N 3.32Å; H298-R300 PolarHBondContact O-N 2.98Å; R300-L302 VanDerWaalsContact C-N 3.32Å; R300-L302 PolarHBondContact O-N 3.01Å; R300-L303 CarbonylContact O-C 3.58Å; R300-L303 WeakPolarHBondContact O-CB 3.49Å; R300-L303 PolarHBondContact O-N 2.93Å; R300-L303 VanDerWaalsContact O-N 3.07Å; R300-E304 WeakPolarHBondContact O-CB 3.5Å; R300-E304 WeakPolarHBondContact O-CG 3.39Å; R300-E304 PolarHBondContact O-N 3.42Å
301	Q	89	Confident	72.3	Confident	78 Å²	78	108.4 Å²	108.4	36%	0.364	55%	0.545	S	S	.	.	H	α-helix	trans	-56.1	-45.1	174.7	-174.4	-172.6	-20.5	0	0	111.7	F297 H298 L303 E304 E305	F297-Q301 PolarHBondContact O-N 3.32Å; H298-Q301 WeakPolarHBondContact O-CB 3.37Å; H298-Q301 PolarHBondContact O-N 2.95Å; Q301-L303 VanDerWaalsContact C-N 3.33Å; Q301-L303 PolarHBondContact O-N 2.79Å; Q301-E304 PolarHBondContact O-N 3.2Å; Q301-E305 WeakPolarHBondContact CG-OE1 3.47Å; Q301-E305 PolarHBondContact NE2-OE1 3.28Å; Q301-E305 WeakPolarHBondContact O-CB 3.45Å; Q301-E305 WeakPolarHBondContact O-CG 3.5Å; Q301-E305 PolarHBondContact O-N 3.23Å
302	L	85.4	Confident	69.7	Low	78 Å²	78	109.5 Å²	109.5	41%	0.408	56%	0.56	S	S	.	*	H	α-helix	trans	-63.2	-36.7	176.1	-70.5	173.4	0	0	0	112.7	H298 R300 T306	H298-L302 WeakPolarHBondContact O-CG 3.42Å; H298-L302 PolarHBondContact O-N 3.38Å; R300-L302 VanDerWaalsContact C-N 3.32Å; R300-L302 PolarHBondContact O-N 3.01Å; L302-T306 VanDerWaalsContact O-CB 3.3Å; L302-T306 WeakPolarHBondContact O-CB 3.32Å; L302-T306 PolarHBondContact O-N 3.04Å; L302-T306 PolarHBondContact O-OG1 2.77Å
303	L	78.4	Confident	67.6	Low	100 Å²	100	114.9 Å²	114.9	52%	0.524	60%	0.595	S	S	.	*	H	α-helix	trans	-70.9	-33.2	175	-72.2	166.8	0	0	0	112.5	Q299 R300 Q301 R307	Q299-L303 WeakPolarHBondContact O-CD1 3.41Å; Q299-L303 VanDerWaalsContact O-CG 3.29Å; Q299-L303 WeakPolarHBondContact O-CG 3.32Å; Q299-L303 PolarHBondContact O-N 3.49Å; Q299-L303 VanDerWaalsContact O-N 3.14Å; R300-L303 CarbonylContact O-C 3.58Å; R300-L303 WeakPolarHBondContact O-CB 3.49Å; R300-L303 PolarHBondContact O-N 2.93Å; R300-L303 VanDerWaalsContact O-N 3.07Å; Q301-L303 VanDerWaalsContact C-N 3.33Å; Q301-L303 PolarHBondContact O-N 2.79Å; L303-R307 WeakPolarHBondContact O-CB 3.29Å; L303-R307 WeakPolarHBondContact O-CG 3.49Å; L303-R307 PolarHBondContact O-N 3.3Å
304	E	78.4	Confident	65.5	Low	133 Å²	133	118 Å²	118	62%	0.621	61%	0.614	S	S	*	*	H	α-helix	trans	-72	-43	174.6	-73.3	166.6	-160.3	0	0	111.2	R300 Q301 T306 R307 G308	R300-E304 WeakPolarHBondContact O-CB 3.5Å; R300-E304 WeakPolarHBondContact O-CG 3.39Å; R300-E304 PolarHBondContact O-N 3.42Å; Q301-E304 PolarHBondContact O-N 3.2Å; E304-T306 VanDerWaalsContact C-N 3.33Å; E304-T306 PolarHBondContact O-N 2.92Å; E304-R307 CarbonylContact O-C 3.44Å; E304-R307 PolarHBondContact O-N 2.84Å; E304-G308 PolarHBondContact O-N 3.47Å
305	E	71.9	Confident	62.7	Low	118 Å²	118	122.6 Å²	122.6	55%	0.551	63%	0.627	S	S	*	*	H	α-helix	trans	-61.2	-39.9	170.8	-73.8	172.7	-166.2	0	0	111.5	Q301 R307 G308	Q301-E305 WeakPolarHBondContact CG-OE1 3.47Å; Q301-E305 PolarHBondContact NE2-OE1 3.28Å; Q301-E305 WeakPolarHBondContact O-CB 3.45Å; Q301-E305 WeakPolarHBondContact O-CG 3.5Å; Q301-E305 PolarHBondContact O-N 3.23Å; E305-R307 VanDerWaalsContact C-N 3.32Å; E305-R307 PolarHBondContact O-N 2.98Å; E305-G308 PolarHBondContact O-N 3.47Å; E305-G308 VanDerWaalsContact O-N 3.09Å
306	T	61.9	Low	60.3	Low	121 Å²	121	123 Å²	123	74%	0.742	64%	0.64	S	S	*	*	H	α-helix	trans	-71.8	-23.4	176.1	-54.5	0	0	0	0	112.9	L302 E304	L302-T306 VanDerWaalsContact O-CB 3.3Å; L302-T306 WeakPolarHBondContact O-CB 3.32Å; L302-T306 PolarHBondContact O-N 3.04Å; L302-T306 PolarHBondContact O-OG1 2.77Å; E304-T306 VanDerWaalsContact C-N 3.33Å; E304-T306 PolarHBondContact O-N 2.92Å
307	R	54.3	Low	57.8	Low	218 Å²	218	124.4 Å²	124.4	82%	0.823	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.4	-2	169.8	-73.8	176.8	173.4	-172.8	-0.7	112.9	L303 E304 E305 D309	L303-R307 WeakPolarHBondContact O-CB 3.29Å; L303-R307 WeakPolarHBondContact O-CG 3.49Å; L303-R307 PolarHBondContact O-N 3.3Å; E304-R307 CarbonylContact O-C 3.44Å; E304-R307 PolarHBondContact O-N 2.84Å; E305-R307 VanDerWaalsContact C-N 3.32Å; E305-R307 PolarHBondContact O-N 2.98Å; R307-D309 VanDerWaalsContact C-N 3.29Å; R307-D309 PolarHBondContact O-N 2.91Å
308	G	43.8	Very low	55	Low	46 Å²	46	126.4 Å²	126.4	47%	0.474	67%	0.67	S	S	.	*			trans	-78.4	64.1	-177.2	0	0	0	0	0	113.8	E304 E305 C310	E304-G308 PolarHBondContact O-N 3.47Å; E305-G308 PolarHBondContact O-N 3.47Å; E305-G308 VanDerWaalsContact O-N 3.09Å; G308-C310 PolarHBondContact O-N 2.99Å
309	D	40.5	Very low	52.2	Low	164 Å²	164	128.1 Å²	128.1	88%	0.877	68%	0.682	S	S	*	*			trans	-65.7	81.9	169.5	-111.9	-28.9	0	0	0	110.3	R307 P311	R307-D309 VanDerWaalsContact C-N 3.29Å; R307-D309 PolarHBondContact O-N 2.91Å; D309-P311 WeakPolarHBondContact O-CD 3.47Å
310	C	30.9	Very low	49.4	Very low	116 Å²	116	128 Å²	128	78%	0.784	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-67.8	122.4	175.8	-91.6	0	0	0	0	110.4	G308 S312	G308-C310 PolarHBondContact O-N 2.99Å; C310-S312 PolarHBondContact O-N 2.76Å
311	P	40.1	Very low	46.8	Very low	122 Å²	122	127 Å²	127	79%	0.792	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-65.9	126.8	178.2	27.1	-33.9	0	0	0	110.5	D309	D309-P311 WeakPolarHBondContact O-CD 3.47Å
312	S	30	Very low	43.8	Very low	111 Å²	111	131.5 Å²	131.5	78%	0.776	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-59.6	126.6	-178.5	59.4	0	0	0	0	112	C310	C310-S312 PolarHBondContact O-N 2.76Å
313	P	36.7	Very low	41	Very low	115 Å²	115	131.5 Å²	131.5	75%	0.747	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-67.7	153.3	174.5	28.5	-34.4	0	0	0	111.4
314	P	36.7	Very low	38.5	Very low	124 Å²	124	134.6 Å²	134.6	81%	0.805	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-69.8	135.3	-170.9	27.5	-35	0	0	0	112.9	P316	P314-P316 WeakPolarHBondContact O-CD 3.37Å
315	R	28.9	Very low	35.8	Very low	236 Å²	236	133.4 Å²	133.4	89%	0.891	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-77	121.4	-179.6	-173	-176.2	-166.7	172.6	6.2	111.5
316	P	32.9	Very low	34.1	Very low	119 Å²	119	133 Å²	133	77%	0.773	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-74.8	151.9	165.8	31.4	-32.9	0	0	0	111	P314	P314-P316 WeakPolarHBondContact O-CD 3.37Å
317	T	32	Very low	32.3	Very low	121 Å²	121	131.6 Å²	131.6	74%	0.742	74%	0.737	S	S	*	*			trans	-107	148.9	-171.3	-21.5	0	0	0	0	112
318	Q	28.1	Very low	31.1	Very low	171 Å²	171	129.5 Å²	129.5	80%	0.799	74%	0.736	S	S	*	*			trans	68.2	138.9	160.5	-80.5	172.4	-33.4	0	0	116.6
319	L	26.3	Very low	30.2	Very low	137 Å²	137	132 Å²	132	72%	0.717	75%	0.752	S	S	*	*			cis	-133.2	-156.5	-8.9	-53.8	92.3	0	0	0	108.4
320	D	27	Very low	29.5	Very low	119 Å²	119	129 Å²	129	64%	0.636	75%	0.75	S	S	*	*			cis	-159.3	168.8	1.8	-134.9	-16.9	0	0	0	115.8
321	I	28.6	Very low	29.2	Very low	121 Å²	121	128.2 Å²	128.2	62%	0.621	75%	0.746	S	S	*	*			trans	19.6	115.3	148.8	-74.7	161.8	0	0	0	122.3
322	E	26.8	Very low	28.6	Very low	172 Å²	172	131 Å²	131	80%	0.804	75%	0.748	S	S	*	*				54.7	156.6	126.3	-58.1	-171	154.4	0	0	123.8
323	S	26.7	Very low	28.3	Very low	78 Å²	78	130.9 Å²	130.9	55%	0.545	75%	0.747	S	S	.	*			cis	-169.6	169.5	-26.6	63.7	0	0	0	0	110.8
324	H	25.9	Very low	27.7	Very low	165 Å²	165	128.5 Å²	128.5	76%	0.764	74%	0.744	S	S	*	*			trans	151.5	111.9	135.4	-76.1	-32.7	0	0	0	114.2
325	S	22.3	Very low	27.1	Very low	108 Å²	108	130 Å²	130	76%	0.755	75%	0.746	S	S	*	*				41.7	154.8	112.4	-51.1	0	0	0	0	121.7
326	P	36.4	Very low	27	Very low	109 Å²	109	127 Å²	127	71%	0.708	74%	0.741	S	S	*	*			cis	-146.5	161.4	24	45.1	-26.3	0	0	0	120.2
327	S	24.3	Very low	26.8	Very low	91 Å²	91	125.7 Å²	125.7	64%	0.636	73%	0.731	S	S	*	*			trans	43.4	135.9	139.1	67.2	0	0	0	0	122.4
328	H	28.2	Very low	26.7	Very low	175 Å²	175	126.6 Å²	126.6	81%	0.81	73%	0.728	S	S	*	*				-163.2	151	64.4	-112.9	-83.3	0	0	0	116.1
329	A	24.2	Very low	26.7	Very low	98 Å²	98	125.9 Å²	125.9	81%	0.81	72%	0.723	S	S	*	*			trans	55.8	129.2	150.8	0	0	0	0	0	121.5
330	A	26.8	Very low	26.7	Very low	101 Å²	101	125.2 Å²	125.2	84%	0.835	72%	0.72	S	S	*	*			trans	-145.5	154.3	163.1	0	0	0	0	0	109.9
331	S	25.4	Very low	26.7	Very low	100 Å²	100	126.9 Å²	126.9	70%	0.699	73%	0.727	S	S	*	*			trans	-173.2	137.5	164.4	47.5	0	0	0	0	114.5
332	Q	26.9	Very low	27	Very low	180 Å²	180	126.6 Å²	126.6	84%	0.841	73%	0.733	S	S	*	*			trans	69.9	148.9	151	-67.5	165.2	21.7	0	0	118.4
333	S	23	Very low	27.1	Very low	108 Å²	108	124.4 Å²	124.4	76%	0.755	73%	0.732	S	S	*	*			cis	-173.6	146.9	-17.1	49.9	0	0	0	0	111.8
334	G	24	Very low	27.5	Very low	66 Å²	66	126.4 Å²	126.4	68%	0.68	74%	0.743	S	S	*	*			trans	74.4	163.6	165.8	0	0	0	0	0	116
335	D	25.3	Very low	27.3	Very low	156 Å²	156	122.5 Å²	122.5	83%	0.834	74%	0.739	S	S	*	*			cis	-158.7	161.7	-14.2	-108.3	-29.5	0	0	0	110.7
336	E	26.2	Very low	27.6	Very low	172 Å²	172	125.8 Å²	125.8	80%	0.804	75%	0.747	S	S	*	*			trans	29.1	142.2	144.7	-64.2	-137.6	131	0	0	121.6
337	V	29.3	Very low	27.1	Very low	92 Å²	92	125.7 Å²	125.7	56%	0.558	76%	0.756	S	S	*	*			cis	-170.1	149.8	16.9	101.1	0	0	0	0	113.9
338	M	29.1	Very low	27.2	Very low	139 Å²	139	126.4 Å²	126.4	69%	0.685	77%	0.767	S	S	*	*			trans	56.5	148.6	156.4	-64.8	-168.4	-70.5	0	0	120.9
339	K	28.6	Very low	27	Very low	156 Å²	156	122.5 Å²	122.5	68%	0.678	77%	0.765	S	S	*	*			cis	-167.8	160	1.5	-117.2	169.2	-178.7	159.3	0	112
340	N	26.2	Very low	27.3	Very low	123 Å²	123	123.8 Å²	123.8	66%	0.658	77%	0.765	S	S	*	*			trans	58.3	110.2	150.4	-58.8	-3.4	0	0	0	120.3
341	I	27.6	Very low	27.1	Very low	155 Å²	155	124.5 Å²	124.5	80%	0.795	76%	0.764	S	S	*	*				63.1	127	73.6	-60.2	167.3	0	0	0	113.4
342	P	34.7	Very low	27.1	Very low	114 Å²	114	126.2 Å²	126.2	74%	0.74	77%	0.77	S	S	*	*			cis	-136.2	-176.1	-12	40.2	-21	0	0	0	116.4
343	T	27.6	Very low	27	Very low	127 Å²	127	126 Å²	126	78%	0.779	77%	0.769	S	S	*	*			trans	-52.7	159.1	162	8.9	0	0	0	0	114.6
344	P	34.8	Very low	27.1	Very low	120 Å²	120	130 Å²	130	78%	0.779	78%	0.776	S	S	*	*				-152.8	159.5	68.6	41.9	-21.9	0	0	0	120.8
345	A	22.9	Very low	27.1	Very low	83 Å²	83	136.1 Å²	136.1	69%	0.686	78%	0.784	S	S	*	*			trans	59.4	119.7	139.4	0	0	0	0	0	123.9
346	L	28.2	Very low	27.1	Very low	177 Å²	177	137.3 Å²	137.3	93%	0.927	78%	0.784	S	S	*	*			trans	13.3	125.5	145.7	-65.2	90.5	0	0	0	121.1
347	A	25.5	Very low	27.1	Very low	107 Å²	107	134.8 Å²	134.8	88%	0.884	78%	0.783	S	S	*	*			trans	-143.6	151.1	137.1	0	0	0	0	0	109.1
348	A	25.9	Very low	26.9	Very low	105 Å²	105	136.4 Å²	136.4	87%	0.868	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-87.4	151.2	-175.5	0	0	0	0	0	113.1
349	A	25.7	Very low	26.8	Very low	94 Å²	94	135.8 Å²	135.8	78%	0.777	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-89.5	142	170.3	0	0	0	0	0	111
350	P	28.7	Very low	26.7	Very low	124 Å²	124	134.1 Å²	134.1	81%	0.805	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-80.6	152.5	177.6	33.3	-34.9	0	0	0	112.3
351	S	24.5	Very low	26.6	Very low	116 Å²	116	137.9 Å²	137.9	81%	0.811	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-75.4	147.7	170.9	42.9	0	0	0	0	112.1
352	V	25	Very low	26.5	Very low	137 Å²	137	134.9 Å²	134.9	83%	0.83	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-84.5	136.8	170.6	176.6	0	0	0	0	108.9
353	Q	24	Very low	26.2	Very low	174 Å²	174	135.6 Å²	135.6	81%	0.813	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-87.5	117.2	172.7	-67.2	-179.7	-48.6	0	0	110
354	E	24.6	Very low	26.2	Very low	193 Å²	193	138.3 Å²	138.3	90%	0.902	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-73.2	144.5	157.1	-63.6	-174.3	149.3	0	0	108.9
355	K	25.1	Very low	25.7	Very low	195 Å²	195	138.9 Å²	138.9	85%	0.848	79%	0.787	S	S	*	*			trans	-110.7	127.9	177.9	-77.8	-176.1	176.4	178.5	0	109.8
356	E	24.1	Very low	25.8	Very low	180 Å²	180	140.7 Å²	140.7	84%	0.841	80%	0.795	S	S	*	*			trans	-63	139.8	171.7	-60.7	171.8	120.7	0	0	111.2	V358	E356-V358 PolarHBondContact O-N 2.7Å
357	P	26.8	Very low	25.6	Very low	119 Å²	119	138.3 Å²	138.3	77%	0.773	79%	0.791	S	S	*	*			trans	-77.7	105	172.2	30.8	-32.3	0	0	0	110.5	V359	P357-V359 PolarHBondContact O-N 3.39Å
358	V	24.7	Very low	25.6	Very low	126 Å²	126	141.3 Å²	141.3	76%	0.764	79%	0.792	S	S	*	*			trans	-66.5	105.1	172.1	178.7	0	0	0	0	109.9	E356	E356-V358 PolarHBondContact O-N 2.7Å
359	V	27.3	Very low	25.5	Very low	127 Å²	127	141.2 Å²	141.2	77%	0.77	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-74.7	125.3	173.5	179.1	0	0	0	0	109.5	P357	P357-V359 PolarHBondContact O-N 3.39Å
360	Q	26.3	Very low	25.6	Very low	121 Å²	121	141.4 Å²	141.4	57%	0.565	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-100.6	131.8	172.5	-65.7	177.3	-114.1	0	0	109.2	N362	Q360-N362 PolarHBondContact O-N 3.01Å
361	F	24.1	Very low	25.4	Very low	202 Å²	202	144.3 Å²	144.3	89%	0.886	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-67.7	120.2	171.7	-83.1	-96.3	0	0	0	110.3
362	N	25.8	Very low	25.3	Very low	91 Å²	91	143.6 Å²	143.6	49%	0.487	79%	0.791	S	S	.	*			trans	-115.2	99.9	173.2	-97.7	6.5	0	0	0	110.1	D5 Q360	D5-N362 PolarHBondContact OD2-ND2 3.16Å; Q360-N362 PolarHBondContact O-N 3.01Å
363	T	27.8	Very low	25.3	Very low	129 Å²	129	142.2 Å²	142.2	79%	0.791	79%	0.787	S	S	*	*			trans	-80.2	126.1	179	-47	0	0	0	0	111.3
364	W	28	Very low	25.3	Very low	185 Å²	185	141.6 Å²	141.6	70%	0.701	79%	0.789	S	S	*	*			trans	-128.4	54.3	-177.1	-83.6	82.2	0	0	0	114.7
365	V	24.7	Very low	25.4	Very low	131 Å²	131	137.9 Å²	137.9	79%	0.794	78%	0.781	S	S	*	*			trans	-144.1	99.8	149.5	-175.2	0	0	0	0	109.7
366	S	24.8	Very low	25.4	Very low	122 Å²	122	134.5 Å²	134.5	85%	0.853	78%	0.777	S	S	*	*			trans	-174.4	119.7	155.2	-84.9	0	0	0	0	110.7
367	C	24.2	Very low	25.4	Very low	126 Å²	126	132.9 Å²	132.9	85%	0.851	78%	0.779	S	S	*	*			trans	-113.4	115.9	157.9	-68.7	0	0	0	0	108
368	D	24.6	Very low	25.1	Very low	170 Å²	170	137.5 Å²	137.5	91%	0.909	78%	0.781	S	S	*	*			trans	-169.2	142.1	136.4	-104.6	-22.3	0	0	0	110.2
369	A	24.2	Very low	25	Very low	103 Å²	103	136.9 Å²	136.9	85%	0.851	78%	0.782	S	S	*	*			trans	-129.1	94.2	-174	0	0	0	0	0	111.3
370	S	27.3	Very low	25.1	Very low	98 Å²	98	136.6 Å²	136.6	69%	0.685	78%	0.783	S	S	*	*			trans	-151.8	155.1	167.2	63.9	0	0	0	0	112.8
371	H	25.5	Very low	25	Very low	186 Å²	186	142.5 Å²	142.5	86%	0.861	80%	0.8	S	S	*	*			trans	71.3	169.6	177.6	-58.6	-72.9	0	0	0	117.1
372	A	22.4	Very low	25.1	Very low	101 Å²	101	140.8 Å²	140.8	84%	0.835	80%	0.798	S	S	*	*			trans	-130.2	170.7	-132.1	0	0	0	0	0	116.2
373	S	23.9	Very low	25	Very low	108 Å²	108	142.8 Å²	142.8	76%	0.755	81%	0.814	S	S	*	*			trans	-69.4	157.1	-171.7	53	0	0	0	0	116.4
374	L	24.2	Very low	24.9	Very low	160 Å²	160	140.4 Å²	140.4	84%	0.838	82%	0.815	S	S	*	*				176.3	178.8	124.7	-87.5	168.4	0	0	0	108.9
375	P	26.4	Very low	24.7	Very low	116 Å²	116	141 Å²	141	75%	0.753	83%	0.826	S	S	*	*				-124.5	174.3	-95.5	34.3	-13.1	0	0	0	116.3
376	V	27	Very low	24.8	Very low	124 Å²	124	142.9 Å²	142.9	75%	0.752	83%	0.826	S	S	*	*			trans	-72.3	144.6	-177.5	173.5	0	0	0	0	114	R378	V376-R378 HydrophobicContact CG1-CG 4.1Å
377	V	23	Very low	24.9	Very low	146 Å²	146	144.3 Å²	144.3	89%	0.885	82%	0.822	S	S	*	*			trans	-120.3	147.4	157.8	179.7	0	0	0	0	109.3
378	R	21.7	Very low	25	Very low	216 Å²	216	146.8 Å²	146.8	82%	0.815	82%	0.819	S	S	*	*			trans	-128.6	160	-173	-86.4	-176.5	167	179.8	-3	113	V376	V376-R378 HydrophobicContact CG1-CG 4.1Å
379	S	21.8	Very low	25.2	Very low	112 Å²	112	146.2 Å²	146.2	78%	0.783	82%	0.815	S	S	*	*			trans	90.9	159.1	154.4	-34.3	0	0	0	0	116.8
380	P	29.3	Very low	25.4	Very low	121 Å²	121	149.8 Å²	149.8	79%	0.786	81%	0.814	S	S	*	*			cis	-121.9	179	-6.6	35.4	-18.2	0	0	0	114.4
381	R	23.8	Very low	25.3	Very low	245 Å²	245	152.8 Å²	152.8	93%	0.925	82%	0.822	S	S	*	*			trans	-86.9	146.6	167.7	-68.7	176	172.5	171	-4.9	110.9
382	I	25.3	Very low	25.6	Very low	166 Å²	166	149.9 Å²	149.9	85%	0.851	82%	0.817	S	S	*	*			trans	-129.4	154.4	154.8	-66.1	-176.3	0	0	0	107.9
383	T	24.6	Very low	26.3	Very low	134 Å²	134	153.8 Å²	153.8	82%	0.822	82%	0.818	S	S	*	*			trans	-98.9	129.1	-163.8	48	0	0	0	0	114.5
384	G	25.5	Very low	26.8	Very low	78 Å²	78	154.2 Å²	154.2	80%	0.804	82%	0.816	S	S	*	*				63.1	108.4	129.9	0	0	0	0	0	119.7
385	E	24.3	Very low	27.2	Very low	199 Å²	199	153.8 Å²	153.8	93%	0.93	82%	0.815	S	S	*	*			trans	-141.4	160.3	135.4	-137.1	164.5	-138.4	0	0	109.4
386	Q	27.5	Very low	28.1	Very low	170 Å²	170	155.2 Å²	155.2	79%	0.794	81%	0.812	S	S	*	*			trans	-101.6	112.6	-160.4	-177.8	177.7	-5.8	0	0	111.7
387	I	27.2	Very low	28.9	Very low	151 Å²	151	155.6 Å²	155.6	77%	0.774	81%	0.81	S	S	*	*			trans	-125.3	130.6	177.3	-58.8	179.1	0	0	0	108.7
388	F	26.2	Very low	29.8	Very low	178 Å²	178	153.3 Å²	153.3	78%	0.781	79%	0.788	S	S	*	*			trans	-73	138.1	171.5	-77.9	-106.6	0	0	0	109.7
389	L	27.9	Very low	30.7	Very low	158 Å²	158	149.7 Å²	149.7	83%	0.827	78%	0.783	S	S	*	*			trans	-110.5	128.8	166.4	-123.3	70.9	0	0	0	108.2
390	E	29.4	Very low	31.5	Very low	178 Å²	178	151 Å²	151	83%	0.832	78%	0.781	S	S	*	*			trans	-83.6	160.2	167.2	-65.4	177.2	117.9	0	0	109.7	V392	E390-V392 PolarHBondContact O-N 3.38Å
391	D	25.3	Very low	31.7	Very low	162 Å²	162	150.2 Å²	150.2	87%	0.866	78%	0.779	S	S	*	*			trans	-66.5	97.7	-175.5	-67.4	-56.9	0	0	0	112.5	Q393	D391-Q393 VanDerWaalsContact C-N 3.34Å; D391-Q393 PolarHBondContact O-N 2.71Å
392	V	31.1	Very low	32.3	Very low	125 Å²	125	142.2 Å²	142.2	76%	0.758	76%	0.761	S	S	*	*			trans	-77.2	86.7	168.1	-176.7	0	0	0	0	109	E390 T394	E390-V392 PolarHBondContact O-N 3.38Å; V392-T394 PolarHBondContact O-N 3.04Å
393	Q	35.9	Very low	33	Very low	182 Å²	182	142.2 Å²	142.2	85%	0.85	76%	0.761	S	S	*	*			trans	-63	128.8	163.3	-68	-173.9	-47.2	0	0	109	D391	D391-Q393 VanDerWaalsContact C-N 3.34Å; D391-Q393 PolarHBondContact O-N 2.71Å
394	T	34.8	Very low	33.4	Very low	117 Å²	117	144.2 Å²	144.2	72%	0.718	77%	0.766	S	S	*	*			trans	-80.4	138.8	-174.1	47	0	0	0	0	112.6	V392 E396	V392-T394 PolarHBondContact O-N 3.04Å; T394-E396 PolarHBondContact O-N 3.17Å; T394-E396 VanDerWaalsContact O-N 3.15Å
395	D	32.9	Very low	33.7	Very low	151 Å²	151	144.6 Å²	144.6	81%	0.807	76%	0.757	S	S	*	*			trans	-58.7	110.8	175.3	-58.7	-49.2	0	0	0	112	D397	D395-D397 VanDerWaalsContact C-N 3.3Å
396	E	44.7	Very low	34.1	Very low	147 Å²	147	138.8 Å²	138.8	69%	0.687	74%	0.738	S	S	*	*	G	3₁₀ helix	trans	-77	-16.4	175.9	-62	-152.3	126	0	0	113.2	T394 K398	T394-E396 PolarHBondContact O-N 3.17Å; T394-E396 VanDerWaalsContact O-N 3.15Å; E396-K398 VanDerWaalsContact C-N 3.28Å; E396-K398 PolarHBondContact O-N 2.64Å; E396-K398 VanDerWaalsContact O-N 3.1Å
397	D	45.1	Very low	34.3	Very low	132 Å²	132	140.2 Å²	140.2	71%	0.706	75%	0.745	S	S	*	*	G	3₁₀ helix	trans	-76.5	4.6	-166	-72.5	-44.7	0	0	0	116.1	D395	D395-D397 VanDerWaalsContact C-N 3.3Å
398	K	41.9	Very low	34.5	Very low	97 Å²	97	137.6 Å²	137.6	42%	0.422	74%	0.739	S	S	.	*	G	3₁₀ helix	trans	-117.3	11.7	-176.7	-131.6	-173.6	-170.7	-93.6	0	117.7	E396 E581	E396-K398 VanDerWaalsContact C-N 3.28Å; E396-K398 PolarHBondContact O-N 2.64Å; E396-K398 VanDerWaalsContact O-N 3.1Å; K398-E581 VanDerWaalsContact CE-OE2 3.31Å; K398-E581 WeakPolarHBondContact CE-OE2 3.18Å; K398-E581 IonicContact NZ-OE2 3.09Å; K398-E581 PolarHBondContact NZ-OE2 2.79Å
399	I	40.8	Very low	34.8	Very low	141 Å²	141	135.2 Å²	135.2	72%	0.723	74%	0.74	S	S	*	*	S	Bend	trans	-107.7	-28.6	177	-61.1	179.9	0	0	0	112.6
400	N	37.8	Very low	34.8	Very low	138 Å²	138	136.5 Å²	136.5	74%	0.738	74%	0.739	S	S	*	*	S	Bend	trans	-96.2	7.4	-161.8	-65	-30.3	0	0	0	116.4
401	S	33.2	Very low	34.8	Very low	106 Å²	106	131.7 Å²	131.7	74%	0.741	72%	0.718	S	S	*	*	S	Bend	trans	-100.3	-2.3	-168.8	57.4	0	0	0	0	116.9
402	S	37.9	Very low	35.1	Very low	77 Å²	77	129.2 Å²	129.2	54%	0.538	71%	0.711	S	S	.	*	S	Bend	trans	-149.5	49.6	-171.8	-155.6	0	0	0	0	116.3
403	L	38.8	Very low	34.8	Very low	166 Å²	166	130.3 Å²	130.3	87%	0.869	71%	0.706	S	S	*	*	S	Bend	trans	-134.3	-0.5	172.4	-82.8	-178.8	0	0	0	117.4
404	L	33.3	Very low	34.5	Very low	175 Å²	175	126.9 Å²	126.9	92%	0.916	70%	0.698	S	S	*	*			trans	-117.8	78.7	179.2	-68	177.9	0	0	0	112.9
405	S	32.7	Very low	34.4	Very low	87 Å²	87	127.3 Å²	127.3	61%	0.608	71%	0.705	S	S	*	*			trans	-164.7	67.4	165.1	49.4	0	0	0	0	113.5	K570	S405-K570 PolarHBondContact O-NZ 3Å
406	S	30.9	Very low	34.1	Very low	77 Å²	77	126.3 Å²	126.3	54%	0.538	70%	0.7	S	S	.	*			trans	-159.6	86.1	164.9	-79.9	0	0	0	0	111.7	S408	S406-S408 PolarHBondContact O-N 3.45Å
407	E	32.6	Very low	33.6	Very low	200 Å²	200	127.3 Å²	127.3	94%	0.935	71%	0.709	S	S	*	*			trans	-69.3	126.1	163	-68.7	-169.1	126.7	0	0	109.9
408	S	31.3	Very low	32.8	Very low	95 Å²	95	128.6 Å²	128.6	66%	0.664	72%	0.716	S	S	*	*			trans	-151.6	58.4	172.9	-157.9	0	0	0	0	112.8	S406 F410	S406-S408 PolarHBondContact O-N 3.45Å; S408-F410 PolarHBondContact O-N 3.21Å; S408-F410 VanDerWaalsContact O-N 3.11Å
409	T	32.6	Very low	32.4	Very low	129 Å²	129	129.9 Å²	129.9	79%	0.791	74%	0.735	S	S	*	*			trans	-71.7	100.2	169.1	-61.7	0	0	0	0	109.8
410	F	27.7	Very low	31.9	Very low	184 Å²	184	131.3 Å²	131.3	81%	0.807	74%	0.738	S	S	*	*			trans	172.5	107.3	134.4	-97.6	-63	0	0	0	112.8	S408	S408-F410 PolarHBondContact O-N 3.21Å; S408-F410 VanDerWaalsContact O-N 3.11Å
411	L	28.6	Very low	31.5	Very low	77 Å²	77	130.3 Å²	130.3	40%	0.403	74%	0.737	S	S	.	*				164	127.5	120.3	-87.7	157.9	0	0	0	110.2	R556	L411-R556 VanDerWaalsContact CB-NH2 3.27Å; L411-R556 HydrophobicContact CD1-CG 4.03Å; L411-R556 PolarHBondContact O-NH2 3.01Å
412	P	32	Very low	31.2	Very low	110 Å²	110	129 Å²	129	71%	0.714	73%	0.733	S	S	*	*			trans	-64.8	146.7	167.6	29.3	-34.7	0	0	0	110.4	R556	P412-R556 PolarHBondContact O-NH1 2.83Å; P412-R556 PolarHBondContact O-NH2 3.03Å
413	F	25.6	Very low	30.8	Very low	149 Å²	149	133.7 Å²	133.7	65%	0.654	75%	0.746	S	S	*	*			trans	-117	116.7	166	-126.7	-50	0	0	0	107.7	R556	F413-R556 VanDerWaalsContact CE2-CZ 3.45Å; F413-R556 VanDerWaalsContact CE2-NE 3.34Å
414	T	29.7	Very low	30.3	Very low	109 Å²	109	130.7 Å²	130.7	67%	0.669	74%	0.735	S	S	*	*			trans	-83.1	135.1	165.6	47	0	0	0	0	108.4	D416	T414-D416 PolarHBondContact O-N 3.24Å
415	S	32.4	Very low	30	Very low	126 Å²	126	129.2 Å²	129.2	88%	0.881	73%	0.728	S	S	*	*			trans	-80.2	101.3	178.4	-57.4	0	0	0	0	110.8
416	D	27.4	Very low	29.8	Very low	130 Å²	130	130 Å²	130	70%	0.695	73%	0.733	S	S	*	*			trans	-90.7	112.6	166	-72.7	-26.3	0	0	0	109.2	T414	T414-D416 PolarHBondContact O-N 3.24Å
417	L	32.5	Very low	29.9	Very low	168 Å²	168	135.7 Å²	135.7	88%	0.88	75%	0.751	S	S	*	*			trans	-132.5	133.7	156.6	-80.5	178.6	0	0	0	108.3
418	D	29.6	Very low	29.7	Very low	160 Å²	160	133.7 Å²	133.7	86%	0.856	75%	0.747	S	S	*	*			trans	-64.9	143.3	-165.8	-64.9	-61.9	0	0	0	115
419	P	33.9	Very low	29.9	Very low	124 Å²	124	136.6 Å²	136.6	81%	0.805	75%	0.75	S	S	*	*			trans	-108.9	125.9	142.4	33.9	-26.6	0	0	0	111.2
420	Q	28.9	Very low	29.9	Very low	170 Å²	170	135.3 Å²	135.3	79%	0.794	74%	0.742	S	S	*	*			trans	-81.1	137.7	171.5	-90.6	-96.4	-38	0	0	111.8
421	T	29.2	Very low	30.1	Very low	117 Å²	117	134.6 Å²	134.6	72%	0.718	74%	0.742	S	S	*	*			trans	70.4	113.7	160.1	58.4	0	0	0	0	120.6
422	A	28.2	Very low	30.2	Very low	80 Å²	80	135.8 Å²	135.8	66%	0.661	75%	0.752	S	S	*	*			trans	52.2	134.4	132.2	0	0	0	0	0	120.4
423	H	29.4	Very low	29.9	Very low	174 Å²	174	140.1 Å²	140.1	81%	0.806	76%	0.76	S	S	*	*			cis	-171.7	168.3	4.3	-95.6	-35.1	0	0	0	107.1
424	T	27.9	Very low	30.4	Very low	103 Å²	103	141.7 Å²	141.7	63%	0.632	77%	0.769	S	S	*	*			cis	-159.2	168.3	8.6	-1.4	0	0	0	0	110.5
425	D	26.5	Very low	31	Very low	144 Å²	144	141.9 Å²	141.9	77%	0.77	77%	0.773	S	S	*	*			trans	72.4	147.9	151.6	-60	-20.9	0	0	0	123.2
426	S	28.5	Very low	30.7	Very low	104 Å²	104	142.6 Å²	142.6	73%	0.727	77%	0.767	S	S	*	*			trans	61.7	103	162.2	53.9	0	0	0	0	121.2
427	E	33.5	Very low	30.9	Very low	196 Å²	196	141 Å²	141	92%	0.916	77%	0.766	S	S	*	*				60.2	117.3	126	-62.7	-178.1	156.4	0	0	119.9
428	D	28.4	Very low	30.8	Very low	158 Å²	158	141.3 Å²	141.3	85%	0.845	77%	0.767	S	S	*	*			trans	-99.3	145.3	178	-147.4	-3.8	0	0	0	111.8
429	E	34.8	Very low	30.6	Very low	156 Å²	156	138.3 Å²	138.3	73%	0.729	77%	0.765	S	S	*	*			trans	-49.2	170.7	159.1	-61.2	-92.4	97.1	0	0	111.7
430	T	33.4	Very low	30.5	Very low	102 Å²	102	138.8 Å²	138.8	63%	0.626	77%	0.768	S	S	*	*			cis	-160.7	156.1	6.8	0.8	0	0	0	0	112
431	E	31.9	Very low	30.5	Very low	170 Å²	170	140 Å²	140	79%	0.794	77%	0.771	S	S	*	*			trans	48.6	128	138.8	-80.1	-173.4	-158.2	0	0	126.6
432	T	30.9	Very low	30.3	Very low	101 Å²	101	145.8 Å²	145.8	62%	0.62	78%	0.779	S	S	*	*				74.3	117.7	123.5	-56.2	0	0	0	0	121.7
433	F	26.4	Very low	30.6	Very low	202 Å²	202	147.1 Å²	147.1	89%	0.886	78%	0.781	S	S	*	*				-170.2	130.1	119.5	-103.6	-67.9	0	0	0	112
434	E	36	Very low	30.6	Very low	181 Å²	181	143.7 Å²	143.7	85%	0.846	78%	0.777	S	S	*	*			trans	-120.6	153.4	155.1	-88.5	-158.5	165.6	0	0	108.7
435	P	40.7	Very low	30.6	Very low	114 Å²	114	147.9 Å²	147.9	74%	0.74	79%	0.789	S	S	*	*				-144.1	160.1	124.4	37.5	-24.3	0	0	0	116.4
436	D	26.5	Very low	30.6	Very low	141 Å²	141	145.6 Å²	145.6	75%	0.754	79%	0.785	S	S	*	*			trans	73.5	97.8	152.1	-92.1	-47.1	0	0	0	122.8
437	S	32.9	Very low	30.4	Very low	97 Å²	97	151.8 Å²	151.8	68%	0.678	79%	0.792	S	S	*	*				83	132.7	109.1	-76.3	0	0	0	0	124
438	L	29.6	Very low	30.1	Very low	173 Å²	173	149.7 Å²	149.7	91%	0.906	79%	0.787	S	S	*	*			trans	76.1	86.4	153	-63.1	168.7	0	0	0	121
439	A	24.8	Very low	30.8	Very low	98 Å²	98	147.3 Å²	147.3	81%	0.81	78%	0.78	S	S	*	*			trans	-150	156.1	150.3	0	0	0	0	0	112.4
440	P	32.6	Very low	30.6	Very low	133 Å²	133	147.2 Å²	147.2	86%	0.864	79%	0.785	S	S	*	*			trans	-93.9	-177.3	-164.9	36.7	-37.1	0	0	0	117.5
441	K	28.2	Very low	31.3	Very low	197 Å²	197	146.9 Å²	146.9	86%	0.857	78%	0.784	S	S	*	*			trans	-88.3	149.4	-156.2	-61.2	170	178.3	169.8	0	117.4
442	R	24.9	Very low	31.2	Very low	237 Å²	237	145.2 Å²	145.2	89%	0.894	78%	0.781	S	S	*	*			trans	72.6	165.7	144.6	-86.2	-173.8	179.9	-170.3	1.2	118.3
443	P	35.9	Very low	31.1	Very low	108 Å²	108	148.8 Å²	148.8	70%	0.701	79%	0.788	S	S	*	*			cis	-131.1	144.4	6.4	36.7	-18.4	0	0	0	118.9
444	S	27.8	Very low	31.1	Very low	102 Å²	102	144.5 Å²	144.5	71%	0.713	78%	0.778	S	S	*	*			trans	24.2	140.5	142.7	64.9	0	0	0	0	124
445	Q	29.2	Very low	30.8	Very low	191 Å²	191	141.7 Å²	141.7	89%	0.893	77%	0.769	S	S	*	*				-164.1	175.7	111.2	-106.5	175	40	0	0	114.7
446	S	25.8	Very low	30.1	Very low	97 Å²	97	144.1 Å²	144.1	68%	0.678	77%	0.77	S	S	*	*			trans	-67.1	173.5	-169.2	62.3	0	0	0	0	116.2
447	R	25.3	Very low	30.1	Very low	234 Å²	234	143.3 Å²	143.3	88%	0.883	78%	0.776	S	S	*	*			cis	-169.3	160.9	37.4	-150.4	168.3	-173.7	171.7	0.6	113.9
448	N	26.3	Very low	29.9	Very low	151 Å²	151	144 Å²	144	81%	0.807	78%	0.781	S	S	*	*			trans	-82.5	-178.1	177.7	-69.3	2.7	0	0	0	113.7
449	P	43.1	Very low	30.8	Very low	108 Å²	108	140.6 Å²	140.6	70%	0.701	77%	0.769	S	S	*	*				-142.9	-160.3	-50.4	42.6	-24.4	0	0	0	114.4
450	N	30.6	Very low	30.9	Very low	154 Å²	154	141.9 Å²	141.9	82%	0.824	77%	0.767	S	S	*	*			trans	98.6	155.4	146.1	-88.3	14.7	0	0	0	122.2
451	P	48.9	Very low	30.7	Very low	96 Å²	96	142.2 Å²	142.2	62%	0.623	76%	0.757	S	S	*	*			trans	-134.1	-171.8	-141.7	46.5	-31.6	0	0	0	116.1
452	N	28.2	Very low	30.7	Very low	135 Å²	135	139.8 Å²	139.8	72%	0.722	75%	0.747	S	S	*	*			trans	177.1	149.3	135.9	-103.6	-63.6	0	0	0	115.8
453	K	28.5	Very low	30.9	Very low	176 Å²	176	134.2 Å²	134.2	77%	0.765	73%	0.734	S	S	*	*			trans	63.7	160.1	141.9	-73	-178.1	-179.7	-174.3	0	121.8
454	T	27.9	Very low	30.6	Very low	111 Å²	111	135.3 Å²	135.3	68%	0.681	73%	0.73	S	S	*	*			cis	179	142.9	-46.1	32.8	0	0	0	0	109.6
455	N	28.8	Very low	30.7	Very low	123 Å²	123	140.2 Å²	140.2	66%	0.658	73%	0.733	S	S	*	*			trans	73.6	116.5	149.4	-68.7	42.6	0	0	0	123.2
456	E	26	Very low	30.8	Very low	164 Å²	164	139.7 Å²	139.7	77%	0.766	73%	0.728	S	S	*	*				76.9	133.7	117.8	-64.8	179	123.6	0	0	125.4
457	S	26.8	Very low	31	Very low	125 Å²	125	140.9 Å²	140.9	87%	0.874	73%	0.731	S	S	*	*			trans	94.3	151.4	136.5	73.7	0	0	0	0	122
458	S	27.9	Very low	31.1	Very low	111 Å²	111	134 Å²	134	78%	0.776	73%	0.733	S	S	*	*			trans	-127.2	-157.8	-174.2	59.9	0	0	0	0	108.3
459	P	49	Very low	31.2	Very low	102 Å²	102	130.9 Å²	130.9	66%	0.662	74%	0.736	S	S	*	*			cis	-140.6	-145.1	2	38.6	-13.6	0	0	0	114.5
460	T	26.5	Very low	30.5	Very low	125 Å²	125	129.3 Å²	129.3	77%	0.767	74%	0.74	S	S	*	*			trans	87.7	146.7	167.3	71.3	0	0	0	0	118
461	E	28.8	Very low	30.4	Very low	139 Å²	139	129.4 Å²	129.4	65%	0.65	74%	0.74	S	S	*	*			cis	-160.8	158.5	-0.9	-128	-170.4	179.5	0	0	116.3
462	K	29.1	Very low	29.6	Very low	147 Å²	147	131.7 Å²	131.7	64%	0.639	75%	0.746	S	S	*	*			trans	61.3	128.8	143.6	-83.2	173.3	-164.6	141.4	0	126.5
463	N	28.4	Very low	29.7	Very low	119 Å²	119	131 Å²	131	64%	0.636	75%	0.746	S	S	*	*				95.5	112.4	123	-83.7	-27.2	0	0	0	125.9
464	Q	30.6	Very low	29.7	Very low	132 Å²	132	128 Å²	128	62%	0.617	75%	0.748	S	S	*	*				78.9	106.5	121.4	-76	-173.6	76.7	0	0	125.7
465	R	29.8	Very low	29.7	Very low	205 Å²	205	129.2 Å²	129.2	77%	0.774	76%	0.755	S	S	*	*				78.1	135.5	115.3	-81.2	-179.5	168.1	167.2	-6.5	124.1
466	K	31.5	Very low	29.7	Very low	179 Å²	179	127 Å²	127	78%	0.778	75%	0.754	S	S	*	*			trans	77.2	147.1	140.5	-81.9	-166.3	172	-167.6	0	119.6
467	T	29.7	Very low	29.8	Very low	123 Å²	123	125.4 Å²	125.4	76%	0.755	76%	0.755	S	S	*	*			cis	-169.9	138.8	-23.7	15.3	0	0	0	0	111.1
468	G	26.9	Very low	29.9	Very low	88 Å²	88	124.7 Å²	124.7	91%	0.907	75%	0.746	S	S	*	*			trans	72.5	160	157.3	0	0	0	0	0	117.7
469	G	27.4	Very low	29.9	Very low	86 Å²	86	125.5 Å²	125.5	89%	0.887	75%	0.746	S	S	*	*			cis	149.1	130.3	-9.5	0	0	0	0	0	113.6
470	G	29.4	Very low	28.9	Very low	75 Å²	75	125.2 Å²	125.2	77%	0.773	75%	0.753	S	S	*	*			trans	164.3	147.7	174.4	0	0	0	0	0	115.9
471	N	29.1	Very low	29.1	Very low	156 Å²	156	123.8 Å²	123.8	83%	0.834	75%	0.753	S	S	*	*			trans	-89.7	-169.9	178.1	-65	-20	0	0	0	110.7
472	I	31.7	Very low	29.2	Very low	145 Å²	145	122.9 Å²	122.9	74%	0.744	76%	0.762	S	S	*	*			cis	-166.1	140.5	31.4	-7	175.4	0	0	0	114.5
473	T	29.4	Very low	29.3	Very low	119 Å²	119	125.5 Å²	125.5	73%	0.73	77%	0.774	S	S	*	*			trans	55.6	153.4	142.8	46.3	0	0	0	0	125.9
474	S	28.3	Very low	29.3	Very low	114 Å²	114	124.5 Å²	124.5	80%	0.797	78%	0.782	S	S	*	*			trans	87.5	152	148.8	77.8	0	0	0	0	119.7
475	V	29.4	Very low	29.1	Very low	137 Å²	137	129.4 Å²	129.4	83%	0.83	80%	0.795	S	S	*	*			cis	-172.7	168.3	-40.7	121.2	0	0	0	0	108.9
476	A	28.9	Very low	28.9	Very low	77 Å²	77	125.5 Å²	125.5	64%	0.636	79%	0.793	S	S	*	*			trans	73.7	116	166.1	0	0	0	0	0	117.6
477	T	27.4	Very low	28.6	Very low	129 Å²	129	121.5 Å²	121.5	79%	0.791	79%	0.794	S	S	*	*				67.5	148.6	84.5	65.6	0	0	0	0	115.5
478	T	28.6	Very low	28.7	Very low	110 Å²	110	123 Å²	123	68%	0.675	80%	0.796	S	S	*	*			cis	-166.2	157	21.3	-13.2	0	0	0	0	114
479	T	28.5	Very low	29.1	Very low	128 Å²	128	124.5 Å²	124.5	79%	0.785	79%	0.789	S	S	*	*			trans	63.2	143.2	144.4	53.7	0	0	0	0	126.7
480	A	27.6	Very low	29.1	Very low	97 Å²	97	129.9 Å²	129.9	80%	0.802	79%	0.789	S	S	*	*			trans	69.1	131.7	148.2	0	0	0	0	0	120.2
481	A	30.7	Very low	29.1	Very low	94 Å²	94	133.9 Å²	133.9	78%	0.777	79%	0.792	S	S	*	*			cis	102.3	112.9	7.5	0	0	0	0	0	118.3
482	S	31	Very low	30	Very low	120 Å²	120	131.5 Å²	131.5	84%	0.839	79%	0.785	S	S	*	*			trans	178	117.7	139.2	-85	0	0	0	0	117.6
483	K	30.6	Very low	29.9	Very low	202 Å²	202	130.4 Å²	130.4	88%	0.878	79%	0.785	S	S	*	*			trans	42.9	133.5	136.9	-71	177	175.3	172.5	0	125.2
484	A	28.9	Very low	29.7	Very low	99 Å²	99	133 Å²	133	82%	0.818	79%	0.789	S	S	*	*			trans	76.7	152	134.3	0	0	0	0	0	120.5
485	R	26	Very low	29.6	Very low	235 Å²	235	136 Å²	136	89%	0.887	79%	0.793	S	S	*	*			cis	-174.8	167.6	-18.5	-177.8	-171.4	-176.8	-164.8	2.6	108.4
486	V	26.5	Very low	30.3	Very low	122 Å²	122	133.4 Å²	133.4	74%	0.739	78%	0.779	S	S	*	*			trans	110.1	104.9	150.4	-174.5	0	0	0	0	120.5
487	A	24.7	Very low	30.3	Very low	96 Å²	96	139 Å²	139	79%	0.793	79%	0.789	S	S	*	*			trans	70.3	174.8	132.6	0	0	0	0	0	125.1
488	I	32.7	Very low	30.3	Very low	155 Å²	155	139.7 Å²	139.7	80%	0.795	79%	0.788	S	S	*	*			trans	-135.7	138.9	-158.1	-52.1	159.4	0	0	0	110.2
489	P	33.9	Very low	30.3	Very low	118 Å²	118	144 Å²	144	77%	0.766	80%	0.798	S	S	*	*				-132	147	122.6	9.8	12.5	0	0	0	111
490	K	28.2	Very low	30.3	Very low	200 Å²	200	141.4 Å²	141.4	87%	0.87	80%	0.796	S	S	*	*				72.6	111.2	59.2	-74.3	-165.3	174.2	-173.5	0	115.8
491	D	28.3	Very low	30.4	Very low	159 Å²	159	145.2 Å²	145.2	85%	0.85	80%	0.795	S	S	*	*			trans	-60.2	178.6	163	-100	-43.3	0	0	0	114.1
492	P	49.6	Very low	30.3	Very low	105 Å²	105	145.8 Å²	145.8	68%	0.682	80%	0.799	S	S	*	*			cis	-136.9	178.4	13	41.7	-25	0	0	0	117.5
493	T	27.8	Very low	30.4	Very low	122 Å²	122	147.2 Å²	147.2	75%	0.748	79%	0.793	S	S	*	*				176.3	129.9	121.2	37.7	0	0	0	0	115.3
494	E	26.3	Very low	30.3	Very low	175 Å²	175	143.2 Å²	143.2	82%	0.818	79%	0.79	S	S	*	*			trans	47.8	100.4	137.2	-54.1	-172.4	163.1	0	0	124.3
495	M	26.5	Very low	30.6	Very low	175 Å²	175	147.3 Å²	147.3	86%	0.862	79%	0.79	S	S	*	*				47.2	159	110.3	-60.9	-67.5	-82.7	0	0	122.8
496	P	43.7	Very low	30.9	Very low	84 Å²	84	143 Å²	143	55%	0.545	78%	0.784	S	S	.	*			cis	-143.5	-159.4	-43.5	41.4	-21.1	0	0	0	114.3
497	F	28.4	Very low	31.1	Very low	195 Å²	195	141.4 Å²	141.4	86%	0.855	78%	0.784	S	S	*	*			trans	77	152.7	176.3	-59.6	-72.3	0	0	0	116.8
498	D	26.9	Very low	31.5	Very low	142 Å²	142	141.5 Å²	141.5	76%	0.759	79%	0.785	S	S	*	*			cis	-139	165.4	4.6	-167	17.9	0	0	0	111.9
499	F	29	Very low	31.6	Very low	201 Å²	201	143.4 Å²	143.4	88%	0.882	79%	0.787	S	S	*	*			trans	-141.5	126.6	175.6	-129.7	-82.1	0	0	0	112.4
500	G	28.8	Very low	31.9	Very low	73 Å²	73	143.9 Å²	143.9	75%	0.753	79%	0.791	S	S	*	*			trans	-70.8	138.3	-167.9	0	0	0	0	0	116
501	K	30.5	Very low	32.7	Very low	177 Å²	177	138.5 Å²	138.5	77%	0.77	78%	0.783	S	S	*	*			trans	-74.1	151.4	171	-83.7	-175.2	169.3	-171.9	0	113.4	E503	K501-E503 HydrophobicContact CD-CG 4.21Å; K501-E503 WeakPolarHBondContact CD-OE1 3.48Å; K501-E503 WeakPolarHBondContact CE-OE1 3.4Å; K501-E503 IonicContact NZ-OE1 2.95Å; K501-E503 PolarHBondContact NZ-OE1 3.22Å
502	A	28.7	Very low	33.3	Very low	106 Å²	106	140.2 Å²	140.2	88%	0.876	79%	0.786	S	S	*	*			trans	-132.3	145.3	141.7	0	0	0	0	0	108.7
503	E	31.9	Very low	33.2	Very low	151 Å²	151	141.5 Å²	141.5	71%	0.706	79%	0.792	S	S	*	*			trans	-127.3	136.4	-173.5	-64.2	-174.4	164.8	0	0	112.9	K501	K501-E503 HydrophobicContact CD-CG 4.21Å; K501-E503 WeakPolarHBondContact CD-OE1 3.48Å; K501-E503 WeakPolarHBondContact CE-OE1 3.4Å; K501-E503 IonicContact NZ-OE1 2.95Å; K501-E503 PolarHBondContact NZ-OE1 3.22Å
504	S	29.6	Very low	34	Very low	117 Å²	117	139.3 Å²	139.3	82%	0.818	78%	0.782	S	S	*	*			trans	-157.8	121.4	150.1	61.7	0	0	0	0	112.6
505	K	34.8	Very low	35.6	Very low	186 Å²	186	134.2 Å²	134.2	81%	0.809	76%	0.762	S	S	*	*			trans	0.4	149.5	143.3	-69.9	178.7	-176.6	-179.2	0	118.9
506	D	31.5	Very low	37	Very low	143 Å²	143	131 Å²	131	77%	0.765	76%	0.757	S	S	*	*			cis	-157	166.4	26.6	-123.8	-34.6	0	0	0	115.3
507	A	32	Very low	37.6	Very low	89 Å²	89	129.3 Å²	129.3	74%	0.736	75%	0.75	S	S	*	*			trans	67.5	144.6	153.5	0	0	0	0	0	124.3
508	A	32.4	Very low	39.1	Very low	99 Å²	99	123.9 Å²	123.9	82%	0.818	73%	0.73	S	S	*	*			trans	68.7	107.1	155.7	0	0	0	0	0	121.6
509	K	35.9	Very low	41	Very low	194 Å²	194	123.6 Å²	123.6	84%	0.843	72%	0.722	S	S	*	*			trans	-74.3	158.2	150.6	-76.4	-176.6	175.7	179.1	0	110.1
510	P	39	Very low	42.8	Very low	129 Å²	129	119.2 Å²	119.2	84%	0.838	71%	0.707	S	S	*	*				-111.4	167.6	90.3	33.1	-36.3	0	0	0	112.9
511	A	44.8	Very low	44.8	Very low	86 Å²	86	120.3 Å²	120.3	71%	0.711	70%	0.696	S	S	*	*			trans	-89.7	139.1	175.6	0	0	0	0	0	111
512	Q	41	Very low	47.1	Very low	195 Å²	195	117.1 Å²	117.1	91%	0.911	69%	0.687	S	S	*	*			trans	-123.2	141.3	152.2	-78.5	-166.8	-23.9	0	0	109.3	S514	Q512-S514 PolarHBondContact O-N 3.1Å
513	V	47.2	Very low	49.4	Very low	132 Å²	132	117.8 Å²	117.8	80%	0.8	68%	0.675	S	S	*	*			trans	-85	104.4	175.3	176.9	0	0	0	0	106.9	T515	V513-T515 PolarHBondContact O-N 2.86Å; V513-T515 VanDerWaalsContact O-N 3.15Å
514	S	46.2	Very low	51.6	Low	77 Å²	77	116.2 Å²	116.2	54%	0.538	67%	0.668	S	S	.	*			trans	-60.7	116.9	167.9	62.5	0	0	0	0	108.2	Q512	Q512-S514 PolarHBondContact O-N 3.1Å
515	T	59.3	Low	53.9	Low	68 Å²	68	113.3 Å²	113.3	42%	0.417	65%	0.65	S	S	.	*			trans	-71.6	165.1	179.6	71.2	0	0	0	0	110.5	V513 A517 D518	V513-T515 PolarHBondContact O-N 2.86Å; V513-T515 VanDerWaalsContact O-N 3.15Å; T515-A517 PolarHBondContact O-N 3.36Å; T515-A517 PolarHBondContact OG1-N 3.24Å; T515-D518 WeakPolarHBondContact CA-OD2 3.43Å; T515-D518 WeakPolarHBondContact CB-OD2 2.93Å; T515-D518 PolarHBondContact N-OD2 3.14Å; T515-D518 PolarHBondContact O-N 2.92Å; T515-D518 VanDerWaalsContact OG1-CG 3.24Å; T515-D518 PolarHBondContact OG1-N 3.36Å; T515-D518 PolarHBondContact OG1-OD2 3.07Å
516	S	56.4	Low	56.4	Low	107 Å²	107	108.6 Å²	108.6	75%	0.748	63%	0.634	S	S	*	*	H	α-helix	trans	-61.8	-29.7	171.3	43.8	0	0	0	0	112.3	L520	S516-L520 PolarHBondContact O-N 2.93Å
517	A	55.8	Low	59	Low	49 Å²	49	106.5 Å²	106.5	41%	0.405	62%	0.62	S	S	.	*	H	α-helix	trans	-66.1	-39.9	177.2	0	0	0	0	0	112.4	T515 K519 L520 N521	T515-A517 PolarHBondContact O-N 3.36Å; T515-A517 PolarHBondContact OG1-N 3.24Å; A517-K519 VanDerWaalsContact C-N 3.29Å; A517-K519 PolarHBondContact O-N 3.42Å; A517-L520 PolarHBondContact O-N 3.47Å; A517-N521 PolarHBondContact O-N 2.83Å
518	D	60	Low	61.5	Low	81 Å²	81	104.2 Å²	104.2	43%	0.433	60%	0.601	S	S	.	*	H	α-helix	trans	-61.3	-38.9	-179.2	-56.7	-52.3	0	0	0	112.1	T515 L522	T515-D518 WeakPolarHBondContact CA-OD2 3.43Å; T515-D518 WeakPolarHBondContact CB-OD2 2.93Å; T515-D518 PolarHBondContact N-OD2 3.14Å; T515-D518 PolarHBondContact O-N 2.92Å; T515-D518 VanDerWaalsContact OG1-CG 3.24Å; T515-D518 PolarHBondContact OG1-N 3.36Å; T515-D518 PolarHBondContact OG1-OD2 3.07Å; D518-L522 WeakPolarHBondContact O-CB 3.34Å; D518-L522 PolarHBondContact O-N 3.21Å; D518-L522 VanDerWaalsContact O-N 3.11Å
519	K	65.4	Low	64.1	Low	135 Å²	135	101.4 Å²	101.4	59%	0.587	58%	0.577	S	S	*	*	H	α-helix	trans	-69.9	-33.8	174.4	-68.2	-174.4	177.5	-178	0	112.6	A517 L523	A517-K519 VanDerWaalsContact C-N 3.29Å; A517-K519 PolarHBondContact O-N 3.42Å; K519-L523 WeakPolarHBondContact O-CG 3.35Å; K519-L523 PolarHBondContact O-N 2.99Å
520	L	67.4	Low	66.7	Low	110 Å²	110	96.7 Å²	96.7	58%	0.576	57%	0.565	S	S	*	*	H	α-helix	trans	-73.3	-41.8	-179.6	-153.9	152.3	0	0	0	110.8	S516 A517 L522 L523 Q524	S516-L520 PolarHBondContact O-N 2.93Å; A517-L520 PolarHBondContact O-N 3.47Å; L520-L522 PolarHBondContact O-N 3.46Å; L520-L523 PolarHBondContact O-N 2.95Å; L520-Q524 PolarHBondContact O-N 3.13Å
521	N	71.8	Confident	69.1	Low	96 Å²	96	96.9 Å²	96.9	51%	0.513	55%	0.549	S	S	.	.	H	α-helix	trans	-59	-43.6	170.3	-70.8	-20.1	0	0	0	111.9	A517 L523 Q524 A525	A517-N521 PolarHBondContact O-N 2.83Å; N521-L523 PolarHBondContact O-N 2.97Å; N521-Q524 PolarHBondContact O-N 3.26Å; N521-A525 WeakPolarHBondContact O-CB 3.45Å; N521-A525 PolarHBondContact O-N 3.09Å
522	L	78.3	Confident	71.1	Confident	109 Å²	109	97.9 Å²	97.9	57%	0.571	54%	0.541	S	S	*	.	H	α-helix	trans	-64.5	-38.2	177	-177	61.4	0	0	0	112.4	D518 L520 N526	D518-L522 WeakPolarHBondContact O-CB 3.34Å; D518-L522 PolarHBondContact O-N 3.21Å; D518-L522 VanDerWaalsContact O-N 3.11Å; L520-L522 PolarHBondContact O-N 3.46Å; L522-N526 VanDerWaalsContact O-CG 3.25Å; L522-N526 PolarHBondContact O-N 2.82Å; L522-N526 PolarHBondContact O-ND2 3.04Å; L522-N526 VanDerWaalsContact O-ND2 3.09Å
523	L	76.3	Confident	73.4	Confident	120 Å²	120	93.5 Å²	93.5	63%	0.628	52%	0.521	S	S	*	.	H	α-helix	trans	-65	-44.1	173.6	-73.8	167.2	0	0	0	111.6	K519 L520 N521 A525 N526 E527	K519-L523 WeakPolarHBondContact O-CG 3.35Å; K519-L523 PolarHBondContact O-N 2.99Å; L520-L523 PolarHBondContact O-N 2.95Å; N521-L523 PolarHBondContact O-N 2.97Å; L523-A525 PolarHBondContact O-N 3.18Å; L523-N526 PolarHBondContact O-N 2.81Å; L523-E527 PolarHBondContact O-N 3.3Å
524	Q	78.1	Confident	75.4	Confident	119 Å²	119	90.3 Å²	90.3	56%	0.556	50%	0.504	S	S	*	.	H	α-helix	trans	-64.7	-38	177.7	-170.7	173.8	-2.2	0	0	112.2	L520 N521 E527 A528	L520-Q524 PolarHBondContact O-N 3.13Å; N521-Q524 PolarHBondContact O-N 3.26Å; Q524-E527 PolarHBondContact O-N 3.09Å; Q524-A528 WeakPolarHBondContact O-CB 3.38Å; Q524-A528 PolarHBondContact O-N 2.97Å
525	A	78.8	Confident	77.3	Confident	55 Å²	55	95.5 Å²	95.5	46%	0.455	51%	0.512	S	S	.	.	H	α-helix	trans	-63.9	-41.9	173	0	0	0	0	0	112.1	N521 L523 A528 A529	N521-A525 WeakPolarHBondContact O-CB 3.45Å; N521-A525 PolarHBondContact O-N 3.09Å; L523-A525 PolarHBondContact O-N 3.18Å; A525-A528 PolarHBondContact O-N 3.05Å; A525-A529 WeakPolarHBondContact O-CB 3.5Å; A525-A529 PolarHBondContact O-N 3.3Å
526	N	87	Confident	78.7	Confident	88 Å²	88	100.5 Å²	100.5	47%	0.471	52%	0.523	S	S	.	.	H	α-helix	trans	-64.8	-40.5	174.7	-71.9	-33.4	0	0	0	112	L522 L523 A529 V530	L522-N526 VanDerWaalsContact O-CG 3.25Å; L522-N526 PolarHBondContact O-N 2.82Å; L522-N526 PolarHBondContact O-ND2 3.04Å; L522-N526 VanDerWaalsContact O-ND2 3.09Å; L523-N526 PolarHBondContact O-N 2.81Å; N526-A529 PolarHBondContact O-N 3.27Å; N526-V530 WeakPolarHBondContact O-CG2 3.29Å; N526-V530 PolarHBondContact O-N 2.7Å
527	E	85.1	Confident	80.1	Confident	99 Å²	99	103.4 Å²	103.4	46%	0.463	52%	0.518	S	S	.	.	H	α-helix	trans	-63.8	-41.8	175.8	-164.6	-171.9	142.5	0	0	111.7	L523 Q524 V530 R531	L523-E527 PolarHBondContact O-N 3.3Å; Q524-E527 PolarHBondContact O-N 3.09Å; E527-V530 PolarHBondContact O-N 3.11Å; E527-R531 PolarHBondContact O-N 3.1Å; E527-R531 IonicContact OE1-CZ 3.37Å; E527-R531 IonicContact OE1-NH1 3.19Å; E527-R531 PolarHBondContact OE1-NH1 2.7Å; E527-R531 IonicContact OE1-NH2 2.74Å; E527-R531 PolarHBondContact OE1-NH2 2.9Å
528	A	84.4	Confident	81.5	Confident	41 Å²	41	102 Å²	102	34%	0.339	51%	0.509	S	S	.	.	H	α-helix	trans	-62.9	-44.3	173.1	0	0	0	0	0	112	Q524 A525 V530 R531 I532	Q524-A528 WeakPolarHBondContact O-CB 3.38Å; Q524-A528 PolarHBondContact O-N 2.97Å; A525-A528 PolarHBondContact O-N 3.05Å; A528-V530 VanDerWaalsContact C-N 3.34Å; A528-V530 PolarHBondContact O-N 3.49Å; A528-R531 WeakPolarHBondContact O-CB 3.15Å; A528-R531 PolarHBondContact O-N 2.92Å; A528-I532 WeakPolarHBondContact O-CG1 3.33Å; A528-I532 PolarHBondContact O-N 3.33Å
529	A	87.2	Confident	82.6	Confident	39 Å²	39	102.7 Å²	102.7	32%	0.322	51%	0.509	S	S	.	.	H	α-helix	trans	-60.6	-41.5	176.1	0	0	0	0	0	112.2	A525 N526 I532 Q533	A525-A529 WeakPolarHBondContact O-CB 3.5Å; A525-A529 PolarHBondContact O-N 3.3Å; N526-A529 PolarHBondContact O-N 3.27Å; A529-I532 PolarHBondContact O-N 2.87Å; A529-Q533 WeakPolarHBondContact O-CB 3.3Å; A529-Q533 VanDerWaalsContact O-CG 3.28Å; A529-Q533 WeakPolarHBondContact O-CG 3.47Å; A529-Q533 PolarHBondContact O-N 3.03Å
530	V	91.2	Very high	83.5	Confident	95 Å²	95	101.8 Å²	101.8	58%	0.576	50%	0.503	S	S	*	.	H	α-helix	trans	-64.2	-40.8	174.6	170.8	0	0	0	0	111.6	N526 E527 A528 Q533 S534	N526-V530 WeakPolarHBondContact O-CG2 3.29Å; N526-V530 PolarHBondContact O-N 2.7Å; E527-V530 PolarHBondContact O-N 3.11Å; A528-V530 VanDerWaalsContact C-N 3.34Å; A528-V530 PolarHBondContact O-N 3.49Å; V530-Q533 PolarHBondContact O-N 3.47Å; V530-S534 WeakPolarHBondContact O-CB 3.44Å; V530-S534 PolarHBondContact O-N 3.1Å
531	R	88.7	Confident	84.4	Confident	133 Å²	133	100 Å²	100	50%	0.502	50%	0.496	S	S	.	.	H	α-helix	trans	-59.4	-51.2	173	-75.6	-172.7	176.6	98.9	10.4	111.4	E527 A528 Q533 S534 W535	E527-R531 PolarHBondContact O-N 3.1Å; E527-R531 IonicContact OE1-CZ 3.37Å; E527-R531 IonicContact OE1-NH1 3.19Å; E527-R531 PolarHBondContact OE1-NH1 2.7Å; E527-R531 IonicContact OE1-NH2 2.74Å; E527-R531 PolarHBondContact OE1-NH2 2.9Å; A528-R531 WeakPolarHBondContact O-CB 3.15Å; A528-R531 PolarHBondContact O-N 2.92Å; R531-Q533 PolarHBondContact O-N 3.15Å; R531-S534 PolarHBondContact O-N 2.97Å; R531-S534 VanDerWaalsContact O-N 3.1Å; R531-S534 PolarHBondContact O-OG 2.77Å; R531-W535 PolarHBondContact O-N 3.09Å
532	I	87.7	Confident	84.7	Confident	108 Å²	108	102.4 Å²	102.4	55%	0.554	50%	0.498	S	S	*	.	H	α-helix	trans	-58.2	-46.2	179	-67	163.1	0	0	0	110.8	A528 A529 S534 W535 W536	A528-I532 WeakPolarHBondContact O-CG1 3.33Å; A528-I532 PolarHBondContact O-N 3.33Å; A529-I532 PolarHBondContact O-N 2.87Å; I532-S534 VanDerWaalsContact C-N 3.34Å; I532-S534 PolarHBondContact O-N 3.4Å; I532-W535 PolarHBondContact O-N 2.88Å; I532-W536 WeakPolarHBondContact O-CB 3.11Å; I532-W536 PolarHBondContact O-N 3.45Å
533	Q	89.2	Confident	84.4	Confident	103 Å²	103	99.3 Å²	99.3	48%	0.481	49%	0.485	S	S	.	.	H	α-helix	trans	-62.4	-37.9	175.9	-72.3	176.2	16.7	0	0	112.7	A529 V530 R531 R537	A529-Q533 WeakPolarHBondContact O-CB 3.3Å; A529-Q533 VanDerWaalsContact O-CG 3.28Å; A529-Q533 WeakPolarHBondContact O-CG 3.47Å; A529-Q533 PolarHBondContact O-N 3.03Å; V530-Q533 PolarHBondContact O-N 3.47Å; R531-Q533 PolarHBondContact O-N 3.15Å; Q533-R537 WeakPolarHBondContact O-CB 3.44Å; Q533-R537 VanDerWaalsContact O-CG 3.24Å; Q533-R537 WeakPolarHBondContact O-CG 3.37Å; Q533-R537 PolarHBondContact O-N 3.28Å
534	S	88.1	Confident	84.5	Confident	64 Å²	64	100 Å²	100	45%	0.448	48%	0.483	S	S	.	.	H	α-helix	trans	-66.7	-40.2	176.1	79.7	0	0	0	0	112.2	V530 R531 I532 G538	V530-S534 WeakPolarHBondContact O-CB 3.44Å; V530-S534 PolarHBondContact O-N 3.1Å; R531-S534 PolarHBondContact O-N 2.97Å; R531-S534 VanDerWaalsContact O-N 3.1Å; R531-S534 PolarHBondContact O-OG 2.77Å; I532-S534 VanDerWaalsContact C-N 3.34Å; I532-S534 PolarHBondContact O-N 3.4Å; S534-G538 PolarHBondContact O-N 2.82Å
535	W	87.1	Confident	85	Confident	186 Å²	186	98.9 Å²	98.9	71%	0.705	48%	0.478	S	S	*	.	H	α-helix	trans	-66.9	-44.5	175.8	-72.6	0.8	0	0	0	111.6	R531 I532 G538 H539	R531-W535 PolarHBondContact O-N 3.09Å; I532-W535 PolarHBondContact O-N 2.88Å; W535-G538 CarbonylContact O-C 3.48Å; W535-G538 PolarHBondContact O-N 3.46Å; W535-H539 WeakPolarHBondContact O-CB 3.45Å; W535-H539 PolarHBondContact O-N 3.49Å
536	W	89.1	Confident	85.2	Confident	174 Å²	174	101 Å²	101	66%	0.659	49%	0.487	S	S	*	.	H	α-helix	trans	-64.6	-44.2	177.8	-169.3	86.4	0	0	0	111.7	I532 G538 H539 Y540	I532-W536 WeakPolarHBondContact O-CB 3.11Å; I532-W536 PolarHBondContact O-N 3.45Å; W536-G538 VanDerWaalsContact C-N 3.33Å; W536-G538 PolarHBondContact O-N 3.04Å; W536-H539 PolarHBondContact O-N 2.96Å; W536-Y540 HydrophobicContact CH2-CD2 4.1Å; W536-Y540 HydrophobicContact CZ2-CD2 4.4Å; W536-Y540 VanDerWaalsContact O-CB 3.32Å; W536-Y540 WeakPolarHBondContact O-CB 3.31Å; W536-Y540 PolarHBondContact O-N 2.96Å
537	R	85.4	Confident	85.2	Confident	167 Å²	167	99.1 Å²	99.1	63%	0.63	48%	0.484	S	S	*	.	H	α-helix	trans	-59.8	-42.2	171.8	-73.4	173.7	-178.7	-174.8	2.3	111.9	Q533 Y540 V541	Q533-R537 WeakPolarHBondContact O-CB 3.44Å; Q533-R537 VanDerWaalsContact O-CG 3.24Å; Q533-R537 WeakPolarHBondContact O-CG 3.37Å; Q533-R537 PolarHBondContact O-N 3.28Å; R537-Y540 PolarHBondContact O-N 3.47Å; R537-V541 WeakPolarHBondContact O-CG2 3.31Å; R537-V541 PolarHBondContact O-N 3.48Å
538	G	85.8	Confident	85.1	Confident	21 Å²	21	95.7 Å²	95.7	22%	0.216	47%	0.473	C	S	.	.	H	α-helix	trans	-64.6	-40	176.1	0	0	0	0	0	113.4	S534 W535 W536 R542	S534-G538 PolarHBondContact O-N 2.82Å; W535-G538 CarbonylContact O-C 3.48Å; W535-G538 PolarHBondContact O-N 3.46Å; W536-G538 VanDerWaalsContact C-N 3.33Å; W536-G538 PolarHBondContact O-N 3.04Å; G538-R542 VanDerWaalsContact O-CG 3.32Å; G538-R542 WeakPolarHBondContact O-CG 3.49Å; G538-R542 PolarHBondContact O-N 2.79Å; G538-R542 PolarHBondContact O-NE 3.24Å; G538-R542 PolarHBondContact O-NH1 2.8Å
539	H	81.8	Confident	85	Confident	94 Å²	94	99.7 Å²	99.7	44%	0.435	48%	0.482	S	S	.	.	H	α-helix	trans	-64.8	-49.1	172.4	-177.7	112	0	0	0	110.4	W535 W536 V541 R542 C543	W535-H539 WeakPolarHBondContact O-CB 3.45Å; W535-H539 PolarHBondContact O-N 3.49Å; W536-H539 PolarHBondContact O-N 2.96Å; H539-V541 VanDerWaalsContact C-N 3.32Å; H539-V541 PolarHBondContact O-N 2.86Å; H539-R542 PolarHBondContact O-N 3.21Å; H539-C543 PolarHBondContact NE2-SG 3.16Å; H539-C543 VanDerWaalsContact NE2-SG 3.37Å; H539-C543 WeakPolarHBondContact O-CB 3.29Å; H539-C543 PolarHBondContact O-N 3.26Å; H539-C543 PolarHBondContact O-SG 3.09Å
540	Y	84.8	Confident	85	Confident	116 Å²	116	104.2 Å²	104.2	46%	0.455	50%	0.497	S	S	.	.	H	α-helix	trans	-55.9	-46.6	-179	-173.6	-93	0	0	0	111.6	W536 R537 R542 C543 F544 H545	W536-Y540 HydrophobicContact CH2-CD2 4.1Å; W536-Y540 HydrophobicContact CZ2-CD2 4.4Å; W536-Y540 VanDerWaalsContact O-CB 3.32Å; W536-Y540 WeakPolarHBondContact O-CB 3.31Å; W536-Y540 PolarHBondContact O-N 2.96Å; R537-Y540 PolarHBondContact O-N 3.47Å; Y540-R542 PolarHBondContact O-N 3.26Å; Y540-C543 PolarHBondContact O-N 2.89Å; Y540-F544 HydrophobicContact CD2-CB 4.12Å; Y540-F544 AromaticContact CD2-CD2 3.74Å; Y540-F544 HydrophobicContact CD2-CD2 3.74Å; Y540-F544 HydrophobicContact CD2-CE2 4.44Å; Y540-F544 HydrophobicContact CD2-CG 4.07Å; Y540-F544 HydrophobicContact CE1-CB 4.34Å; Y540-F544 HydrophobicContact CE2-CB 3.84Å; Y540-F544 HydrophobicContact CE2-CD2 4.1Å; Y540-F544 AromaticContact CE2-CG 3.96Å; Y540-F544 HydrophobicContact CE2-CG 3.96Å; Y540-F544 HydrophobicContact CG-CB 4.49Å; Y540-F544 HydrophobicContact CG-CD2 4.34Å; Y540-F544 WeakPolarHBondContact O-CB 3.48Å; Y540-F544 PolarHBondContact O-N 3.3Å; Y540-H545 PolarHBondContact O-N 2.92Å
541	V	85.5	Confident	85	Confident	73 Å²	73	103.2 Å²	103.2	44%	0.442	49%	0.491	S	S	.	.	H	α-helix	trans	-63.1	-38.5	175.3	173.1	0	0	0	0	112.2	R537 H539 C543 H545 A548	R537-V541 WeakPolarHBondContact O-CG2 3.31Å; R537-V541 PolarHBondContact O-N 3.48Å; H539-V541 VanDerWaalsContact C-N 3.32Å; H539-V541 PolarHBondContact O-N 2.86Å; V541-C543 PolarHBondContact O-N 3.32Å; V541-H545 HydrophobicContact CG1-CB 4.37Å; V541-H545 WeakPolarHBondContact O-CB 3.36Å; V541-A548 HydrophobicContact CG1-CB 4.42Å; V541-A548 WeakPolarHBondContact O-CB 3.5Å
542	R	78.5	Confident	84.7	Confident	147 Å²	147	102.8 Å²	102.8	56%	0.555	49%	0.489	S	S	*	.	H	α-helix	trans	-77	-14.4	-179.7	-72.2	-174.6	-57.2	-98.1	2.4	115.4	G538 H539 Y540 R552	G538-R542 VanDerWaalsContact O-CG 3.32Å; G538-R542 WeakPolarHBondContact O-CG 3.49Å; G538-R542 PolarHBondContact O-N 2.79Å; G538-R542 PolarHBondContact O-NE 3.24Å; G538-R542 PolarHBondContact O-NH1 2.8Å; H539-R542 PolarHBondContact O-N 3.21Å; Y540-R542 PolarHBondContact O-N 3.26Å; R542-R552 PolarHBondContact O-NH1 3.31Å
543	C	73.4	Confident	84.4	Confident	44 Å²	44	100.9 Å²	100.9	30%	0.297	49%	0.485	S	S	.	.	H	α-helix	trans	-117.1	-37.3	-174.3	-64.1	0	0	0	0	113.3	H539 Y540 V541	H539-C543 PolarHBondContact NE2-SG 3.16Å; H539-C543 VanDerWaalsContact NE2-SG 3.37Å; H539-C543 WeakPolarHBondContact O-CB 3.29Å; H539-C543 PolarHBondContact O-N 3.26Å; H539-C543 PolarHBondContact O-SG 3.09Å; Y540-C543 PolarHBondContact O-N 2.89Å; V541-C543 PolarHBondContact O-N 3.32Å
544	F	78.2	Confident	84.6	Confident	134 Å²	134	100.2 Å²	100.2	59%	0.588	48%	0.482	S	S	*	.	H	α-helix	trans	-116.8	-15.3	-170.2	-58.1	-91.7	0	0	0	114.5	Y540	Y540-F544 HydrophobicContact CD2-CB 4.12Å; Y540-F544 AromaticContact CD2-CD2 3.74Å; Y540-F544 HydrophobicContact CD2-CD2 3.74Å; Y540-F544 HydrophobicContact CD2-CE2 4.44Å; Y540-F544 HydrophobicContact CD2-CG 4.07Å; Y540-F544 HydrophobicContact CE1-CB 4.34Å; Y540-F544 HydrophobicContact CE2-CB 3.84Å; Y540-F544 HydrophobicContact CE2-CD2 4.1Å; Y540-F544 AromaticContact CE2-CG 3.96Å; Y540-F544 HydrophobicContact CE2-CG 3.96Å; Y540-F544 HydrophobicContact CG-CB 4.49Å; Y540-F544 HydrophobicContact CG-CD2 4.34Å; Y540-F544 WeakPolarHBondContact O-CB 3.48Å; Y540-F544 PolarHBondContact O-N 3.3Å
545	H	87.8	Confident	84.8	Confident	95 Å²	95	100.9 Å²	100.9	44%	0.44	48%	0.48	S	S	.	.			trans	-79.1	120	175.4	-171.1	-85.4	0	0	0	110.5	Y540 V541 A547 A548 K549	Y540-H545 PolarHBondContact O-N 2.92Å; V541-H545 HydrophobicContact CG1-CB 4.37Å; V541-H545 WeakPolarHBondContact O-CB 3.36Å; H545-A547 PolarHBondContact O-N 2.89Å; H545-A548 HydrophobicContact CB-CB 4.13Å; H545-A548 WeakPolarHBondContact O-CB 3.31Å; H545-A548 PolarHBondContact O-N 3.07Å; H545-K549 PolarHBondContact O-N 3.42Å
546	P	83.3	Confident	84.9	Confident	99 Å²	99	94.8 Å²	94.8	64%	0.643	46%	0.457	S	S	*	.	H	α-helix	trans	-60.3	-50.2	-165.3	20	-31.9	0	0	0	113.3	A548 K549 E550	P546-A548 PolarHBondContact O-N 3.25Å; P546-A548 VanDerWaalsContact O-N 3.13Å; P546-K549 WeakPolarHBondContact O-CB 3.34Å; P546-K549 PolarHBondContact O-N 3.12Å; P546-K549 VanDerWaalsContact O-N 3.09Å; P546-E550 PolarHBondContact O-N 3.48Å
547	A	86.9	Confident	85	Confident	50 Å²	50	90.5 Å²	90.5	41%	0.413	45%	0.446	S	S	.	.	H	α-helix	trans	-63.7	-19.9	178.1	0	0	0	0	0	113.7	H545 V551	H545-A547 PolarHBondContact O-N 2.89Å; A547-V551 WeakPolarHBondContact O-CG2 3.21Å; A547-V551 PolarHBondContact O-N 3Å
548	A	83	Confident	85.3	Confident	27 Å²	27	88.9 Å²	88.9	22%	0.223	44%	0.44	C	S	.	.	H	α-helix	trans	-86.3	-33.1	175.2	0	0	0	0	0	111.8	V541 H545 P546 R552	V541-A548 HydrophobicContact CG1-CB 4.42Å; V541-A548 WeakPolarHBondContact O-CB 3.5Å; H545-A548 HydrophobicContact CB-CB 4.13Å; H545-A548 WeakPolarHBondContact O-CB 3.31Å; H545-A548 PolarHBondContact O-N 3.07Å; P546-A548 PolarHBondContact O-N 3.25Å; P546-A548 VanDerWaalsContact O-N 3.13Å; A548-R552 WeakPolarHBondContact O-CB 3.42Å; A548-R552 PolarHBondContact O-N 3.4Å
549	K	81.5	Confident	85.6	Confident	125 Å²	125	96 Å²	96	54%	0.543	46%	0.46	S	S	.	.	H	α-helix	trans	-60.5	-46.9	167.7	-173.3	178.7	179.2	-179.2	0	110	H545 P546 R552 S553	H545-K549 PolarHBondContact O-N 3.42Å; P546-K549 WeakPolarHBondContact O-CB 3.34Å; P546-K549 PolarHBondContact O-N 3.12Å; P546-K549 VanDerWaalsContact O-N 3.09Å; K549-R552 WeakPolarHBondContact O-CB 3.47Å; K549-R552 PolarHBondContact O-N 3.42Å; K549-S553 PolarHBondContact O-N 3.26Å; K549-S553 PolarHBondContact O-OG 3.14Å
550	E	88.6	Confident	86.1	Confident	134 Å²	134	95.7 Å²	95.7	63%	0.626	46%	0.46	S	S	*	.	H	α-helix	trans	-58.9	-55.3	179.4	-173.9	175.1	-160.6	0	0	112.8	P546 R552 S553 E554	P546-E550 PolarHBondContact O-N 3.48Å; E550-R552 VanDerWaalsContact C-N 3.26Å; E550-R552 PolarHBondContact O-N 3.13Å; E550-S553 WeakPolarHBondContact CA-OG 3.48Å; E550-S553 PolarHBondContact O-N 2.92Å; E550-S553 VanDerWaalsContact O-N 3.1Å; E550-S553 PolarHBondContact O-OG 3.44Å; E550-E554 PolarHBondContact O-N 2.93Å
551	V	89.7	Confident	86.5	Confident	74 Å²	74	94.9 Å²	94.9	45%	0.448	46%	0.461	S	S	.	.	H	α-helix	trans	-60.9	-35.2	176.6	170.3	0	0	0	0	111.8	A547 E554 I555	A547-V551 WeakPolarHBondContact O-CG2 3.21Å; A547-V551 PolarHBondContact O-N 3Å; V551-E554 PolarHBondContact O-N 2.8Å; V551-I555 HydrophobicContact CG1-CD1 3.77Å; V551-I555 HydrophobicContact CG1-CG1 4.42Å; V551-I555 WeakPolarHBondContact O-CB 3.43Å; V551-I555 VanDerWaalsContact O-CG1 3.29Å; V551-I555 WeakPolarHBondContact O-CG1 3.29Å; V551-I555 PolarHBondContact O-N 2.97Å
552	R	82.8	Confident	86.8	Confident	124 Å²	124	97 Å²	97	47%	0.468	47%	0.466	S	S	.	.	H	α-helix	trans	-66.5	-40.3	174.6	-179.4	179.1	174	-167	-5.2	112.1	R542 A548 K549 E550 R556	R542-R552 PolarHBondContact O-NH1 3.31Å; A548-R552 WeakPolarHBondContact O-CB 3.42Å; A548-R552 PolarHBondContact O-N 3.4Å; K549-R552 WeakPolarHBondContact O-CB 3.47Å; K549-R552 PolarHBondContact O-N 3.42Å; E550-R552 VanDerWaalsContact C-N 3.26Å; E550-R552 PolarHBondContact O-N 3.13Å; R552-R556 WeakPolarHBondContact O-CB 3.34Å; R552-R556 PolarHBondContact O-N 2.91Å
553	S	82.8	Confident	87.3	Confident	68 Å²	68	93.6 Å²	93.6	48%	0.476	46%	0.456	S	S	.	.	H	α-helix	trans	-66.2	-39.4	173	37.9	0	0	0	0	112.3	K549 E550 R556 L557	K549-S553 PolarHBondContact O-N 3.26Å; K549-S553 PolarHBondContact O-OG 3.14Å; E550-S553 WeakPolarHBondContact CA-OG 3.48Å; E550-S553 PolarHBondContact O-N 2.92Å; E550-S553 VanDerWaalsContact O-N 3.1Å; E550-S553 PolarHBondContact O-OG 3.44Å; S553-R556 PolarHBondContact O-N 3.25Å; S553-L557 WeakPolarHBondContact O-CB 3.4Å; S553-L557 PolarHBondContact O-N 2.97Å
554	E	93.4	Very high	88.2	Confident	88 Å²	88	95.8 Å²	95.8	41%	0.411	46%	0.464	S	S	.	.	H	α-helix	trans	-63.7	-46.6	176.8	-163	-161.4	159.2	0	0	111.7	E550 V551 R556 L557 R558	E550-E554 PolarHBondContact O-N 2.93Å; V551-E554 PolarHBondContact O-N 2.8Å; E554-R556 VanDerWaalsContact C-N 3.31Å; E554-R556 PolarHBondContact O-N 3.5Å; E554-L557 PolarHBondContact O-N 2.91Å; E554-R558 WeakPolarHBondContact O-CG 3.47Å; E554-R558 PolarHBondContact O-N 3.35Å; E554-R558 IonicContact OE1-CZ 2.67Å; E554-R558 IonicContact OE1-NE 2.7Å; E554-R558 PolarHBondContact OE1-NE 3.47Å; E554-R558 IonicContact OE1-NH2 2.59Å; E554-R558 PolarHBondContact OE1-NH2 2.84Å
555	I	90.5	Very high	88.9	Confident	78 Å²	78	95.4 Å²	95.4	40%	0.4	47%	0.467	S	S	.	.	H	α-helix	trans	-62.9	-38.3	176.7	-68.2	167.6	0	0	0	111.1	V551 R559	V551-I555 HydrophobicContact CG1-CD1 3.77Å; V551-I555 HydrophobicContact CG1-CG1 4.42Å; V551-I555 WeakPolarHBondContact O-CB 3.43Å; V551-I555 VanDerWaalsContact O-CG1 3.29Å; V551-I555 WeakPolarHBondContact O-CG1 3.29Å; V551-I555 PolarHBondContact O-N 2.97Å; I555-R559 WeakPolarHBondContact O-CB 3.49Å; I555-R559 VanDerWaalsContact O-CG 3.31Å; I555-R559 WeakPolarHBondContact O-CG 3.34Å; I555-R559 PolarHBondContact O-N 2.93Å; I555-R559 VanDerWaalsContact O-N 3.13Å
556	R	89.6	Confident	89.2	Confident	59 Å²	59	96.2 Å²	96.2	22%	0.223	47%	0.47	C	S	.	.	H	α-helix	trans	-65.4	-44.4	175.3	-171.6	-179.1	-171.1	161.7	6.6	111.4	L411 P412 F413 R552 S553 E554 M560	L411-R556 VanDerWaalsContact CB-NH2 3.27Å; L411-R556 HydrophobicContact CD1-CG 4.03Å; L411-R556 PolarHBondContact O-NH2 3.01Å; P412-R556 PolarHBondContact O-NH1 2.83Å; P412-R556 PolarHBondContact O-NH2 3.03Å; F413-R556 VanDerWaalsContact CE2-CZ 3.45Å; F413-R556 VanDerWaalsContact CE2-NE 3.34Å; R552-R556 WeakPolarHBondContact O-CB 3.34Å; R552-R556 PolarHBondContact O-N 2.91Å; S553-R556 PolarHBondContact O-N 3.25Å; E554-R556 VanDerWaalsContact C-N 3.31Å; E554-R556 PolarHBondContact O-N 3.5Å; R556-M560 WeakPolarHBondContact O-CB 3.47Å; R556-M560 PolarHBondContact O-N 3.08Å
557	L	91.7	Very high	89.5	Confident	83 Å²	83	94.7 Å²	94.7	44%	0.435	46%	0.456	S	S	.	.	H	α-helix	trans	-63.5	-46.8	179.3	179.3	58.8	0	0	0	111.6	S553 E554 M560 Q561	S553-L557 WeakPolarHBondContact O-CB 3.4Å; S553-L557 PolarHBondContact O-N 2.97Å; E554-L557 PolarHBondContact O-N 2.91Å; L557-M560 HydrophobicContact CD1-CE 3.79Å; L557-M560 PolarHBondContact O-N 3.15Å; L557-Q561 HydrophobicContact CD1-CG 4.32Å; L557-Q561 VanDerWaalsContact O-CG 3.31Å; L557-Q561 WeakPolarHBondContact O-CG 3.35Å; L557-Q561 PolarHBondContact O-N 2.99Å
558	R	92.1	Very high	89.8	Confident	133 Å²	133	95.5 Å²	95.5	50%	0.502	46%	0.458	S	S	.	.	H	α-helix	trans	-57.5	-50.7	175.9	-73.1	171.3	177.2	-95.4	4.6	111.7	E554 M560 Q561 E562	E554-R558 WeakPolarHBondContact O-CG 3.47Å; E554-R558 PolarHBondContact O-N 3.35Å; E554-R558 IonicContact OE1-CZ 2.67Å; E554-R558 IonicContact OE1-NE 2.7Å; E554-R558 PolarHBondContact OE1-NE 3.47Å; E554-R558 IonicContact OE1-NH2 2.59Å; E554-R558 PolarHBondContact OE1-NH2 2.84Å; R558-M560 VanDerWaalsContact C-N 3.3Å; R558-M560 PolarHBondContact O-N 2.99Å; R558-Q561 WeakPolarHBondContact O-CB 3.47Å; R558-Q561 PolarHBondContact O-N 2.81Å; R558-Q561 VanDerWaalsContact O-N 3.14Å; R558-E562 WeakPolarHBondContact O-CB 3.43Å; R558-E562 VanDerWaalsContact O-CG 3.28Å; R558-E562 WeakPolarHBondContact O-CG 3.4Å; R558-E562 PolarHBondContact O-N 3.35Å
559	R	92.4	Very high	90.3	Very high	170 Å²	170	98.9 Å²	98.9	64%	0.642	47%	0.473	S	S	*	.	H	α-helix	trans	-61.2	-37.2	177.6	-72.8	175.8	179.2	-167.3	-1.6	113.1	I555 H563	I555-R559 WeakPolarHBondContact O-CB 3.49Å; I555-R559 VanDerWaalsContact O-CG 3.31Å; I555-R559 WeakPolarHBondContact O-CG 3.34Å; I555-R559 PolarHBondContact O-N 2.93Å; I555-R559 VanDerWaalsContact O-N 3.13Å; R559-H563 VanDerWaalsContact O-CB 3.29Å; R559-H563 WeakPolarHBondContact O-CB 3.46Å; R559-H563 PolarHBondContact O-N 3.21Å
560	M	92.1	Very high	90.9	Very high	88 Å²	88	96.1 Å²	96.1	43%	0.433	46%	0.461	S	S	.	.	H	α-helix	trans	-66.2	-41.6	175.6	-173.6	174.1	70.9	0	0	111.2	R556 L557 R558 H563 I564	R556-M560 WeakPolarHBondContact O-CB 3.47Å; R556-M560 PolarHBondContact O-N 3.08Å; L557-M560 HydrophobicContact CD1-CE 3.79Å; L557-M560 PolarHBondContact O-N 3.15Å; R558-M560 VanDerWaalsContact C-N 3.3Å; R558-M560 PolarHBondContact O-N 2.99Å; M560-H563 PolarHBondContact O-N 3.03Å; M560-I564 HydrophobicContact CG-CD1 4.06Å; M560-I564 WeakPolarHBondContact O-CB 3.44Å; M560-I564 WeakPolarHBondContact O-CD1 3.44Å; M560-I564 WeakPolarHBondContact O-CG1 3.19Å; M560-I564 PolarHBondContact O-N 3.38Å
561	Q	92.8	Very high	91.1	Very high	100 Å²	100	95.6 Å²	95.6	47%	0.467	46%	0.461	S	S	.	.	H	α-helix	trans	-66.2	-44.4	175.3	-70.8	167.6	-25.7	0	0	112.1	L557 R558 H563 I564 L565	L557-Q561 HydrophobicContact CD1-CG 4.32Å; L557-Q561 VanDerWaalsContact O-CG 3.31Å; L557-Q561 WeakPolarHBondContact O-CG 3.35Å; L557-Q561 PolarHBondContact O-N 2.99Å; R558-Q561 WeakPolarHBondContact O-CB 3.47Å; R558-Q561 PolarHBondContact O-N 2.81Å; R558-Q561 VanDerWaalsContact O-N 3.14Å; Q561-H563 VanDerWaalsContact C-N 3.33Å; Q561-H563 PolarHBondContact O-N 3.17Å; Q561-I564 PolarHBondContact O-N 3.35Å; Q561-L565 WeakPolarHBondContact O-CG 3.25Å; Q561-L565 PolarHBondContact O-N 2.64Å
562	E	91.4	Very high	91.2	Very high	117 Å²	117	98.8 Å²	98.8	55%	0.547	47%	0.472	S	S	.	.	H	α-helix	trans	-58.2	-43.2	173.8	-71.5	159.9	-176.1	0	0	111.4	R558 L565 F566	R558-E562 WeakPolarHBondContact O-CB 3.43Å; R558-E562 VanDerWaalsContact O-CG 3.28Å; R558-E562 WeakPolarHBondContact O-CG 3.4Å; R558-E562 PolarHBondContact O-N 3.35Å; E562-L565 PolarHBondContact O-N 3.2Å; E562-F566 PolarHBondContact O-N 2.9Å
563	H	89.3	Confident	91.7	Very high	75 Å²	75	95.8 Å²	95.8	35%	0.347	47%	0.467	S	S	.	.	H	α-helix	trans	-71.2	-36.4	177.8	-169.3	-113.9	0	0	0	113.1	R559 M560 Q561 F566 L567	R559-H563 VanDerWaalsContact O-CB 3.29Å; R559-H563 WeakPolarHBondContact O-CB 3.46Å; R559-H563 PolarHBondContact O-N 3.21Å; M560-H563 PolarHBondContact O-N 3.03Å; Q561-H563 VanDerWaalsContact C-N 3.33Å; Q561-H563 PolarHBondContact O-N 3.17Å; H563-F566 PolarHBondContact O-N 2.85Å; H563-L567 WeakPolarHBondContact O-CG 3.26Å; H563-L567 PolarHBondContact O-N 2.93Å
564	I	92.8	Very high	92	Very high	91 Å²	91	95.8 Å²	95.8	47%	0.467	46%	0.46	S	S	.	.	H	α-helix	trans	-61.4	-46.9	172.9	-73	162.4	0	0	0	110.2	M560 Q561 F566 L567 S568	M560-I564 HydrophobicContact CG-CD1 4.06Å; M560-I564 WeakPolarHBondContact O-CB 3.44Å; M560-I564 WeakPolarHBondContact O-CD1 3.44Å; M560-I564 WeakPolarHBondContact O-CG1 3.19Å; M560-I564 PolarHBondContact O-N 3.38Å; Q561-I564 PolarHBondContact O-N 3.35Å; I564-F566 PolarHBondContact O-N 3.3Å; I564-L567 PolarHBondContact O-N 3.42Å; I564-S568 PolarHBondContact O-N 2.69Å; I564-S568 PolarHBondContact O-OG 3Å
565	L	93.2	Very high	92	Very high	125 Å²	125	98.1 Å²	98.1	65%	0.654	47%	0.471	S	S	*	.	H	α-helix	trans	-61	-42.8	177.3	-70.2	170.1	0	0	0	112.1	Q561 E562 S568 D569	Q561-L565 WeakPolarHBondContact O-CG 3.25Å; Q561-L565 PolarHBondContact O-N 2.64Å; E562-L565 PolarHBondContact O-N 3.2Å; L565-S568 PolarHBondContact O-N 2.92Å; L565-D569 PolarHBondContact O-N 3.45Å
566	F	93.8	Very high	92.2	Very high	112 Å²	112	100.4 Å²	100.4	49%	0.491	48%	0.478	S	S	.	.	H	α-helix	trans	-61.7	-40.7	174.8	173.3	-104.6	0	0	0	112.8	E562 H563 I564 K570	E562-F566 PolarHBondContact O-N 2.9Å; H563-F566 PolarHBondContact O-N 2.85Å; I564-F566 PolarHBondContact O-N 3.3Å; F566-K570 WeakPolarHBondContact O-CB 3.41Å; F566-K570 PolarHBondContact O-N 2.91Å
567	L	88.8	Confident	92.3	Very high	68 Å²	68	102.7 Å²	102.7	36%	0.356	49%	0.491	S	S	.	.	H	α-helix	trans	-69.3	-35.2	175.8	-71.5	176.5	0	0	0	112.4	H563 I564 K570 L571	H563-L567 WeakPolarHBondContact O-CG 3.26Å; H563-L567 PolarHBondContact O-N 2.93Å; I564-L567 PolarHBondContact O-N 3.42Å; L567-K570 PolarHBondContact O-N 3.49Å; L567-L571 WeakPolarHBondContact O-CB 3.45Å; L567-L571 VanDerWaalsContact O-CG 3.31Å; L567-L571 WeakPolarHBondContact O-CG 3.37Å; L567-L571 PolarHBondContact O-N 3.42Å
568	S	93.1	Very high	92.3	Very high	66 Å²	66	105.7 Å²	105.7	46%	0.462	50%	0.498	S	S	.	.	H	α-helix	trans	-64.2	-46.3	173.9	-64.4	0	0	0	0	112.3	I564 L565 K570 L571 E572	I564-S568 PolarHBondContact O-N 2.69Å; I564-S568 PolarHBondContact O-OG 3Å; L565-S568 PolarHBondContact O-N 2.92Å; S568-K570 PolarHBondContact O-N 3.03Å; S568-L571 PolarHBondContact O-N 2.92Å; S568-L571 VanDerWaalsContact O-N 3.15Å; S568-E572 PolarHBondContact O-N 3.38Å
569	D	94.4	Very high	92.4	Very high	99 Å²	99	104.1 Å²	104.1	53%	0.529	50%	0.497	S	S	.	.	H	α-helix	trans	-61.8	-41.1	175	-178.8	85.4	0	0	0	111.9	L565 L571 E572 T573	L565-D569 PolarHBondContact O-N 3.45Å; D569-L571 VanDerWaalsContact C-N 3.33Å; D569-L571 PolarHBondContact O-N 3.16Å; D569-E572 PolarHBondContact O-N 3.3Å; D569-T573 WeakPolarHBondContact O-CG2 3.33Å; D569-T573 PolarHBondContact O-N 3.04Å; D569-T573 PolarHBondContact O-OG1 3.28Å
570	K	93.4	Very high	92.5	Very high	66 Å²	66	101.1 Å²	101.1	29%	0.287	49%	0.49	S	S	.	.	H	α-helix	trans	-64.6	-33.7	173.3	-166	174.2	-178.4	-178.9	0	112.5	S405 F566 L567 S568 T573 M574	S405-K570 PolarHBondContact O-NZ 3Å; F566-K570 WeakPolarHBondContact O-CB 3.41Å; F566-K570 PolarHBondContact O-N 2.91Å; L567-K570 PolarHBondContact O-N 3.49Å; S568-K570 PolarHBondContact O-N 3.03Å; K570-T573 WeakPolarHBondContact CA-OG1 3.39Å; K570-T573 PolarHBondContact O-OG1 3.24Å; K570-T573 VanDerWaalsContact O-OG1 3.08Å; K570-M574 WeakPolarHBondContact O-CG 3.39Å; K570-M574 PolarHBondContact O-N 3.27Å
571	L	93.1	Very high	92.5	Very high	123 Å²	123	100.9 Å²	100.9	64%	0.644	49%	0.488	S	S	*	.	H	α-helix	trans	-71.7	-45.6	175.1	-76.2	168.8	0	0	0	112.1	L567 S568 D569 T573 M574 E575	L567-L571 WeakPolarHBondContact O-CB 3.45Å; L567-L571 VanDerWaalsContact O-CG 3.31Å; L567-L571 WeakPolarHBondContact O-CG 3.37Å; L567-L571 PolarHBondContact O-N 3.42Å; S568-L571 PolarHBondContact O-N 2.92Å; S568-L571 VanDerWaalsContact O-N 3.15Å; D569-L571 VanDerWaalsContact C-N 3.33Å; D569-L571 PolarHBondContact O-N 3.16Å; L571-T573 VanDerWaalsContact C-N 3.31Å; L571-T573 PolarHBondContact O-N 3.41Å; L571-M574 PolarHBondContact O-N 2.69Å; L571-M574 VanDerWaalsContact O-N 3.16Å; L571-E575 PolarHBondContact O-N 2.79Å
572	E	92.7	Very high	92.6	Very high	142 Å²	142	102.6 Å²	102.6	66%	0.664	49%	0.49	S	S	*	.	H	α-helix	trans	-61.2	-39.4	178.5	-172.3	174.8	167.2	0	0	111.6	S568 D569 K576	S568-E572 PolarHBondContact O-N 3.38Å; D569-E572 PolarHBondContact O-N 3.3Å; E572-K576 WeakPolarHBondContact O-CB 3.28Å; E572-K576 PolarHBondContact O-N 2.84Å
573	T	92.9	Very high	92.8	Very high	61 Å²	61	102.3 Å²	102.3	37%	0.374	49%	0.491	S	S	.	.	H	α-helix	trans	-68.8	-34.2	174.9	50.2	0	0	0	0	113.6	D569 K570 L571 Q577	D569-T573 WeakPolarHBondContact O-CG2 3.33Å; D569-T573 PolarHBondContact O-N 3.04Å; D569-T573 PolarHBondContact O-OG1 3.28Å; K570-T573 WeakPolarHBondContact CA-OG1 3.39Å; K570-T573 PolarHBondContact O-OG1 3.24Å; K570-T573 VanDerWaalsContact O-OG1 3.08Å; L571-T573 VanDerWaalsContact C-N 3.31Å; L571-T573 PolarHBondContact O-N 3.41Å; T573-Q577 WeakPolarHBondContact O-CG 3.47Å; T573-Q577 PolarHBondContact O-N 3.45Å; T573-Q577 VanDerWaalsContact O-N 3.15Å
574	M	88.4	Confident	93	Very high	67 Å²	67	104.5 Å²	104.5	33%	0.33	50%	0.502	S	S	.	.	H	α-helix	trans	-70.9	-41.6	173.2	-69.1	-71.8	98	0	0	112.4	K570 L571 K576 Q577 Y578	K570-M574 WeakPolarHBondContact O-CG 3.39Å; K570-M574 PolarHBondContact O-N 3.27Å; L571-M574 PolarHBondContact O-N 2.69Å; L571-M574 VanDerWaalsContact O-N 3.16Å; M574-K576 PolarHBondContact O-N 3Å; M574-Q577 PolarHBondContact O-N 3.04Å; M574-Y578 PolarHBondContact O-N 3.21Å
575	E	93.8	Very high	92.9	Very high	137 Å²	137	107.1 Å²	107.1	64%	0.64	51%	0.506	S	S	*	.	H	α-helix	trans	-61	-44.6	176	-176.6	167.1	-149.7	0	0	110.9	L571 Q577 Y578 E579	L571-E575 PolarHBondContact O-N 2.79Å; E575-Q577 PolarHBondContact O-N 3.45Å; E575-Y578 WeakPolarHBondContact O-CB 3.38Å; E575-Y578 PolarHBondContact O-N 3.02Å; E575-E579 PolarHBondContact O-N 3.32Å
576	K	94.8	Very high	93	Very high	127 Å²	127	105.1 Å²	105.1	55%	0.552	50%	0.495	S	S	*	.	H	α-helix	trans	-60.7	-43.8	174.9	-172.4	174.5	-177.5	-81.4	0	112.9	E572 M574 Y578 E579 E580	E572-K576 WeakPolarHBondContact O-CB 3.28Å; E572-K576 PolarHBondContact O-N 2.84Å; M574-K576 PolarHBondContact O-N 3Å; K576-Y578 VanDerWaalsContact C-N 3.32Å; K576-Y578 PolarHBondContact O-N 3.3Å; K576-E579 PolarHBondContact O-N 2.92Å; K576-E580 IonicContact NZ-OE1 3.69Å; K576-E580 PolarHBondContact NZ-OE1 3.47Å; K576-E580 WeakPolarHBondContact O-CG 3.35Å; K576-E580 PolarHBondContact O-N 3.41Å
577	Q	92	Very high	93	Very high	106 Å²	106	104 Å²	104	50%	0.495	50%	0.497	S	S	.	.	H	α-helix	trans	-63.3	-39.1	176.6	-75.5	176.3	14	0	0	111.8	T573 M574 E575 E580 E581	T573-Q577 WeakPolarHBondContact O-CG 3.47Å; T573-Q577 PolarHBondContact O-N 3.45Å; T573-Q577 VanDerWaalsContact O-N 3.15Å; M574-Q577 PolarHBondContact O-N 3.04Å; E575-Q577 PolarHBondContact O-N 3.45Å; Q577-E580 PolarHBondContact O-N 2.94Å; Q577-E581 PolarHBondContact O-N 3.48Å
578	Y	91.4	Very high	93.1	Very high	146 Å²	146	105.8 Å²	105.8	57%	0.573	50%	0.504	S	S	*	.	H	α-helix	trans	-64.5	-39.5	174.8	177.8	-98.8	0	0	0	112.5	M574 E575 K576 R582	M574-Y578 PolarHBondContact O-N 3.21Å; E575-Y578 WeakPolarHBondContact O-CB 3.38Å; E575-Y578 PolarHBondContact O-N 3.02Å; K576-Y578 VanDerWaalsContact C-N 3.32Å; K576-Y578 PolarHBondContact O-N 3.3Å; Y578-R582 VanDerWaalsContact O-CB 3.32Å; Y578-R582 WeakPolarHBondContact O-CB 3.38Å; Y578-R582 PolarHBondContact O-N 3.08Å
579	E	93.2	Very high	93.2	Very high	101 Å²	101	107.6 Å²	107.6	47%	0.472	51%	0.505	S	S	.	.	H	α-helix	trans	-65.6	-41.1	173.6	-70.1	-131.5	109	0	0	112.8	E575 K576 R582 L583	E575-E579 PolarHBondContact O-N 3.32Å; K576-E579 PolarHBondContact O-N 2.92Å; E579-R582 PolarHBondContact O-N 2.88Å; E579-R582 IonicContact OE1-CZ 3.36Å; E579-R582 IonicContact OE1-NH1 3.16Å; E579-R582 PolarHBondContact OE1-NH1 3.39Å; E579-R582 IonicContact OE1-NH2 2.69Å; E579-R582 PolarHBondContact OE1-NH2 2.66Å; E579-L583 PolarHBondContact O-N 3.1Å
580	E	94.8	Very high	93.2	Very high	107 Å²	107	108.6 Å²	108.6	50%	0.5	51%	0.506	S	S	.	.	H	α-helix	trans	-63.2	-45.1	175.9	-73.9	177.5	179.9	0	0	111.7	K576 Q577 R582 L583 Q584	K576-E580 IonicContact NZ-OE1 3.69Å; K576-E580 PolarHBondContact NZ-OE1 3.47Å; K576-E580 WeakPolarHBondContact O-CG 3.35Å; K576-E580 PolarHBondContact O-N 3.41Å; Q577-E580 PolarHBondContact O-N 2.94Å; E580-R582 PolarHBondContact O-N 3.16Å; E580-L583 PolarHBondContact O-N 3.22Å; E580-Q584 WeakPolarHBondContact O-CB 3.49Å; E580-Q584 PolarHBondContact O-N 2.98Å
581	E	92.9	Very high	93.1	Very high	83 Å²	83	107.8 Å²	107.8	39%	0.388	51%	0.512	S	S	.	.	H	α-helix	trans	-60.2	-42.5	171.3	-82	-166.1	-161.9	0	0	112.5	K398 Q577 L583 Q584 R585	K398-E581 VanDerWaalsContact CE-OE2 3.31Å; K398-E581 WeakPolarHBondContact CE-OE2 3.18Å; K398-E581 IonicContact NZ-OE2 3.09Å; K398-E581 PolarHBondContact NZ-OE2 2.79Å; Q577-E581 PolarHBondContact O-N 3.48Å; E581-L583 VanDerWaalsContact C-N 3.31Å; E581-L583 PolarHBondContact O-N 2.63Å; E581-Q584 PolarHBondContact O-N 2.93Å; E581-R585 WeakPolarHBondContact O-CB 3.14Å; E581-R585 WeakPolarHBondContact O-CG 3.27Å; E581-R585 PolarHBondContact O-N 3.21Å
582	R	95.2	Very high	93.2	Very high	135 Å²	135	106.6 Å²	106.6	51%	0.509	51%	0.51	S	S	.	.	H	α-helix	trans	-62.5	-40.7	-180	-164.8	-175.1	84.8	-131.3	-1.4	110.9	Y578 E579 E580 L586	Y578-R582 VanDerWaalsContact O-CB 3.32Å; Y578-R582 WeakPolarHBondContact O-CB 3.38Å; Y578-R582 PolarHBondContact O-N 3.08Å; E579-R582 PolarHBondContact O-N 2.88Å; E579-R582 IonicContact OE1-CZ 3.36Å; E579-R582 IonicContact OE1-NH1 3.16Å; E579-R582 PolarHBondContact OE1-NH1 3.39Å; E579-R582 IonicContact OE1-NH2 2.69Å; E579-R582 PolarHBondContact OE1-NH2 2.66Å; E580-R582 PolarHBondContact O-N 3.16Å; R582-L586 PolarHBondContact O-N 3.04Å; R582-L586 VanDerWaalsContact O-N 3.16Å
583	L	94.9	Very high	93.2	Very high	112 Å²	112	104.4 Å²	104.4	59%	0.586	50%	0.498	S	S	*	.	H	α-helix	trans	-68.1	-42.8	175.5	-173.7	63	0	0	0	111.6	E579 E580 E581 R585 L586 V587	E579-L583 PolarHBondContact O-N 3.1Å; E580-L583 PolarHBondContact O-N 3.22Å; E581-L583 VanDerWaalsContact C-N 3.31Å; E581-L583 PolarHBondContact O-N 2.63Å; L583-R585 VanDerWaalsContact C-N 3.34Å; L583-R585 PolarHBondContact O-N 3.06Å; L583-L586 PolarHBondContact O-N 3.5Å; L583-V587 WeakPolarHBondContact O-CG2 3.31Å; L583-V587 PolarHBondContact O-N 3Å
584	Q	92.9	Very high	93.3	Very high	120 Å²	120	107.3 Å²	107.3	56%	0.561	51%	0.506	S	S	*	.	H	α-helix	trans	-60	-43.1	176.6	-169.7	-178.4	25.9	0	0	111.9	E580 E581 V587 Q588	E580-Q584 WeakPolarHBondContact O-CB 3.49Å; E580-Q584 PolarHBondContact O-N 2.98Å; E581-Q584 PolarHBondContact O-N 2.93Å; Q584-V587 PolarHBondContact O-N 3Å; Q584-Q588 WeakPolarHBondContact O-CG 3.49Å; Q584-Q588 PolarHBondContact O-N 3.39Å
585	R	91.8	Very high	93.6	Very high	146 Å²	146	109.2 Å²	109.2	55%	0.551	52%	0.517	S	S	*	.	H	α-helix	trans	-61.3	-41.8	175	-76	177	169.5	-140.4	-10.8	112.4	E581 L583 Q588 E589	E581-R585 WeakPolarHBondContact O-CB 3.14Å; E581-R585 WeakPolarHBondContact O-CG 3.27Å; E581-R585 PolarHBondContact O-N 3.21Å; L583-R585 VanDerWaalsContact C-N 3.34Å; L583-R585 PolarHBondContact O-N 3.06Å; R585-Q588 PolarHBondContact O-N 3.4Å; R585-E589 WeakPolarHBondContact O-CB 3.41Å; R585-E589 PolarHBondContact O-N 3.2Å
586	L	94.1	Very high	93.6	Very high	83 Å²	83	110.6 Å²	110.6	44%	0.435	52%	0.516	S	S	.	.	H	α-helix	trans	-63.7	-44.3	177.8	-167.2	156.7	0	0	0	111.2	R582 L583 Q588 E589 E590	R582-L586 PolarHBondContact O-N 3.04Å; R582-L586 VanDerWaalsContact O-N 3.16Å; L583-L586 PolarHBondContact O-N 3.5Å; L586-Q588 VanDerWaalsContact C-N 3.34Å; L586-Q588 PolarHBondContact O-N 2.75Å; L586-E589 PolarHBondContact O-N 3.21Å; L586-E590 HydrophobicContact CD2-CG 4.17Å; L586-E590 PolarHBondContact O-N 2.9Å
587	V	95.1	Very high	93.6	Very high	88 Å²	88	111.2 Å²	111.2	53%	0.533	52%	0.519	S	S	.	.	H	α-helix	trans	-62.6	-39.5	175.2	173.5	0	0	0	0	111.7	L583 Q584 E590 A591	L583-V587 WeakPolarHBondContact O-CG2 3.31Å; L583-V587 PolarHBondContact O-N 3Å; Q584-V587 PolarHBondContact O-N 3Å; V587-E590 PolarHBondContact O-N 3.03Å; V587-A591 WeakPolarHBondContact O-CB 3.36Å; V587-A591 PolarHBondContact O-N 3.43Å
588	Q	90.7	Very high	93.7	Very high	106 Å²	106	111 Å²	111	50%	0.495	52%	0.518	S	S	.	.	H	α-helix	trans	-63.8	-42.7	173.7	-73.5	169.7	-12.1	0	0	111.9	Q584 R585 L586 A591 V592	Q584-Q588 WeakPolarHBondContact O-CG 3.49Å; Q584-Q588 PolarHBondContact O-N 3.39Å; R585-Q588 PolarHBondContact O-N 3.4Å; L586-Q588 VanDerWaalsContact C-N 3.34Å; L586-Q588 PolarHBondContact O-N 2.75Å; Q588-A591 PolarHBondContact O-N 3Å; Q588-V592 WeakPolarHBondContact O-CG2 3.31Å; Q588-V592 PolarHBondContact O-N 3.08Å
589	E	94.9	Very high	93.9	Very high	105 Å²	105	108.1 Å²	108.1	49%	0.491	51%	0.512	S	S	.	.	H	α-helix	trans	-64	-41.3	177.8	-157.4	-159.1	160.6	0	0	111.6	R585 L586 V592 K593	R585-E589 WeakPolarHBondContact O-CB 3.41Å; R585-E589 PolarHBondContact O-N 3.2Å; L586-E589 PolarHBondContact O-N 3.21Å; E589-V592 PolarHBondContact O-N 3.15Å; E589-K593 WeakPolarHBondContact O-CB 3.03Å; E589-K593 WeakPolarHBondContact O-CD 3.32Å; E589-K593 VanDerWaalsContact O-CG 3.23Å; E589-K593 WeakPolarHBondContact O-CG 3.48Å; E589-K593 PolarHBondContact O-N 3.23Å; E589-K593 WeakPolarHBondContact OE1-CE 3.45Å; E589-K593 IonicContact OE1-NZ 2.62Å; E589-K593 PolarHBondContact OE1-NZ 3.13Å; E589-K593 IonicContact OE2-NZ 2.63Å; E589-K593 PolarHBondContact OE2-NZ 3.49Å
590	E	94.6	Very high	93.9	Very high	119 Å²	119	108.1 Å²	108.1	56%	0.556	51%	0.512	S	S	*	.	H	α-helix	trans	-66.5	-39	174.2	-71.1	-165	154.7	0	0	112.6	L586 V587 K593 F594	L586-E590 HydrophobicContact CD2-CG 4.17Å; L586-E590 PolarHBondContact O-N 2.9Å; V587-E590 PolarHBondContact O-N 3.03Å; E590-K593 PolarHBondContact O-N 2.97Å; E590-F594 WeakPolarHBondContact O-CB 3.39Å; E590-F594 PolarHBondContact O-N 3.47Å
591	A	92.1	Very high	94	Very high	49 Å²	49	106.5 Å²	106.5	41%	0.405	51%	0.512	S	S	.	.	H	α-helix	trans	-63.3	-42	174.1	0	0	0	0	0	112.1	V587 Q588 F594 L595	V587-A591 WeakPolarHBondContact O-CB 3.36Å; V587-A591 PolarHBondContact O-N 3.43Å; Q588-A591 PolarHBondContact O-N 3Å; A591-F594 WeakPolarHBondContact O-CB 3.5Å; A591-F594 PolarHBondContact O-N 3.31Å; A591-L595 WeakPolarHBondContact O-CG 3.43Å; A591-L595 PolarHBondContact O-N 3.43Å
592	V	94	Very high	94	Very high	98 Å²	98	108.6 Å²	108.6	59%	0.594	52%	0.524	S	S	*	.	H	α-helix	trans	-64.2	-43.2	173.9	171.3	0	0	0	0	111.1	Q588 E589 F594 L595 W596	Q588-V592 WeakPolarHBondContact O-CG2 3.31Å; Q588-V592 PolarHBondContact O-N 3.08Å; E589-V592 PolarHBondContact O-N 3.15Å; V592-F594 VanDerWaalsContact C-N 3.26Å; V592-F594 PolarHBondContact O-N 2.96Å; V592-L595 PolarHBondContact O-N 3.03Å; V592-W596 WeakPolarHBondContact O-CB 3.33Å; V592-W596 PolarHBondContact O-N 3.15Å
593	K	92.3	Very high	93.7	Very high	96 Å²	96	108 Å²	108	42%	0.417	53%	0.527	S	S	.	.	H	α-helix	trans	-62.3	-30.8	174.1	-72.9	164.1	-175.9	165.1	0	112.9	E589 E590 K597	E589-K593 WeakPolarHBondContact O-CB 3.03Å; E589-K593 WeakPolarHBondContact O-CD 3.32Å; E589-K593 VanDerWaalsContact O-CG 3.23Å; E589-K593 WeakPolarHBondContact O-CG 3.48Å; E589-K593 PolarHBondContact O-N 3.23Å; E589-K593 WeakPolarHBondContact OE1-CE 3.45Å; E589-K593 IonicContact OE1-NZ 2.62Å; E589-K593 PolarHBondContact OE1-NZ 3.13Å; E589-K593 IonicContact OE2-NZ 2.63Å; E589-K593 PolarHBondContact OE2-NZ 3.49Å; E590-K593 PolarHBondContact O-N 2.97Å; K593-K597 WeakPolarHBondContact O-CD 3.48Å; K593-K597 WeakPolarHBondContact O-CG 3.5Å; K593-K597 PolarHBondContact O-N 3.48Å
594	F	95.7	Very high	93.6	Very high	122 Å²	122	108.7 Å²	108.7	54%	0.535	53%	0.527	S	S	.	.	H	α-helix	trans	-71.5	-53.8	174.1	179.2	-90.4	0	0	0	111.1	E590 A591 V592 W596 K597 E598	E590-F594 WeakPolarHBondContact O-CB 3.39Å; E590-F594 PolarHBondContact O-N 3.47Å; A591-F594 WeakPolarHBondContact O-CB 3.5Å; A591-F594 PolarHBondContact O-N 3.31Å; V592-F594 VanDerWaalsContact C-N 3.26Å; V592-F594 PolarHBondContact O-N 2.96Å; F594-W596 VanDerWaalsContact C-N 3.26Å; F594-W596 PolarHBondContact O-N 3.37Å; F594-K597 WeakPolarHBondContact O-CB 3.45Å; F594-K597 PolarHBondContact O-N 2.94Å; F594-E598 HydrophobicContact CD1-CG 4.34Å; F594-E598 HydrophobicContact CE1-CG 3.81Å; F594-E598 WeakPolarHBondContact CE1-OE1 3.04Å; F594-E598 WeakPolarHBondContact CE1-OE2 3.45Å; F594-E598 HydrophobicContact CZ-CG 4.05Å; F594-E598 PolarHBondContact O-N 3.26Å; F594-E598 VanDerWaalsContact O-N 3.08Å
595	L	94.4	Very high	93.7	Very high	107 Å²	107	111.5 Å²	111.5	56%	0.56	53%	0.532	S	S	*	.	H	α-helix	trans	-57.9	-37.6	178.6	-70.4	171	0	0	0	112.3	A591 V592 K597 E598 L599	A591-L595 WeakPolarHBondContact O-CG 3.43Å; A591-L595 PolarHBondContact O-N 3.43Å; V592-L595 PolarHBondContact O-N 3.03Å; L595-K597 VanDerWaalsContact C-N 3.34Å; L595-K597 PolarHBondContact O-N 3.5Å; L595-E598 PolarHBondContact O-N 2.97Å; L595-L599 WeakPolarHBondContact O-CB 3.47Å; L595-L599 PolarHBondContact O-N 3.29Å
596	W	93.4	Very high	93.7	Very high	167 Å²	167	109.4 Å²	109.4	63%	0.633	53%	0.528	S	S	*	.	H	α-helix	trans	-63.3	-37.2	175.1	-173.3	-101.8	0	0	0	112.9	V592 F594 L599 Q600	V592-W596 WeakPolarHBondContact O-CB 3.33Å; V592-W596 PolarHBondContact O-N 3.15Å; F594-W596 VanDerWaalsContact C-N 3.26Å; F594-W596 PolarHBondContact O-N 3.37Å; W596-L599 HydrophobicContact CE3-CD2 4.16Å; W596-L599 HydrophobicContact CZ3-CD2 4.14Å; W596-Q600 VanDerWaalsContact O-CB 3.29Å; W596-Q600 WeakPolarHBondContact O-CB 3.32Å; W596-Q600 PolarHBondContact O-N 2.74Å
597	K	95.3	Very high	93.6	Very high	139 Å²	139	110.2 Å²	110.2	60%	0.604	53%	0.529	S	S	*	.	H	α-helix	trans	-69.2	-39.2	175.2	-71.2	167.6	-176.6	173.7	0	111.9	K593 F594 L595 Q600 S601	K593-K597 WeakPolarHBondContact O-CD 3.48Å; K593-K597 WeakPolarHBondContact O-CG 3.5Å; K593-K597 PolarHBondContact O-N 3.48Å; F594-K597 WeakPolarHBondContact O-CB 3.45Å; F594-K597 PolarHBondContact O-N 2.94Å; L595-K597 VanDerWaalsContact C-N 3.34Å; L595-K597 PolarHBondContact O-N 3.5Å; K597-Q600 PolarHBondContact O-N 3.37Å; K597-S601 WeakPolarHBondContact O-CB 3.38Å; K597-S601 PolarHBondContact O-N 2.92Å
598	E	94.9	Very high	93.4	Very high	101 Å²	101	108.3 Å²	108.3	47%	0.472	52%	0.52	S	S	.	.	H	α-helix	trans	-64.2	-45.7	173.8	-68.2	-162.1	133.8	0	0	111.5	F594 L595 Q600 S601 M602	F594-E598 HydrophobicContact CD1-CG 4.34Å; F594-E598 HydrophobicContact CE1-CG 3.81Å; F594-E598 WeakPolarHBondContact CE1-OE1 3.04Å; F594-E598 WeakPolarHBondContact CE1-OE2 3.45Å; F594-E598 HydrophobicContact CZ-CG 4.05Å; F594-E598 PolarHBondContact O-N 3.26Å; F594-E598 VanDerWaalsContact O-N 3.08Å; L595-E598 PolarHBondContact O-N 2.97Å; E598-Q600 VanDerWaalsContact C-N 3.35Å; E598-Q600 PolarHBondContact O-N 2.91Å; E598-S601 WeakPolarHBondContact O-CB 3.46Å; E598-S601 PolarHBondContact O-N 2.63Å; E598-M602 PolarHBondContact O-N 2.98Å
599	L	95.2	Very high	93.4	Very high	87 Å²	87	105.7 Å²	105.7	46%	0.455	51%	0.511	S	S	.	.	H	α-helix	trans	-58.7	-45.8	175	-175.3	68.1	0	0	0	111.4	L595 W596 S601 M602 Q603	L595-L599 WeakPolarHBondContact O-CB 3.47Å; L595-L599 PolarHBondContact O-N 3.29Å; W596-L599 HydrophobicContact CE3-CD2 4.16Å; W596-L599 HydrophobicContact CZ3-CD2 4.14Å; L599-S601 VanDerWaalsContact C-N 3.33Å; L599-S601 PolarHBondContact O-N 2.96Å; L599-M602 PolarHBondContact O-N 2.94Å; L599-Q603 WeakPolarHBondContact O-CB 3.37Å; L599-Q603 PolarHBondContact O-N 3.49Å
600	Q	93.8	Very high	93.1	Very high	100 Å²	100	104.5 Å²	104.5	47%	0.467	51%	0.505	S	S	.	.	H	α-helix	trans	-63.3	-38.2	177	-168.7	178.8	32.3	0	0	112	W596 K597 E598 Q603 Q604	W596-Q600 VanDerWaalsContact O-CB 3.29Å; W596-Q600 WeakPolarHBondContact O-CB 3.32Å; W596-Q600 PolarHBondContact O-N 2.74Å; K597-Q600 PolarHBondContact O-N 3.37Å; E598-Q600 VanDerWaalsContact C-N 3.35Å; E598-Q600 PolarHBondContact O-N 2.91Å; Q600-Q603 PolarHBondContact O-N 3.27Å; Q600-Q604 WeakPolarHBondContact O-CB 3.23Å; Q600-Q604 VanDerWaalsContact O-CG 3.29Å; Q600-Q604 WeakPolarHBondContact O-CG 3.45Å; Q600-Q604 PolarHBondContact O-N 3.36Å
601	S	94.9	Very high	92.7	Very high	73 Å²	73	103.3 Å²	103.3	51%	0.51	50%	0.503	S	S	.	.	H	α-helix	trans	-63.9	-45.5	174.2	-173.4	0	0	0	0	111.7	K597 E598 L599 Q603 Q604 W605	K597-S601 WeakPolarHBondContact O-CB 3.38Å; K597-S601 PolarHBondContact O-N 2.92Å; E598-S601 WeakPolarHBondContact O-CB 3.46Å; E598-S601 PolarHBondContact O-N 2.63Å; L599-S601 VanDerWaalsContact C-N 3.33Å; L599-S601 PolarHBondContact O-N 2.96Å; S601-Q603 PolarHBondContact O-N 3.44Å; S601-Q604 PolarHBondContact O-N 3.44Å; S601-W605 WeakPolarHBondContact O-CB 3.48Å; S601-W605 PolarHBondContact O-N 2.62Å
602	M	92.8	Very high	92.2	Very high	127 Å²	127	107.3 Å²	107.3	63%	0.626	51%	0.511	S	S	*	.	H	α-helix	trans	-64	-38.2	174.5	-69.9	-150.7	-64.6	0	0	112.5	E598 L599 W605 K606	E598-M602 PolarHBondContact O-N 2.98Å; L599-M602 PolarHBondContact O-N 2.94Å; M602-W605 PolarHBondContact O-N 3.37Å; M602-K606 WeakPolarHBondContact O-CB 3.29Å; M602-K606 PolarHBondContact O-N 2.94Å
603	Q	90.7	Very high	91.5	Very high	123 Å²	123	108 Å²	108	58%	0.575	51%	0.51	S	S	*	.	H	α-helix	trans	-62.7	-44.5	175.1	-164.5	79.5	-10.3	0	0	111.3	L599 Q600 S601 K606 Q607	L599-Q603 WeakPolarHBondContact O-CB 3.37Å; L599-Q603 PolarHBondContact O-N 3.49Å; Q600-Q603 PolarHBondContact O-N 3.27Å; S601-Q603 PolarHBondContact O-N 3.44Å; Q603-K606 PolarHBondContact O-N 3.21Å; Q603-Q607 PolarHBondContact O-N 3.16Å
604	Q	92.7	Very high	90.6	Very high	126 Å²	126	106.1 Å²	106.1	59%	0.589	51%	0.513	S	S	*	.	H	α-helix	trans	-65.1	-40.5	175.2	-72.6	173.6	11.8	0	0	112.2	Q600 S601 Q607 S608	Q600-Q604 WeakPolarHBondContact O-CB 3.23Å; Q600-Q604 VanDerWaalsContact O-CG 3.29Å; Q600-Q604 WeakPolarHBondContact O-CG 3.45Å; Q600-Q604 PolarHBondContact O-N 3.36Å; S601-Q604 PolarHBondContact O-N 3.44Å; Q604-Q607 PolarHBondContact O-N 2.97Å; Q604-S608 WeakPolarHBondContact O-CB 3.39Å; Q604-S608 PolarHBondContact O-N 3.38Å
605	W	93.6	Very high	89.4	Confident	179 Å²	179	103.6 Å²	103.6	68%	0.678	52%	0.515	S	S	*	.	H	α-helix	trans	-63.2	-47.2	175.1	180	88.9	0	0	0	111.5	S601 M602 Q607 S608 V609	S601-W605 WeakPolarHBondContact O-CB 3.48Å; S601-W605 PolarHBondContact O-N 2.62Å; M602-W605 PolarHBondContact O-N 3.37Å; W605-Q607 PolarHBondContact O-N 2.94Å; W605-S608 WeakPolarHBondContact O-CA 3.47Å; W605-S608 WeakPolarHBondContact O-CB 3.32Å; W605-S608 PolarHBondContact O-N 3.49Å; W605-S608 VanDerWaalsContact O-N 3.08Å; W605-V609 HydrophobicContact CD2-CG2 4.05Å; W605-V609 HydrophobicContact CE3-CG2 4.25Å; W605-V609 HydrophobicContact CH2-CG2 4.02Å; W605-V609 HydrophobicContact CZ2-CG2 3.8Å; W605-V609 HydrophobicContact CZ3-CG2 4.23Å; W605-V609 WeakPolarHBondContact O-CG2 3.5Å; W605-V609 PolarHBondContact O-N 3.35Å
606	K	92.8	Very high	88.1	Confident	103 Å²	103	104.5 Å²	104.5	45%	0.448	53%	0.525	S	S	.	.	H	α-helix	trans	-55	-50.2	174.5	177.2	-177.3	168.4	-176.9	0	110.8	M602 Q603 S608 V609 E610	M602-K606 WeakPolarHBondContact O-CB 3.29Å; M602-K606 PolarHBondContact O-N 2.94Å; Q603-K606 PolarHBondContact O-N 3.21Å; K606-S608 VanDerWaalsContact C-N 3.28Å; K606-S608 PolarHBondContact O-N 3.22Å; K606-V609 PolarHBondContact O-N 3.03Å; K606-V609 VanDerWaalsContact O-N 3.08Å; K606-E610 WeakPolarHBondContact CE-OE1 3.47Å; K606-E610 HydrophobicContact CG-CG 4.47Å; K606-E610 IonicContact NZ-OE1 3.83Å; K606-E610 PolarHBondContact O-N 3.31Å
607	Q	90.9	Very high	86.3	Confident	99 Å²	99	100.2 Å²	100.2	46%	0.463	53%	0.525	S	S	.	.	H	α-helix	trans	-61.3	-36.4	177.6	-165.2	66.8	69.7	0	0	112	Q603 Q604 W605 N611	Q603-Q607 PolarHBondContact O-N 3.16Å; Q604-Q607 PolarHBondContact O-N 2.97Å; W605-Q607 PolarHBondContact O-N 2.94Å; Q607-N611 PolarHBondContact NE2-OD1 2.94Å; Q607-N611 VanDerWaalsContact O-CB 3.24Å; Q607-N611 WeakPolarHBondContact O-CB 3.4Å; Q607-N611 PolarHBondContact O-N 3.3Å; Q607-N611 PolarHBondContact O-ND2 3.45Å; Q607-N611 PolarHBondContact O-OD1 2.89Å
608	S	92.4	Very high	84.4	Confident	49 Å²	49	100.8 Å²	100.8	34%	0.343	53%	0.53	S	S	.	.	H	α-helix	trans	-64.6	-38.1	174.2	-165.7	0	0	0	0	112.5	Q604 W605 K606 K612	Q604-S608 WeakPolarHBondContact O-CB 3.39Å; Q604-S608 PolarHBondContact O-N 3.38Å; W605-S608 WeakPolarHBondContact O-CA 3.47Å; W605-S608 WeakPolarHBondContact O-CB 3.32Å; W605-S608 PolarHBondContact O-N 3.49Å; W605-S608 VanDerWaalsContact O-N 3.08Å; K606-S608 VanDerWaalsContact C-N 3.28Å; K606-S608 PolarHBondContact O-N 3.22Å; S608-K612 WeakPolarHBondContact O-CB 3.41Å; S608-K612 WeakPolarHBondContact O-CD 3.42Å; S608-K612 VanDerWaalsContact O-CG 3.23Å; S608-K612 WeakPolarHBondContact O-CG 3.35Å; S608-K612 PolarHBondContact O-N 2.94Å; S608-K612 VanDerWaalsContact O-N 3.14Å; S608-K612 PolarHBondContact OG-NZ 3.31Å
609	V	89.9	Confident	82.1	Confident	50 Å²	50	101.3 Å²	101.3	30%	0.303	54%	0.542	S	S	.	.	H	α-helix	trans	-70.1	-47.1	176.3	172.6	0	0	0	0	110.9	W605 K606 N611 K612 L613	W605-V609 HydrophobicContact CD2-CG2 4.05Å; W605-V609 HydrophobicContact CE3-CG2 4.25Å; W605-V609 HydrophobicContact CH2-CG2 4.02Å; W605-V609 HydrophobicContact CZ2-CG2 3.8Å; W605-V609 HydrophobicContact CZ3-CG2 4.23Å; W605-V609 WeakPolarHBondContact O-CG2 3.5Å; W605-V609 PolarHBondContact O-N 3.35Å; K606-V609 PolarHBondContact O-N 3.03Å; K606-V609 VanDerWaalsContact O-N 3.08Å; V609-N611 PolarHBondContact O-N 2.9Å; V609-K612 PolarHBondContact O-N 2.96Å; V609-K612 VanDerWaalsContact O-N 3.17Å; V609-L613 HydrophobicContact CG1-CD1 3.91Å; V609-L613 HydrophobicContact CG1-CG 4.46Å; V609-L613 WeakPolarHBondContact O-CG 3.29Å; V609-L613 PolarHBondContact O-N 3.24Å
610	E	88.5	Confident	79.8	Confident	81 Å²	81	101.8 Å²	101.8	38%	0.379	56%	0.558	S	S	.	*	H	α-helix	trans	-60.3	-43.9	176.4	-72.4	177.1	169.9	0	0	111.6	K606 K612 L613 A614	K606-E610 WeakPolarHBondContact CE-OE1 3.47Å; K606-E610 HydrophobicContact CG-CG 4.47Å; K606-E610 IonicContact NZ-OE1 3.83Å; K606-E610 PolarHBondContact O-N 3.31Å; E610-K612 VanDerWaalsContact C-N 3.31Å; E610-K612 PolarHBondContact O-N 2.92Å; E610-L613 PolarHBondContact O-N 3.38Å; E610-A614 WeakPolarHBondContact O-CB 3.39Å; E610-A614 PolarHBondContact O-N 3.45Å
611	N	86.1	Confident	77.6	Confident	94 Å²	94	102.8 Å²	102.8	50%	0.503	57%	0.573	S	S	.	*	H	α-helix	trans	-63.2	-35.3	176.1	-68.3	0.7	0	0	0	112.3	Q607 V609 A615	Q607-N611 PolarHBondContact NE2-OD1 2.94Å; Q607-N611 VanDerWaalsContact O-CB 3.24Å; Q607-N611 WeakPolarHBondContact O-CB 3.4Å; Q607-N611 PolarHBondContact O-N 3.3Å; Q607-N611 PolarHBondContact O-ND2 3.45Å; Q607-N611 PolarHBondContact O-OD1 2.89Å; V609-N611 PolarHBondContact O-N 2.9Å; N611-A615 WeakPolarHBondContact O-CB 3.41Å; N611-A615 PolarHBondContact O-N 3.01Å
612	K	82.6	Confident	75.1	Confident	132 Å²	132	105.1 Å²	105.1	57%	0.574	59%	0.587	S	S	*	*	H	α-helix	trans	-71.4	-40.1	175	-75.9	165.7	-176	162.4	0	112.1	S608 V609 E610 A615 V616	S608-K612 WeakPolarHBondContact O-CB 3.41Å; S608-K612 WeakPolarHBondContact O-CD 3.42Å; S608-K612 VanDerWaalsContact O-CG 3.23Å; S608-K612 WeakPolarHBondContact O-CG 3.35Å; S608-K612 PolarHBondContact O-N 2.94Å; S608-K612 VanDerWaalsContact O-N 3.14Å; S608-K612 PolarHBondContact OG-NZ 3.31Å; V609-K612 PolarHBondContact O-N 2.96Å; V609-K612 VanDerWaalsContact O-N 3.17Å; E610-K612 VanDerWaalsContact C-N 3.31Å; E610-K612 PolarHBondContact O-N 2.92Å; K612-A615 PolarHBondContact O-N 2.91Å; K612-V616 WeakPolarHBondContact O-CG2 3.35Å; K612-V616 PolarHBondContact O-N 3.32Å
613	L	78.9	Confident	72.9	Confident	112 Å²	112	103.4 Å²	103.4	59%	0.586	59%	0.593	S	S	*	*	H	α-helix	trans	-63.5	-43.2	174.1	-71.5	166.5	0	0	0	111.1	V609 E610 A615 V616 A617	V609-L613 HydrophobicContact CG1-CD1 3.91Å; V609-L613 HydrophobicContact CG1-CG 4.46Å; V609-L613 WeakPolarHBondContact O-CG 3.29Å; V609-L613 PolarHBondContact O-N 3.24Å; E610-L613 PolarHBondContact O-N 3.38Å; L613-A615 VanDerWaalsContact C-N 3.31Å; L613-A615 PolarHBondContact O-N 2.87Å; L613-V616 PolarHBondContact O-N 2.95Å; L613-A617 PolarHBondContact O-N 3.46Å
614	A	74	Confident	70.8	Confident	57 Å²	57	103.1 Å²	103.1	47%	0.471	60%	0.602	S	S	.	*	H	α-helix	trans	-62.4	-35.9	174.4	0	0	0	0	0	112.7	E610 A617	E610-A614 WeakPolarHBondContact O-CB 3.39Å; E610-A614 PolarHBondContact O-N 3.45Å; A614-A617 PolarHBondContact O-N 3.26Å
615	A	69.3	Low	67.9	Low	70 Å²	70	103 Å²	103	58%	0.579	60%	0.604	S	S	*	*	H	α-helix	trans	-68.9	-33.4	174.2	0	0	0	0	0	113.1	N611 K612 L613 A617	N611-A615 WeakPolarHBondContact O-CB 3.41Å; N611-A615 PolarHBondContact O-N 3.01Å; K612-A615 PolarHBondContact O-N 2.91Å; L613-A615 VanDerWaalsContact C-N 3.31Å; L613-A615 PolarHBondContact O-N 2.87Å; A615-A617 VanDerWaalsContact C-N 3.33Å
616	V	66.8	Low	65	Low	126 Å²	126	104.1 Å²	104.1	76%	0.764	61%	0.61	S	S	*	*	H	α-helix	trans	-73.4	-25.6	173.8	171.6	0	0	0	0	112	K612 L613 Q618	K612-V616 WeakPolarHBondContact O-CG2 3.35Å; K612-V616 PolarHBondContact O-N 3.32Å; L613-V616 PolarHBondContact O-N 2.95Å; V616-Q618 VanDerWaalsContact C-N 3.3Å; V616-Q618 PolarHBondContact O-N 3.46Å
617	A	56.4	Low	62.2	Low	77 Å²	77	104.2 Å²	104.2	64%	0.636	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.4	1.2	179.6	0	0	0	0	0	115.1	L613 A614 A615 P619	L613-A617 PolarHBondContact O-N 3.46Å; A614-A617 PolarHBondContact O-N 3.26Å; A615-A617 VanDerWaalsContact C-N 3.33Å; A617-P619 WeakPolarHBondContact O-CD 3.49Å
618	Q	55.1	Low	59.9	Low	151 Å²	151	105.8 Å²	105.8	71%	0.706	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-82.5	118.6	179.6	-73.2	-69.7	-29.3	0	0	111.9	V616	V616-Q618 VanDerWaalsContact C-N 3.3Å; V616-Q618 PolarHBondContact O-N 3.46Å
619	P	46.2	Very low	56.9	Low	111 Å²	111	107 Å²	107	72%	0.721	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-75.9	133.4	178.4	30.8	-33.9	0	0	0	111.8	A617	A617-P619 WeakPolarHBondContact O-CD 3.49Å
620	A	48.1	Very low	54.1	Low	98 Å²	98	112.7 Å²	112.7	81%	0.81	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-73.1	127.7	-176.5	0	0	0	0	0	113
621	P	47.9	Very low	51.3	Low	120 Å²	120	114 Å²	114	78%	0.779	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-73	158.5	167.1	30.6	-33.3	0	0	0	111.8
622	P	42.1	Very low	48.7	Very low	123 Å²	123	118.4 Å²	118.4	80%	0.799	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-92.1	151.6	-154.7	34.6	-37.5	0	0	0	116.4
623	A	45.8	Very low	46.1	Very low	91 Å²	91	116.8 Å²	116.8	75%	0.752	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-78.3	153	158.3	0	0	0	0	0	111.1
624	P	47.3	Very low	44	Very low	117 Å²	117	117.7 Å²	117.7	76%	0.76	75%	0.745	S	S	*	*				-144.1	-163.2	100.4	29.7	-6.7	0	0	0	111.1
625	I	31.6	Very low	42.6	Very low	123 Å²	123	121 Å²	121	63%	0.631	76%	0.761	S	S	*	*			cis	-151.6	171.6	9.7	-30.9	150.5	0	0	0	108.7
626	Y	32.1	Very low	42.1	Very low	203 Å²	203	123.2 Å²	123.2	80%	0.796	77%	0.77	S	S	*	*			trans	76.7	140.3	162.8	-60.5	-65	0	0	0	118.2
627	S	34.4	Very low	40.3	Very low	105 Å²	105	121.8 Å²	121.8	73%	0.734	77%	0.771	S	S	*	*			cis	-158.8	171.5	-11.2	58.1	0	0	0	0	110.8
628	P	42.9	Very low	39.2	Very low	132 Å²	132	122.7 Å²	122.7	86%	0.857	78%	0.779	S	S	*	*			trans	-102.8	164.3	-155.9	39.1	-36.4	0	0	0	116.9
629	G	28.2	Very low	38.3	Very low	74 Å²	74	120.5 Å²	120.5	76%	0.763	78%	0.78	S	S	*	*			trans	-173.6	146.3	167	0	0	0	0	0	114.3
630	L	32	Very low	37.6	Very low	170 Å²	170	120.6 Å²	120.6	89%	0.89	78%	0.783	S	S	*	*			trans	-83.7	166.5	170.2	-71.9	75.6	0	0	0	109
631	C	29.4	Very low	36.8	Very low	108 Å²	108	120.1 Å²	120.1	73%	0.73	78%	0.779	S	S	*	*				-166.9	153.8	52.9	-73	0	0	0	0	114.5
632	H	31.7	Very low	35.9	Very low	187 Å²	187	120.2 Å²	120.2	87%	0.866	78%	0.778	S	S	*	*			trans	40.2	128	144.7	-75.1	-77.7	0	0	0	123.7
633	A	28.1	Very low	35.2	Very low	98 Å²	98	121.8 Å²	121.8	81%	0.81	78%	0.78	S	S	*	*				149	156.3	115.2	0	0	0	0	0	114.1
634	V	33.8	Very low	35.6	Very low	131 Å²	131	123.1 Å²	123.1	79%	0.794	78%	0.781	S	S	*	*			trans	-142.8	137.6	-170.8	164.3	0	0	0	0	109.4
635	P	45	Very low	35.7	Very low	125 Å²	125	122.9 Å²	122.9	81%	0.812	78%	0.779	S	S	*	*				-143.8	172.8	116.7	27.9	-5.9	0	0	0	114.8
636	P	58.6	Low	35.7	Very low	118 Å²	118	124.8 Å²	124.8	77%	0.766	79%	0.789	S	S	*	*			trans	-134.6	-154.9	-143.1	44.1	-26.4	0	0	0	117.1
637	A	30.8	Very low	35.6	Very low	95 Å²	95	119 Å²	119	79%	0.785	78%	0.784	S	S	*	*			trans	88.5	129.5	179.3	0	0	0	0	0	115.6
638	A	33	Very low	35.2	Very low	96 Å²	96	121.8 Å²	121.8	79%	0.793	79%	0.79	S	S	*	*			cis	89.1	140.5	37.3	0	0	0	0	0	113.4
639	S	34.7	Very low	34.9	Very low	105 Å²	105	121.8 Å²	121.8	73%	0.734	79%	0.787	S	S	*	*			cis	-169.7	153.1	-5.4	44	0	0	0	0	112.8
640	S	31.3	Very low	34.9	Very low	113 Å²	113	123.9 Å²	123.9	79%	0.79	79%	0.79	S	S	*	*			trans	13	141.1	153.5	60.7	0	0	0	0	123.9
641	A	31.2	Very low	35.1	Very low	88 Å²	88	125.2 Å²	125.2	73%	0.727	79%	0.789	S	S	*	*				173.2	141.9	115.5	0	0	0	0	0	117.8
642	T	29.9	Very low	35.5	Very low	123 Å²	123	126 Å²	126	76%	0.755	79%	0.793	S	S	*	*			trans	52.9	117.4	144.3	53	0	0	0	0	126.1
643	N	28.3	Very low	35.3	Very low	156 Å²	156	124.5 Å²	124.5	83%	0.834	79%	0.791	S	S	*	*				23.3	162.7	124.8	-56.1	3.4	0	0	0	122.8
644	P	53.2	Low	35.8	Very low	118 Å²	118	125.2 Å²	125.2	77%	0.766	79%	0.791	S	S	*	*			cis	-121.5	-139.7	-7.8	44.6	-28.2	0	0	0	110.1
645	P	49.1	Very low	35.6	Very low	112 Å²	112	121.8 Å²	121.8	73%	0.727	78%	0.781	S	S	*	*			cis	-98.2	-167.2	-32	30.7	-11.7	0	0	0	112.1
646	I	31.8	Very low	35	Very low	163 Å²	163	124.6 Å²	124.6	84%	0.836	78%	0.781	S	S	*	*			cis	87.7	104.7	17.6	-41.5	174.3	0	0	0	118.2
647	A	30.9	Very low	33.6	Very low	83 Å²	83	126.6 Å²	126.6	69%	0.686	78%	0.78	S	S	*	*				161.9	133.4	124.4	0	0	0	0	0	114.5
648	D	26.2	Very low	33.6	Very low	163 Å²	163	126.9 Å²	126.9	87%	0.872	77%	0.773	S	S	*	*			trans	66.1	149.7	148.5	-57.2	-14.2	0	0	0	124.7
649	V	36.6	Very low	33.6	Very low	132 Å²	132	128.3 Å²	128.3	80%	0.8	77%	0.771	S	S	*	*			trans	-140.8	135.3	-170.5	172.1	0	0	0	0	108.7
650	S	27.8	Very low	33.2	Very low	117 Å²	117	130 Å²	130	82%	0.818	77%	0.772	S	S	*	*			trans	-171.7	154.3	147.2	-85.6	0	0	0	0	112
651	F	34.6	Very low	33.1	Very low	198 Å²	198	131 Å²	131	87%	0.868	76%	0.764	S	S	*	*			trans	-82	152.7	177.1	-72	-103.8	0	0	0	111.9
652	P	39.6	Very low	33.1	Very low	124 Å²	124	133.3 Å²	133.3	81%	0.805	76%	0.76	S	S	*	*			trans	-86.1	150.9	157.7	35.4	-31.4	0	0	0	111.6
653	D	27.5	Very low	33.1	Very low	156 Å²	156	135.8 Å²	135.8	83%	0.834	76%	0.763	S	S	*	*			trans	-104.4	-177.9	172.7	-166.8	7.1	0	0	0	110.9
654	S	37.3	Very low	33.1	Very low	114 Å²	114	132.5 Å²	132.5	80%	0.797	76%	0.758	S	S	*	*			trans	-57.2	161.4	-173.4	-51	0	0	0	0	117.2
655	G	29.6	Very low	31.9	Very low	58 Å²	58	131.4 Å²	131.4	60%	0.598	76%	0.758	S	S	*	*			trans	-172.7	159.4	165.4	0	0	0	0	0	110.6
656	F	33.3	Very low	30.9	Very low	184 Å²	184	133.2 Å²	133.2	81%	0.807	76%	0.757	S	S	*	*			cis	-140.1	-165	1.9	-68.6	-95.2	0	0	0	108
657	Q	29.4	Very low	30.9	Very low	160 Å²	160	132.6 Å²	132.6	75%	0.748	75%	0.751	S	S	*	*			cis	-150.6	157.4	12.3	-109.3	113.4	29.4	0	0	106.9
658	T	31.1	Very low	30.7	Very low	102 Å²	102	135.8 Å²	135.8	63%	0.626	76%	0.756	S	S	*	*			cis	75.1	124.5	19.5	74.5	0	0	0	0	116.9
659	T	31.9	Very low	31	Very low	125 Å²	125	131.9 Å²	131.9	77%	0.767	74%	0.742	S	S	*	*			cis	-178.9	158.2	-2.9	26	0	0	0	0	108.9
660	N	26	Very low	30.4	Very low	140 Å²	140	134.1 Å²	134.1	75%	0.749	74%	0.741	S	S	*	*			trans	179.9	152	150.6	-110.3	26.3	0	0	0	110.2
661	E	29.7	Very low	30.7	Very low	135 Å²	135	135.7 Å²	135.7	63%	0.631	74%	0.74	S	S	*	*			cis	-159.5	149.8	-12.8	-135.1	-172.1	138.3	0	0	112.1
662	Q	32	Very low	30.5	Very low	137 Å²	137	131.1 Å²	131.1	64%	0.64	73%	0.732	S	S	*	*			trans	63	125.5	154.7	-72.5	-178.2	46	0	0	125
663	Q	28.6	Very low	30.1	Very low	174 Å²	174	130.6 Å²	130.6	81%	0.813	73%	0.732	S	S	*	*			trans	70.7	147.5	144.5	-62.5	176	22.9	0	0	121.4
664	A	28.1	Very low	30.1	Very low	88 Å²	88	126 Å²	126	73%	0.727	72%	0.721	S	S	*	*			cis	-170.8	154.5	-24.9	0	0	0	0	0	111.7
665	A	29.7	Very low	29.9	Very low	94 Å²	94	127.2 Å²	127.2	78%	0.777	72%	0.724	S	S	*	*			trans	69.2	149.9	168.2	0	0	0	0	0	117.3
666	Q	27.7	Very low	29.9	Very low	151 Å²	151	128.7 Å²	128.7	71%	0.706	73%	0.731	S	S	*	*			cis	-156.4	152.2	3	-141.8	172.2	-40.5	0	0	111.3
667	E	30.9	Very low	29.7	Very low	149 Å²	149	126.7 Å²	126.7	70%	0.696	73%	0.728	S	S	*	*			trans	41.6	141.5	149.8	-77.9	154.1	-139.4	0	0	119.9
668	D	27.4	Very low	29.8	Very low	151 Å²	151	124.3 Å²	124.3	81%	0.807	73%	0.729	S	S	*	*			cis	170.1	175.9	6.9	-115.9	15.8	0	0	0	103.5
669	S	31.5	Very low	29.9	Very low	81 Å²	81	127.3 Å²	127.3	57%	0.566	74%	0.74	S	S	*	*			cis	-168.4	141.4	-3.6	158.1	0	0	0	0	110
670	F	25.4	Very low	29.9	Very low	178 Å²	178	130.7 Å²	130.7	78%	0.781	75%	0.745	S	S	*	*			trans	66	118.6	149.6	-79.8	-132.1	0	0	0	124.3
671	L	32.8	Very low	30.1	Very low	151 Å²	151	129.9 Å²	129.9	79%	0.791	75%	0.745	S	S	*	*			trans	64.6	153.3	130.8	-58	-173.9	0	0	0	121.7
672	S	31	Very low	30	Very low	101 Å²	101	129 Å²	129	71%	0.706	75%	0.748	S	S	*	*			cis	-174.3	162.6	-19.8	-176.7	0	0	0	0	110.9
673	S	30.8	Very low	29.7	Very low	114 Å²	114	133.1 Å²	133.1	80%	0.797	76%	0.758	S	S	*	*			trans	67.7	140.8	165.3	137	0	0	0	0	117.2
674	G	28.7	Very low	29.5	Very low	60 Å²	60	129.2 Å²	129.2	62%	0.619	76%	0.755	S	S	*	*			cis	94.4	131.8	5.2	0	0	0	0	0	112.4
675	T	32.5	Very low	29.4	Very low	139 Å²	139	133.3 Å²	133.3	85%	0.853	76%	0.764	S	S	*	*			cis	-160	166.1	12.9	48.2	0	0	0	0	110.7
676	A	30.4	Very low	29.2	Very low	89 Å²	89	133.8 Å²	133.8	74%	0.736	76%	0.762	S	S	*	*			trans	34.7	158.6	142.6	0	0	0	0	0	122.2
677	D	29.1	Very low	29.2	Very low	142 Å²	142	132.1 Å²	132.1	76%	0.759	77%	0.767	S	S	*	*			cis	-163.4	162.3	18.3	-149.1	-35.5	0	0	0	113
678	S	29.6	Very low	29	Very low	110 Å²	110	132.4 Å²	132.4	77%	0.769	78%	0.778	S	S	*	*			trans	65.7	148.6	143.9	-79.9	0	0	0	0	124.7
679	L	34.6	Very low	28.9	Very low	164 Å²	164	136.8 Å²	136.8	86%	0.859	78%	0.784	S	S	*	*			trans	-106.3	142.1	178.6	-71.2	149.8	0	0	0	111.7
680	K	31.9	Very low	28.6	Very low	197 Å²	197	139 Å²	139	86%	0.857	80%	0.799	S	S	*	*				170	129.8	117.6	-95.1	169.8	-178.9	176	0	115.5
681	T	30.4	Very low	28.6	Very low	123 Å²	123	133.6 Å²	133.6	76%	0.755	79%	0.794	S	S	*	*			trans	59.5	122.8	138.4	-38.2	0	0	0	0	121
682	V	26.9	Very low	28.1	Very low	115 Å²	115	137 Å²	137	70%	0.697	80%	0.802	S	S	*	*				173.6	122.7	115.1	155	0	0	0	0	112.7
683	R	25.1	Very low	28	Very low	224 Å²	224	137.2 Å²	137.2	85%	0.845	81%	0.81	S	S	*	*			trans	36.4	140.2	150.6	-61.6	179	178.4	126.5	-0.4	123.6
684	A	24.6	Very low	27.7	Very low	92 Å²	92	135.1 Å²	135.1	76%	0.76	81%	0.806	S	S	*	*			trans	70.1	145.2	149.1	0	0	0	0	0	116.6
685	L	26.4	Very low	27.8	Very low	175 Å²	175	139.8 Å²	139.8	92%	0.916	82%	0.822	S	S	*	*			cis	-133.3	167.7	30.4	-78.1	158.5	0	0	0	114
686	S	25.9	Very low	27.6	Very low	104 Å²	104	136.8 Å²	136.8	73%	0.727	82%	0.82	S	S	*	*			trans	-107.4	158.2	172.2	50.9	0	0	0	0	112.6
687	S	27.3	Very low	27.6	Very low	115 Å²	115	140.7 Å²	140.7	80%	0.804	83%	0.828	S	S	*	*			trans	57.3	106.8	158.9	-61.3	0	0	0	0	120
688	V	25.9	Very low	27.5	Very low	155 Å²	155	136.9 Å²	136.9	94%	0.939	82%	0.822	S	S	*	*			trans	-127.5	141.8	134.2	179.2	0	0	0	0	108.8
689	R	26.8	Very low	27.9	Very low	244 Å²	244	136.3 Å²	136.3	92%	0.921	82%	0.824	S	S	*	*			trans	-102.7	141	-169.3	-171.7	-171.9	-164.5	-175	7.1	110.5
690	S	25.4	Very low	27.9	Very low	128 Å²	128	136.4 Å²	136.4	90%	0.895	83%	0.825	S	S	*	*			trans	-136.9	147.6	161	-173.3	0	0	0	0	108.8
691	G	23.9	Very low	28.3	Very low	64 Å²	64	132.3 Å²	132.3	66%	0.66	82%	0.822	S	S	*	*			trans	-174.8	149.9	-179.9	0	0	0	0	0	113.6
692	F	23.4	Very low	28.8	Very low	223 Å²	223	129.9 Å²	129.9	98%	0.978	81%	0.814	S	S	*	*			trans	-144	154.8	163.2	-112.2	-89.8	0	0	0	107.2
693	A	27.5	Very low	29.7	Very low	104 Å²	104	131.7 Å²	131.7	86%	0.86	82%	0.82	S	S	*	*			trans	-136.1	160.7	-154.2	0	0	0	0	0	115.5
694	G	26.3	Very low	30.5	Very low	70 Å²	70	125.3 Å²	125.3	72%	0.722	81%	0.808	S	S	*	*			trans	106.3	141.6	167.9	0	0	0	0	0	114.3
695	V	30.9	Very low	31.6	Very low	158 Å²	158	124.4 Å²	124.4	96%	0.958	80%	0.797	S	S	*	*			cis	-151.4	141.7	-5.5	178.3	0	0	0	0	107.8
696	G	26.5	Very low	32.6	Very low	77 Å²	77	122.2 Å²	122.2	79%	0.794	79%	0.785	S	S	*	*			trans	175.9	122.9	172.6	0	0	0	0	0	112.2
697	D	31	Very low	33.6	Very low	171 Å²	171	122.8 Å²	122.8	91%	0.914	78%	0.779	S	S	*	*			trans	-81.2	161.3	-171.5	-163.5	11.2	0	0	0	113.5
698	G	27	Very low	35	Very low	62 Å²	62	121.8 Å²	121.8	64%	0.639	77%	0.765	S	S	*	*			trans	170.5	111.4	178.6	0	0	0	0	0	113.7
699	A	38.8	Very low	36.4	Very low	98 Å²	98	120.2 Å²	120.2	81%	0.81	75%	0.747	S	S	*	*			trans	-108.8	65.1	-169.2	0	0	0	0	0	113.8
700	D	35	Very low	37.8	Very low	165 Å²	165	116 Å²	116	88%	0.882	73%	0.733	S	S	*	*			trans	-112	78.6	177.4	-68.8	-54.8	0	0	0	111.2
701	S	39	Very low	39.5	Very low	112 Å²	112	114.4 Å²	114.4	78%	0.783	71%	0.714	S	S	*	*			trans	-148.3	4.2	-177.3	-170.6	0	0	0	0	116.1
702	A	41.9	Very low	41.4	Very low	72 Å²	72	115 Å²	115	60%	0.595	71%	0.707	S	S	*	*	S	Bend	trans	-91	-46.3	-179.6	0	0	0	0	0	112.8	C704 S705	A702-C704 VanDerWaalsContact C-N 3.34Å; A702-C704 PolarHBondContact O-N 2.9Å; A702-S705 VanDerWaalsContact O-CB 3.3Å; A702-S705 WeakPolarHBondContact O-CB 2.8Å; A702-S705 PolarHBondContact O-N 3.08Å; A702-S705 VanDerWaalsContact O-N 3.09Å
703	D	45.5	Very low	43.4	Very low	153 Å²	153	107 Å²	107	82%	0.818	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.5	-16	-162.5	-65.6	-6.1	0	0	0	114.9	S705	D703-S705 VanDerWaalsContact C-N 3.34Å
704	C	41.8	Very low	45	Very low	89 Å²	89	104.6 Å²	104.6	60%	0.601	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.5	-29.1	170.7	-60.6	0	0	0	0	112.4	A702 L706 L707 D708	A702-C704 VanDerWaalsContact C-N 3.34Å; A702-C704 PolarHBondContact O-N 2.9Å; C704-L706 VanDerWaalsContact C-N 3.34Å; C704-L706 PolarHBondContact O-N 3.45Å; C704-L707 PolarHBondContact O-N 2.99Å; C704-L707 VanDerWaalsContact O-N 3.16Å; C704-D708 PolarHBondContact O-N 3.19Å
705	S	48.3	Very low	46.7	Very low	73 Å²	73	106.4 Å²	106.4	51%	0.51	64%	0.643	S	S	.	*	H	α-helix	trans	-59.7	-41.3	-168.1	-167	0	0	0	0	112.9	A702 D703 L707 E709	A702-S705 VanDerWaalsContact O-CB 3.3Å; A702-S705 WeakPolarHBondContact O-CB 2.8Å; A702-S705 PolarHBondContact O-N 3.08Å; A702-S705 VanDerWaalsContact O-N 3.09Å; D703-S705 VanDerWaalsContact C-N 3.34Å; S705-L707 VanDerWaalsContact C-N 3.34Å; S705-L707 PolarHBondContact O-N 3.3Å; S705-E709 WeakPolarHBondContact O-CB 3.5Å; S705-E709 PolarHBondContact O-N 2.95Å
706	L	47.3	Very low	47.9	Very low	129 Å²	129	104.4 Å²	104.4	68%	0.675	62%	0.624	S	S	*	*	H	α-helix	trans	-71.4	-27.6	-177	-74	168.5	0	0	0	113.2	C704 Y710	C704-L706 VanDerWaalsContact C-N 3.34Å; C704-L706 PolarHBondContact O-N 3.45Å; L706-Y710 VanDerWaalsContact O-CB 3.31Å; L706-Y710 WeakPolarHBondContact O-CB 3.24Å; L706-Y710 PolarHBondContact O-N 3.46Å; L706-Y710 VanDerWaalsContact O-N 3.12Å
707	L	46.9	Very low	49.4	Very low	116 Å²	116	109.4 Å²	109.4	61%	0.607	62%	0.619	S	S	*	*	H	α-helix	trans	-78.2	-43.7	177.7	-166.4	69.9	0	0	0	110.7	C704 S705 Y710 L711	C704-L707 PolarHBondContact O-N 2.99Å; C704-L707 VanDerWaalsContact O-N 3.16Å; S705-L707 VanDerWaalsContact C-N 3.34Å; S705-L707 PolarHBondContact O-N 3.3Å; L707-Y710 PolarHBondContact O-N 2.89Å; L707-L711 HydrophobicContact CG-CD1 4.32Å; L707-L711 WeakPolarHBondContact O-CB 3.38Å; L707-L711 VanDerWaalsContact O-CG 3.25Å; L707-L711 WeakPolarHBondContact O-CG 3.36Å; L707-L711 PolarHBondContact O-N 3.45Å
708	D	55.5	Low	50.6	Low	94 Å²	94	106.1 Å²	106.1	50%	0.503	60%	0.598	S	S	.	*	H	α-helix	trans	-68.5	-35.1	176.4	-69.6	-30.6	0	0	0	111.8	C704 S712	C704-D708 PolarHBondContact O-N 3.19Å; D708-S712 VanDerWaalsContact O-CB 3.26Å; D708-S712 WeakPolarHBondContact O-CB 3.47Å; D708-S712 PolarHBondContact O-N 3.4Å; D708-S712 PolarHBondContact O-OG 3.33Å
709	E	56.6	Low	52.4	Low	122 Å²	122	108.9 Å²	108.9	57%	0.57	59%	0.594	S	S	*	*	H	α-helix	trans	-67.2	-41.6	173.6	-175.2	170.9	-145.9	0	0	111.9	S705 S712 S713	S705-E709 WeakPolarHBondContact O-CB 3.5Å; S705-E709 PolarHBondContact O-N 2.95Å; E709-S712 PolarHBondContact O-N 3.44Å; E709-S713 WeakPolarHBondContact O-CB 3.44Å; E709-S713 PolarHBondContact O-N 2.87Å
710	Y	54.2	Low	53.5	Low	157 Å²	157	110 Å²	110	62%	0.616	58%	0.583	S	S	*	*	H	α-helix	trans	-63.6	-46.4	172.9	-179.7	-97.6	0	0	0	112	L706 L707 S712 S713 V714	L706-Y710 VanDerWaalsContact O-CB 3.31Å; L706-Y710 WeakPolarHBondContact O-CB 3.24Å; L706-Y710 PolarHBondContact O-N 3.46Å; L706-Y710 VanDerWaalsContact O-N 3.12Å; L707-Y710 PolarHBondContact O-N 2.89Å; Y710-S712 VanDerWaalsContact C-N 3.34Å; Y710-S712 PolarHBondContact O-N 2.99Å; Y710-S713 PolarHBondContact O-N 3.47Å; Y710-V714 HydrophobicContact CD1-CG2 4.43Å; Y710-V714 HydrophobicContact CE1-CG2 4.04Å; Y710-V714 WeakPolarHBondContact O-CG2 3.46Å; Y710-V714 PolarHBondContact O-N 2.84Å
711	L	62.8	Low	54.6	Low	94 Å²	94	105 Å²	105	49%	0.492	56%	0.564	S	S	.	*	H	α-helix	trans	-62.7	-40.6	177.1	-71.9	169.1	0	0	0	111.6	L707 V714 Q715	L707-L711 HydrophobicContact CG-CD1 4.32Å; L707-L711 WeakPolarHBondContact O-CB 3.38Å; L707-L711 VanDerWaalsContact O-CG 3.25Å; L707-L711 WeakPolarHBondContact O-CG 3.36Å; L707-L711 PolarHBondContact O-N 3.45Å; L711-V714 PolarHBondContact O-N 3.35Å; L711-Q715 WeakPolarHBondContact O-CB 3.47Å; L711-Q715 PolarHBondContact O-N 2.94Å
712	S	62.1	Low	55.4	Low	75 Å²	75	107 Å²	107	52%	0.524	56%	0.561	S	S	.	*	H	α-helix	trans	-64.3	-39.3	174.8	-58.2	0	0	0	0	112.2	D708 E709 Y710 V714 Q715 Q716	D708-S712 VanDerWaalsContact O-CB 3.26Å; D708-S712 WeakPolarHBondContact O-CB 3.47Å; D708-S712 PolarHBondContact O-N 3.4Å; D708-S712 PolarHBondContact O-OG 3.33Å; E709-S712 PolarHBondContact O-N 3.44Å; Y710-S712 VanDerWaalsContact C-N 3.34Å; Y710-S712 PolarHBondContact O-N 2.99Å; S712-V714 VanDerWaalsContact C-N 3.33Å; S712-V714 PolarHBondContact O-N 3.16Å; S712-Q715 PolarHBondContact O-N 3.44Å; S712-Q716 WeakPolarHBondContact O-CB 3.23Å; S712-Q716 PolarHBondContact O-N 3.31Å
713	S	65.8	Low	55.7	Low	57 Å²	57	110.8 Å²	110.8	40%	0.399	57%	0.566	S	S	.	*	H	α-helix	trans	-69	-29.8	176.4	-173.6	0	0	0	0	113.1	E709 Y710 R717	E709-S713 WeakPolarHBondContact O-CB 3.44Å; E709-S713 PolarHBondContact O-N 2.87Å; Y710-S713 PolarHBondContact O-N 3.47Å; S713-R717 WeakPolarHBondContact O-CG 3.33Å; S713-R717 PolarHBondContact O-N 3.08Å
714	V	61	Low	55.7	Low	53 Å²	53	106.6 Å²	106.6	32%	0.321	55%	0.553	S	S	.	*	H	α-helix	trans	-71	-49.8	170	172.9	0	0	0	0	110.5	Y710 L711 S712 Q716 R717 E718	Y710-V714 HydrophobicContact CD1-CG2 4.43Å; Y710-V714 HydrophobicContact CE1-CG2 4.04Å; Y710-V714 WeakPolarHBondContact O-CG2 3.46Å; Y710-V714 PolarHBondContact O-N 2.84Å; L711-V714 PolarHBondContact O-N 3.35Å; S712-V714 VanDerWaalsContact C-N 3.33Å; S712-V714 PolarHBondContact O-N 3.16Å; V714-Q716 VanDerWaalsContact C-N 3.29Å; V714-Q716 PolarHBondContact O-N 3.08Å; V714-R717 PolarHBondContact O-N 2.91Å; V714-E718 PolarHBondContact O-N 3.26Å
715	Q	63.3	Low	55.8	Low	107 Å²	107	108.3 Å²	108.3	50%	0.5	56%	0.556	S	S	.	*	H	α-helix	trans	-53.5	-45.2	177.5	-168.4	79.9	61.4	0	0	111.8	L711 S712 R717 E718 E719	L711-Q715 WeakPolarHBondContact O-CB 3.47Å; L711-Q715 PolarHBondContact O-N 2.94Å; S712-Q715 PolarHBondContact O-N 3.44Å; Q715-R717 VanDerWaalsContact C-N 3.31Å; Q715-R717 PolarHBondContact O-N 3.46Å; Q715-E718 WeakPolarHBondContact O-CB 3.49Å; Q715-E718 PolarHBondContact O-N 3.38Å; Q715-E718 VanDerWaalsContact O-N 3.16Å; Q715-E719 PolarHBondContact O-N 3.44Å
716	Q	55.4	Low	55.4	Low	116 Å²	116	108.9 Å²	108.9	54%	0.542	56%	0.56	S	S	.	*	H	α-helix	trans	-66.5	-31	179.7	-169.9	171.3	6.9	0	0	112.9	S712 V714 E720	S712-Q716 WeakPolarHBondContact O-CB 3.23Å; S712-Q716 PolarHBondContact O-N 3.31Å; V714-Q716 VanDerWaalsContact C-N 3.29Å; V714-Q716 PolarHBondContact O-N 3.08Å; Q716-E720 WeakPolarHBondContact O-CG 3.38Å; Q716-E720 PolarHBondContact O-N 2.87Å
717	R	58.4	Low	55.1	Low	182 Å²	182	110 Å²	110	69%	0.687	57%	0.567	S	S	*	*	H	α-helix	trans	-77.2	-26.1	173.2	-76	178.3	173.2	175.4	1.4	113.2	S713 V714 Q715 A721	S713-R717 WeakPolarHBondContact O-CG 3.33Å; S713-R717 PolarHBondContact O-N 3.08Å; V714-R717 PolarHBondContact O-N 2.91Å; Q715-R717 VanDerWaalsContact C-N 3.31Å; Q715-R717 PolarHBondContact O-N 3.46Å; R717-A721 WeakPolarHBondContact O-CB 3.44Å; R717-A721 PolarHBondContact O-N 3.46Å
718	E	55.7	Low	55	Low	102 Å²	102	111.9 Å²	111.9	48%	0.477	57%	0.57	S	S	.	*	H	α-helix	trans	-69.7	-44.3	170.3	-68.3	174.7	162.5	0	0	109.6	V714 Q715 A721 E722	V714-E718 PolarHBondContact O-N 3.26Å; Q715-E718 WeakPolarHBondContact O-CB 3.49Å; Q715-E718 PolarHBondContact O-N 3.38Å; Q715-E718 VanDerWaalsContact O-N 3.16Å; E718-A721 PolarHBondContact O-N 2.93Å; E718-E722 PolarHBondContact O-N 2.89Å
719	E	64.2	Low	54.1	Low	120 Å²	120	113.7 Å²	113.7	56%	0.561	59%	0.585	S	S	*	*	H	α-helix	trans	-63.8	-45.7	175.9	-69.8	179.6	169.6	0	0	113.2	Q715 A721 E722 E723	Q715-E719 PolarHBondContact O-N 3.44Å; E719-A721 PolarHBondContact O-N 3.14Å; E719-E722 PolarHBondContact O-N 2.86Å; E719-E723 PolarHBondContact O-N 3.35Å
720	E	63.5	Low	53	Low	122 Å²	122	117 Å²	117	57%	0.57	60%	0.601	S	S	*	*	H	α-helix	trans	-60.6	-30.2	174.7	-76.5	178.2	179.1	0	0	112.7	Q716 A724	Q716-E720 WeakPolarHBondContact O-CG 3.38Å; Q716-E720 PolarHBondContact O-N 2.87Å; E720-A724 WeakPolarHBondContact O-CB 3.42Å; E720-A724 PolarHBondContact O-N 2.87Å
721	A	57.4	Low	51.9	Low	59 Å²	59	115.9 Å²	115.9	49%	0.488	61%	0.61	S	S	.	*	H	α-helix	trans	-78.7	-31.6	177.1	0	0	0	0	0	113.1	R717 E718 E719 N725	R717-A721 WeakPolarHBondContact O-CB 3.44Å; R717-A721 PolarHBondContact O-N 3.46Å; E718-A721 PolarHBondContact O-N 2.93Å; E719-A721 PolarHBondContact O-N 3.14Å; A721-N725 PolarHBondContact O-N 3.39Å
722	E	55	Low	51	Low	154 Å²	154	116.9 Å²	116.9	72%	0.72	62%	0.622	S	S	*	*	H	α-helix	trans	-74.5	-42.6	175.2	-71	-162.6	160.4	0	0	112.3	E718 E719 A724 N725 S726	E718-E722 PolarHBondContact O-N 2.89Å; E719-E722 PolarHBondContact O-N 2.86Å; E722-A724 VanDerWaalsContact C-N 3.33Å; E722-A724 PolarHBondContact O-N 3.06Å; E722-N725 PolarHBondContact O-N 3.17Å; E722-N725 VanDerWaalsContact O-N 3.13Å; E722-S726 PolarHBondContact O-N 3.04Å
723	E	48.4	Very low	49.4	Very low	152 Å²	152	122 Å²	122	71%	0.71	64%	0.638	S	S	*	*	H	α-helix	trans	-57.2	-46.8	173.7	-81.6	-156.4	142	0	0	111.2	E719 N725 S726	E719-E723 PolarHBondContact O-N 3.35Å; E723-N725 PolarHBondContact O-N 3.02Å; E723-N725 VanDerWaalsContact O-N 3.08Å; E723-S726 PolarHBondContact O-N 3.18Å; E723-S726 PolarHBondContact O-OG 3.42Å
724	A	46	Very low	47.6	Very low	66 Å²	66	125.6 Å²	125.6	55%	0.545	66%	0.657	S	S	.	*	H	α-helix	trans	-64.3	-12.7	-180	0	0	0	0	0	114.9	E720 E722	E720-A724 WeakPolarHBondContact O-CB 3.42Å; E720-A724 PolarHBondContact O-N 2.87Å; E722-A724 VanDerWaalsContact C-N 3.33Å; E722-A724 PolarHBondContact O-N 3.06Å
725	N	42.9	Very low	46	Very low	125 Å²	125	128.4 Å²	128.4	67%	0.668	68%	0.679	S	S	*	*	H	α-helix	trans	-98.3	-19.9	174.2	-119	-6.9	0	0	0	113	A721 E722 E723	A721-N725 PolarHBondContact O-N 3.39Å; E722-N725 PolarHBondContact O-N 3.17Å; E722-N725 VanDerWaalsContact O-N 3.13Å; E723-N725 PolarHBondContact O-N 3.02Å; E723-N725 VanDerWaalsContact O-N 3.08Å
726	S	41.1	Very low	45	Very low	84 Å²	84	128.3 Å²	128.3	59%	0.587	69%	0.688	S	S	*	*	H	α-helix	trans	-76.2	-35.1	-178.9	73.2	0	0	0	0	113.7	E722 E723 K728	E722-S726 PolarHBondContact O-N 3.04Å; E723-S726 PolarHBondContact O-N 3.18Å; E723-S726 PolarHBondContact O-OG 3.42Å; S726-K728 PolarHBondContact O-N 3.3Å
727	D	40.9	Very low	43.7	Very low	152 Å²	152	127.4 Å²	127.4	81%	0.813	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.5	37	-168.8	-160.3	33.1	0	0	0	114.2
728	K	43.9	Very low	42.3	Very low	156 Å²	156	129.7 Å²	129.7	68%	0.678	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.4	3.9	-172.9	-90.7	175.6	-175.4	146.8	0	116.3	S726	S726-K728 PolarHBondContact O-N 3.3Å
729	T	37.5	Very low	40.9	Very low	133 Å²	133	131 Å²	131	82%	0.816	72%	0.718	S	S	*	*	S	Bend	trans	-124.9	48.3	-176.6	52.1	0	0	0	0	114.8
730	E	33.1	Very low	39.2	Very low	192 Å²	192	129.7 Å²	129.7	90%	0.897	73%	0.728	S	S	*	*			trans	-142.8	129.6	160.9	-125.1	-180	-137.1	0	0	112.7
731	T	30.8	Very low	37.5	Very low	133 Å²	133	129.3 Å²	129.3	82%	0.816	74%	0.738	S	S	*	*			trans	-154.3	160.6	177.4	66.5	0	0	0	0	110.2
732	P	45.5	Very low	36.1	Very low	114 Å²	114	131.7 Å²	131.7	74%	0.74	75%	0.747	S	S	*	*				-135.5	158.5	-60.1	37.5	-23.1	0	0	0	112.4
733	Q	27.1	Very low	34.9	Very low	184 Å²	184	131.8 Å²	131.8	86%	0.86	75%	0.753	S	S	*	*			trans	-155.2	147.1	157.7	-126.9	170	66.1	0	0	116.5
734	T	27.6	Very low	34.1	Very low	131 Å²	131	130.7 Å²	130.7	80%	0.804	76%	0.757	S	S	*	*			trans	66.2	116.2	170.2	55.3	0	0	0	0	119.4
735	S	28	Very low	34	Very low	112 Å²	112	133.2 Å²	133.2	78%	0.783	77%	0.767	S	S	*	*			trans	-85.3	179.5	165.2	58.9	0	0	0	0	110.1
736	P	43.5	Very low	33.9	Very low	106 Å²	106	133.3 Å²	133.3	69%	0.688	78%	0.775	S	S	*	*			cis	-152.9	169.3	23.5	44.5	-23	0	0	0	121.3
737	S	26.8	Very low	33.3	Very low	96 Å²	96	137.6 Å²	137.6	67%	0.671	79%	0.788	S	S	*	*			trans	78.1	131.6	136.4	71.1	0	0	0	0	123.6
738	R	29	Very low	32.9	Very low	231 Å²	231	139.6 Å²	139.6	87%	0.872	79%	0.792	S	S	*	*			trans	69.3	148.4	145.9	-70.5	179.1	167.7	-168.4	-4.2	117.6
739	T	27.4	Very low	32.3	Very low	129 Å²	129	139.7 Å²	139.7	79%	0.791	79%	0.793	S	S	*	*			cis	-153.6	163.8	-5.9	1.1	0	0	0	0	111.4
740	A	28	Very low	32	Very low	92 Å²	92	137.9 Å²	137.9	76%	0.76	79%	0.791	S	S	*	*			trans	-46.8	154.8	175.5	0	0	0	0	0	117.5
741	S	27.4	Very low	32	Very low	114 Å²	114	136.1 Å²	136.1	80%	0.797	78%	0.783	S	S	*	*				-176	154.6	110.1	42.6	0	0	0	0	115.4
742	T	28.8	Very low	32.1	Very low	110 Å²	110	139.3 Å²	139.3	68%	0.675	79%	0.788	S	S	*	*			trans	-27.7	145	166	51.8	0	0	0	0	119.3
743	N	29.3	Very low	31.5	Very low	156 Å²	156	139.5 Å²	139.5	83%	0.834	79%	0.792	S	S	*	*				-175.4	167.4	99.9	-95.8	-42.8	0	0	0	115.1
744	T	32.4	Very low	31.8	Very low	129 Å²	129	136.4 Å²	136.4	79%	0.791	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-90.5	163.2	-178.9	32.8	0	0	0	0	114.2
745	P	42.2	Very low	33.4	Very low	118 Å²	118	136 Å²	136	77%	0.766	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-96.8	168.7	-174.2	39	-37.2	0	0	0	114.5
746	P	40.7	Very low	33.8	Very low	128 Å²	128	140 Å²	140	83%	0.831	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-102.1	151.2	164.2	36.9	-30.1	0	0	0	113.7
747	M	29.5	Very low	33.9	Very low	174 Å²	174	143 Å²	143	86%	0.857	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-88.9	160.2	173.1	-57.5	149.4	53.1	0	0	112.3
748	Q	32.4	Very low	34.8	Very low	193 Å²	193	147 Å²	147	90%	0.902	85%	0.845	S	S	*	*			trans	-171	164.3	138	-108.3	165.3	38.9	0	0	112.5
749	K	30.9	Very low	35.1	Very low	159 Å²	159	142.8 Å²	142.8	69%	0.691	84%	0.844	S	S	*	*				-166.9	120.3	-63	-169.2	-163.6	-169.4	-151.9	0	109.8	E751	K749-E751 WeakPolarHBondContact CE-OE1 3.45Å; K749-E751 IonicContact NZ-OE1 2.63Å; K749-E751 PolarHBondContact NZ-OE1 3.4Å
750	A	32.1	Very low	35.5	Very low	95 Å²	95	143.5 Å²	143.5	79%	0.785	85%	0.847	S	S	*	*			trans	-165.3	111.9	160.5	0	0	0	0	0	107.2
751	E	31.9	Very low	35.9	Very low	155 Å²	155	146.4 Å²	146.4	72%	0.724	85%	0.852	S	S	*	*				76.5	134	56.7	-73.4	-177.8	-171.2	0	0	115.4	K749	K749-E751 WeakPolarHBondContact CE-OE1 3.45Å; K749-E751 IonicContact NZ-OE1 2.63Å; K749-E751 PolarHBondContact NZ-OE1 3.4Å
752	Q	34.6	Very low	36.4	Very low	199 Å²	199	148.3 Å²	148.3	93%	0.93	86%	0.855	S	S	*	*			trans	-113.5	154.6	-164	-54.2	161.5	-61.3	0	0	110.4
753	S	32.3	Very low	36.9	Very low	118 Å²	118	150.7 Å²	150.7	83%	0.825	87%	0.866	S	S	*	*			trans	-161.3	139.7	152.9	53.7	0	0	0	0	113.9
754	S	33.8	Very low	37.4	Very low	119 Å²	119	150.3 Å²	150.3	83%	0.832	87%	0.868	S	S	*	*			trans	177.1	156.1	166.3	-78.4	0	0	0	0	107.7
755	P	59.5	Low	37.8	Very low	124 Å²	124	151.9 Å²	151.9	81%	0.805	87%	0.874	S	S	*	*			cis	-121.2	-176.7	-21	41.2	-27.9	0	0	0	111.6
756	E	38.3	Very low	37.5	Very low	194 Å²	194	154.5 Å²	154.5	91%	0.907	88%	0.882	S	S	*	*			trans	-151.4	167.4	154.1	-147	166.1	-156.5	0	0	111.7
757	L	44.6	Very low	37.2	Very low	170 Å²	170	156.7 Å²	156.7	89%	0.89	89%	0.886	S	S	*	*			trans	-100.7	148.3	-171.4	-63.8	87.2	0	0	0	113.4
758	A	46.3	Very low	37.9	Very low	180 Å²	180	155.1 Å²	155.1	100%	1.488	89%	0.889	S	S	*	*			trans	-153.4	0	147.2	0	0	0	0	0	109.9

Retrieved 758 of 758 residues in 1008.4 ms (Link to these results)

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