A0A3Q0KH03_SCHMA Loading...

Dihydrolipoamide acetyltransferase component of pyruvate dehydrogenase complex

AlphaFold DB , UniProt , Accession A0A3Q0KH03, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 483 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.1	Very low	38.2	Very low	238 Å²	238	171.1 Å²	171.1	100%	1.172	88%	0.876	S	S	*	*				0	124.6	0	-85	179.9	159	0	0	107.4
2	S	36.3	Very low	38	Very low	127 Å²	127	165.6 Å²	165.6	89%	0.888	86%	0.863	S	S	*	*			trans	52.8	135	173.9	-69.3	0	0	0	0	118.5
3	A	40.3	Very low	38.2	Very low	84 Å²	84	165.7 Å²	165.7	69%	0.694	86%	0.863	S	S	*	*			cis	-169.6	121.5	-4.4	0	0	0	0	0	104.6
4	R	38.1	Very low	38.2	Very low	238 Å²	238	170.9 Å²	170.9	90%	0.898	87%	0.866	S	S	*	*				23.8	100.6	106.1	-79.1	-174.8	176.6	-175.2	-0.6	113.6
5	L	41.5	Very low	38.3	Very low	171 Å²	171	171.6 Å²	171.6	90%	0.895	86%	0.864	S	S	*	*				-176.3	151.3	127.4	-120.6	72.7	0	0	0	110.5
6	C	37.1	Very low	38.2	Very low	124 Å²	124	174.7 Å²	174.7	84%	0.838	87%	0.871	S	S	*	*			trans	85.4	56.8	177.1	-98.2	0	0	0	0	117.6
7	L	37.7	Very low	38.7	Very low	163 Å²	163	170.7 Å²	170.7	85%	0.853	86%	0.858	S	S	*	*			trans	-64.8	147.9	135	-88.1	116.7	0	0	0	108.9
8	L	35.8	Very low	38.5	Very low	163 Å²	163	171.5 Å²	171.5	85%	0.853	86%	0.858	S	S	*	*			trans	87.1	79.1	-176	-71.6	84.4	0	0	0	115.6
9	R	38.7	Very low	38.5	Very low	237 Å²	237	169.2 Å²	169.2	89%	0.894	85%	0.854	S	S	*	*	S	Bend		-168.5	122	129.4	-106.4	176.3	179.4	-176.5	-0.8	110.5
10	L	37.9	Very low	38.4	Very low	140 Å²	140	166 Å²	166	73%	0.733	85%	0.848	S	S	*	*			trans	73	68.2	162.1	-69.9	93.2	0	0	0	118.2	C12	L10-C12 PolarHBondContact O-N 3.2Å
11	Q	36.2	Very low	38.3	Very low	197 Å²	197	169.2 Å²	169.2	92%	0.921	85%	0.849	S	S	*	*			trans	-68.8	94	134.5	-79.5	170.8	-31.7	0	0	108
12	C	36.1	Very low	38.2	Very low	105 Å²	105	166.2 Å²	166.2	71%	0.709	83%	0.83	S	S	*	*			trans	178.7	77.2	163.1	-98.6	0	0	0	0	109.2	L10	L10-C12 PolarHBondContact O-N 3.2Å
13	L	40.2	Very low	38.5	Very low	167 Å²	167	166.3 Å²	166.3	87%	0.874	82%	0.819	S	S	*	*			trans	-170.7	51.5	164.6	-106.2	137.6	0	0	0	111.4
14	R	38.6	Very low	39.1	Very low	239 Å²	239	166.9 Å²	166.9	90%	0.902	81%	0.807	S	S	*	*			trans	-149	68	165.2	-78.7	-165.7	175.8	177	-2.7	109.7
15	H	39.2	Very low	40.4	Very low	181 Å²	181	163 Å²	163	84%	0.838	80%	0.797	S	S	*	*			trans	-139.6	87.2	157.1	-98.1	57.2	0	0	0	105.2	V17	H15-V17 VanDerWaalsContact C-N 3.31Å; H15-V17 PolarHBondContact O-N 3.04Å
16	F	37.8	Very low	42.1	Very low	221 Å²	221	156.6 Å²	156.6	97%	0.969	77%	0.766	S	S	*	*			trans	-72.5	97.4	168.3	-129.2	-96.6	0	0	0	105.6	H18	F16-H18 PolarHBondContact O-N 3.27Å
17	V	45.6	Very low	44.3	Very low	107 Å²	107	152.5 Å²	152.5	65%	0.648	74%	0.737	S	S	*	*			trans	-63.6	123.1	-177.9	179	0	0	0	0	108.4	H15 T19	H15-V17 VanDerWaalsContact C-N 3.31Å; H15-V17 PolarHBondContact O-N 3.04Å; V17-T19 VanDerWaalsContact C-N 3.28Å; V17-T19 PolarHBondContact O-N 3.38Å
18	H	35.2	Very low	46.7	Very low	185 Å²	185	149.2 Å²	149.2	86%	0.856	72%	0.717	S	S	*	*			trans	-55	91.9	162.5	-115.5	-79	0	0	0	108.4	F16 S20	F16-H18 PolarHBondContact O-N 3.27Å; H18-S20 VanDerWaalsContact C-N 3.27Å; H18-S20 PolarHBondContact O-N 3.03Å; H18-S20 VanDerWaalsContact O-N 3.1Å
19	T	39.7	Very low	49.3	Very low	127 Å²	127	142.1 Å²	142.1	78%	0.779	68%	0.68	S	S	*	*			trans	-79.2	86.8	164.5	39	0	0	0	0	106.6	V17 R21	V17-T19 VanDerWaalsContact C-N 3.28Å; V17-T19 PolarHBondContact O-N 3.38Å; T19-R21 PolarHBondContact O-N 3.02Å
20	S	36.4	Very low	51.8	Low	106 Å²	106	136.7 Å²	136.7	74%	0.741	66%	0.663	S	S	*	*			trans	-66.6	93.9	164.2	-158.4	0	0	0	0	106.5	H18 K22	H18-S20 VanDerWaalsContact C-N 3.27Å; H18-S20 PolarHBondContact O-N 3.03Å; H18-S20 VanDerWaalsContact O-N 3.1Å; S20-K22 VanDerWaalsContact C-N 3.29Å; S20-K22 PolarHBondContact O-N 3.14Å
21	R	34.8	Very low	54.3	Low	233 Å²	233	130.1 Å²	130.1	88%	0.879	63%	0.629	S	S	*	*			trans	-60.6	98.4	168.5	-149.9	177.4	-168.8	-160.6	0.9	104.8	T19 I23	T19-R21 PolarHBondContact O-N 3.02Å; R21-I23 VanDerWaalsContact C-N 3.33Å; R21-I23 PolarHBondContact O-N 3.05Å
22	K	39.4	Very low	56.7	Low	175 Å²	175	122.2 Å²	122.2	76%	0.761	59%	0.594	S	S	*	*			trans	-56.6	107	167.9	-88.1	-174.9	175.9	-178.4	0	104.8	S20 Q24	S20-K22 VanDerWaalsContact C-N 3.29Å; S20-K22 PolarHBondContact O-N 3.14Å; K22-Q24 PolarHBondContact O-N 3.07Å
23	I	41.7	Very low	59.2	Low	129 Å²	129	121.3 Å²	121.3	66%	0.662	59%	0.589	S	S	*	*			trans	-67.1	90.2	167.2	-60.2	168.6	0	0	0	103.5	R21 F25	R21-I23 VanDerWaalsContact C-N 3.33Å; R21-I23 PolarHBondContact O-N 3.05Å; I23-F25 HydrophobicContact CB-CE2 4.39Å; I23-F25 HydrophobicContact CB-CZ 4.48Å; I23-F25 HydrophobicContact CG2-CD1 4.39Å; I23-F25 HydrophobicContact CG2-CD2 4.36Å; I23-F25 HydrophobicContact CG2-CE1 3.93Å; I23-F25 HydrophobicContact CG2-CE2 3.89Å; I23-F25 HydrophobicContact CG2-CZ 3.66Å; I23-F25 WeakPolarHBondContact O-CD2 3.46Å; I23-F25 PolarHBondContact O-N 3.18Å
24	Q	53.5	Low	61.4	Low	96 Å²	96	115.5 Å²	115.5	45%	0.449	56%	0.558	S	S	.	*	P	Polyproline II helix	trans	-72.5	123.8	167.4	-83.4	169.3	-33	0	0	105.3	K22	K22-Q24 PolarHBondContact O-N 3.07Å
25	F	64.5	Low	63.4	Low	157 Å²	157	104.3 Å²	104.3	69%	0.689	52%	0.517	S	S	*	.	P	Polyproline II helix	trans	-86.6	145.3	175.7	-68.9	-85.2	0	0	0	107.5	I23 V27	I23-F25 HydrophobicContact CB-CE2 4.39Å; I23-F25 HydrophobicContact CB-CZ 4.48Å; I23-F25 HydrophobicContact CG2-CD1 4.39Å; I23-F25 HydrophobicContact CG2-CD2 4.36Å; I23-F25 HydrophobicContact CG2-CE1 3.93Å; I23-F25 HydrophobicContact CG2-CE2 3.89Å; I23-F25 HydrophobicContact CG2-CZ 3.66Å; I23-F25 WeakPolarHBondContact O-CD2 3.46Å; I23-F25 PolarHBondContact O-N 3.18Å; F25-V27 PolarHBondContact O-N 3.03Å
26	P	77.5	Confident	65.2	Low	36 Å²	36	101.6 Å²	101.6	23%	0.234	52%	0.516	C	S	.	.	P	Polyproline II helix	trans	-56.9	142.5	174.9	25.7	-34.9	0	0	0	109.8	H28 V100 V111	P26-H28 PolarHBondContact O-CD2 3.25Å; P26-H28 PolarHBondContact O-N 3.42Å; P26-V100 HydrophobicContact CB-CG1 3.66Å; P26-V100 HydrophobicContact CG-CG1 4.42Å; P26-V111 HydrophobicContact CB-CG1 3.63Å; P26-V111 HydrophobicContact CG-CG1 4.41Å
27	V	84.2	Confident	67	Low	39 Å²	39	94.5 Å²	94.5	24%	0.236	49%	0.49	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	119.9	-175.8	174	0	0	0	0	108.5	F25 E76 L101	F25-V27 PolarHBondContact O-N 3.03Å; V27-E76 HydrophobicContact CG1-CB 4.08Å; V27-E76 HydrophobicContact CG1-CG 3.88Å; V27-L101 HydrophobicContact CB-CB 3.96Å; V27-L101 HydrophobicContact CG1-CB 4.42Å; V27-L101 HydrophobicContact CG1-CD1 4.2Å; V27-L101 PolarHBondContact N-O 3.15Å; V27-L101 PolarHBondContact O-N 3.27Å
28	H	88.8	Confident	68.7	Low	94 Å²	94	90.2 Å²	90.2	44%	0.435	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	107.4	-174.7	-78.4	-169	0	0	0	110.3	P26 K30 L97	P26-H28 PolarHBondContact O-CD2 3.25Å; P26-H28 PolarHBondContact O-N 3.42Å; H28-K30 PolarHBondContact O-N 3.07Å; H28-L97 HydrophobicContact CB-CD1 3.39Å
29	I	88.9	Confident	71	Confident	14 Å²	14	84.9 Å²	84.9	7%	0.072	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	115.7	173.2	-53.5	-175.3	0	0	0	108.6	L60 F72 L80 L97 I98 A99 L101	I29-L60 HydrophobicContact CD1-CD1 3.67Å; I29-L60 HydrophobicContact CG2-CD1 4.47Å; I29-F72 HydrophobicContact CG2-CE1 3.67Å; I29-F72 HydrophobicContact CG2-CZ 4.04Å; I29-L80 HydrophobicContact CD1-CD1 4.34Å; I29-L97 WeakPolarHBondContact O-CD1 3.4Å; I29-I98 HydrophobicContact CB-CG1 4.22Å; I29-I98 HydrophobicContact CG2-CD1 3.76Å; I29-I98 HydrophobicContact CG2-CG1 3.68Å; I29-I98 VanDerWaalsContact O-CG1 3.28Å; I29-I98 WeakPolarHBondContact O-CG1 3.49Å; I29-I98 PolarHBondContact O-N 3.38Å; I29-A99 WeakPolarHBondContact CA-O 3.28Å; I29-A99 HydrophobicContact CB-CB 4.25Å; I29-A99 WeakPolarHBondContact CB-O 2.94Å; I29-A99 HydrophobicContact CD1-CB 4.16Å; I29-A99 PolarHBondContact N-O 3.17Å; I29-A99 PolarHBondContact O-N 3.47Å; I29-L101 HydrophobicContact CD1-CD1 3.56Å; I29-L101 HydrophobicContact CD1-CD2 4.36Å; I29-L101 HydrophobicContact CD1-CG 3.63Å; I29-L101 HydrophobicContact CG1-CD1 3.7Å; I29-L101 HydrophobicContact CG1-CG 3.94Å
30	K	91.1	Very high	73.3	Confident	122 Å²	122	82 Å²	82	53%	0.53	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	154.4	175.1	-64.7	174.5	-179.2	178.3	0	110.6	H28 P32 G95 S96 L97	H28-K30 PolarHBondContact O-N 3.07Å; K30-P32 VanDerWaalsContact O-CD 3.26Å; K30-P32 WeakPolarHBondContact O-CD 3.4Å; K30-G95 WeakPolarHBondContact CD-O 3.39Å; K30-S96 CarbonylContact C-O 3.47Å; K30-S96 WeakPolarHBondContact CA-O 3.34Å; K30-L97 HydrophobicContact CG-CD1 4.39Å
31	M	90.6	Very high	75.6	Confident	3 Å²	3	77 Å²	77	2%	0.015	39%	0.389	C	S	.	.			trans	-60	115.9	173	-176.8	61.8	88.7	0	0	109.8	M38 I43 V63 I92 G95 S96 I98	M31-M38 HydrophobicContact CG-CE 4.37Å; M31-M38 HydrophobicContact SD-CE 4.28Å; M31-I43 HydrophobicContact CE-CD1 4.38Å; M31-I43 HydrophobicContact CE-CG1 3.99Å; M31-V63 HydrophobicContact CE-CG1 4.35Å; M31-V63 HydrophobicContact SD-CG1 4.06Å; M31-V63 HydrophobicContact SD-CG2 4.39Å; M31-I92 HydrophobicContact CB-CG2 4.04Å; M31-I92 HydrophobicContact CE-CB 3.67Å; M31-I92 HydrophobicContact CE-CD1 3.73Å; M31-I92 HydrophobicContact CE-CG1 4.32Å; M31-I92 HydrophobicContact CE-CG2 3.68Å; M31-I92 HydrophobicContact CG-CG2 4.23Å; M31-G95 PolarHBondContact O-N 3.43Å; M31-S96 PolarHBondContact N-O 3.41Å; M31-I98 HydrophobicContact CB-CG2 3.9Å; M31-I98 HydrophobicContact CE-CG2 4.08Å
32	P	87.9	Confident	78.1	Confident	31 Å²	31	66.3 Å²	66.3	20%	0.201	35%	0.351	C	S	.	.			trans	-73.7	163.7	178.2	33.2	-39.7	0	0	0	111.8	K30 L34 F72	K30-P32 VanDerWaalsContact O-CD 3.26Å; K30-P32 WeakPolarHBondContact O-CD 3.4Å; P32-L34 HydrophobicContact CB-CD2 4.47Å; P32-L34 HydrophobicContact CB-CG 4.44Å; P32-L34 HydrophobicContact CG-CD1 4.21Å; P32-L34 HydrophobicContact CG-CD2 4.09Å; P32-L34 HydrophobicContact CG-CG 3.87Å; P32-L34 PolarHBondContact O-N 2.86Å; P32-F72 HydrophobicContact CB-CD2 4.42Å; P32-F72 HydrophobicContact CB-CE2 4.08Å; P32-F72 HydrophobicContact CG-CD2 3.59Å; P32-F72 HydrophobicContact CG-CE2 3.59Å; P32-F72 HydrophobicContact CG-CG 4.07Å; P32-F72 HydrophobicContact CG-CZ 4.07Å
33	S	88.2	Confident	80.6	Confident	85 Å²	85	58.1 Å²	58.1	59%	0.594	32%	0.315	S	S	*	.			trans	-90.2	97.3	165.5	54.8	0	0	0	0	109.2	S35	S33-S35 VanDerWaalsContact C-N 3.35Å
34	L	85.6	Confident	82.7	Confident	45 Å²	45	54.9 Å²	54.9	24%	0.236	30%	0.302	C	S	.	.			trans	-86.5	-7.3	-179.8	-65.9	169.2	0	0	0	113.1	P32 M38 V63 T65 I70 F72	P32-L34 HydrophobicContact CB-CD2 4.47Å; P32-L34 HydrophobicContact CB-CG 4.44Å; P32-L34 HydrophobicContact CG-CD1 4.21Å; P32-L34 HydrophobicContact CG-CD2 4.09Å; P32-L34 HydrophobicContact CG-CG 3.87Å; P32-L34 PolarHBondContact O-N 2.86Å; L34-M38 HydrophobicContact CB-SD 4.15Å; L34-M38 PolarHBondContact N-SD 2.98Å; L34-M38 VanDerWaalsContact N-SD 3.44Å; L34-V63 HydrophobicContact CD1-CB 3.65Å; L34-V63 HydrophobicContact CD1-CG1 3.99Å; L34-V63 HydrophobicContact CD1-CG2 4.06Å; L34-T65 HydrophobicContact CB-CG2 3.82Å; L34-I70 HydrophobicContact CB-CD1 4.06Å; L34-I70 HydrophobicContact CD1-CB 4.25Å; L34-I70 HydrophobicContact CD1-CG2 4.3Å; L34-I70 HydrophobicContact CD2-CG2 4.29Å; L34-F72 HydrophobicContact CD1-CB 4.48Å
35	S	80.5	Confident	84.5	Confident	4 Å²	4	53.8 Å²	53.8	3%	0.028	30%	0.299	C	S	.	.	S	Bend	trans	-136.2	144.6	169.3	-167	0	0	0	0	110	S33 T37 M38 K67	S33-S35 VanDerWaalsContact C-N 3.35Å; S35-T37 PolarHBondContact O-N 3.29Å; S35-T37 PolarHBondContact OG-OG1 3Å; S35-M38 VanDerWaalsContact O-CB 3.26Å; S35-M38 WeakPolarHBondContact O-CB 3.44Å; S35-M38 PolarHBondContact O-N 2.87Å; S35-K67 PolarHBondContact OG-NZ 2.76Å
36	P	78.1	Confident	85.7	Confident	125 Å²	125	47.1 Å²	47.1	81%	0.812	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-22.6	177	-25.9	34.2	0	0	0	114.2
37	T	75.2	Confident	86.3	Confident	71 Å²	71	48.8 Å²	48.8	44%	0.436	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.2	2.8	-178.5	50.9	0	0	0	0	113.7	S35 S39 D66 K67 R230	S35-T37 PolarHBondContact O-N 3.29Å; S35-T37 PolarHBondContact OG-OG1 3Å; T37-S39 PolarHBondContact O-N 2.83Å; T37-D66 PolarHBondContact OG1-OD2 3.28Å; T37-K67 WeakPolarHBondContact OG1-CE 3.37Å; T37-K67 PolarHBondContact OG1-NZ 3.24Å; T37-R230 VanDerWaalsContact CB-NH2 3.28Å; T37-R230 PolarHBondContact OG1-NH2 3.37Å
38	M	82	Confident	86.5	Confident	17 Å²	17	48.1 Å²	48.1	8%	0.084	27%	0.272	C	S	.	.			trans	-79.6	116	-173.3	-174.3	-177.8	176.8	0	0	111.1	M31 L34 S35 E40 V63 T65 V94	M31-M38 HydrophobicContact CG-CE 4.37Å; M31-M38 HydrophobicContact SD-CE 4.28Å; L34-M38 HydrophobicContact CB-SD 4.15Å; L34-M38 PolarHBondContact N-SD 2.98Å; L34-M38 VanDerWaalsContact N-SD 3.44Å; S35-M38 VanDerWaalsContact O-CB 3.26Å; S35-M38 WeakPolarHBondContact O-CB 3.44Å; S35-M38 PolarHBondContact O-N 2.87Å; M38-E40 WeakPolarHBondContact CG-O 3.34Å; M38-V63 HydrophobicContact CE-CG1 4.04Å; M38-T65 HydrophobicContact CE-CG2 4.29Å; M38-T65 HydrophobicContact SD-CG2 3.76Å; M38-V94 HydrophobicContact CE-CG2 4.43Å; M38-V94 HydrophobicContact CG-CG2 3.98Å; M38-V94 WeakPolarHBondContact O-CG2 3.33Å; M38-V94 HydrophobicContact SD-CG2 4.39Å
39	S	83.5	Confident	86.5	Confident	74 Å²	74	48.8 Å²	48.8	52%	0.517	28%	0.279	S	S	.	.	S	Bend	trans	-98.3	-29.9	168.3	56.4	0	0	0	0	112.2	T37 V94	T37-S39 PolarHBondContact O-N 2.83Å; S39-V94 PolarHBondContact O-N 3.05Å
40	E	87	Confident	86.5	Confident	66 Å²	66	51.7 Å²	51.7	31%	0.308	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	152	-177.8	56	-173.8	158.6	0	0	111.7	M38 N91 I92	M38-E40 WeakPolarHBondContact CG-O 3.34Å; E40-N91 WeakPolarHBondContact OE2-CB 3.4Å; E40-N91 PolarHBondContact OE2-OD1 3Å; E40-I92 CarbonylContact C-O 3.53Å; E40-I92 VanDerWaalsContact CA-O 3.27Å; E40-I92 WeakPolarHBondContact CA-O 3.35Å
41	G	85.6	Confident	86.3	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	160.4	-179.3	0	0	0	0	0	113.3	N91 I92	G41-N91 PolarHBondContact O-N 2.87Å; G41-I92 PolarHBondContact N-O 3.49Å; G41-I92 WeakPolarHBondContact O-CB 3.2Å; G41-I92 PolarHBondContact O-N 3.2Å
42	S	87.4	Confident	86.1	Confident	10 Å²	10	50.6 Å²	50.6	7%	0.07	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	139.7	172.2	-72.5	0	0	0	0	110.4	V63 Q64 S89 S90 N222	S42-V63 CarbonylContact O-C 3.56Å; S42-V63 WeakPolarHBondContact O-CA 3.31Å; S42-Q64 PolarHBondContact N-O 2.88Å; S42-Q64 PolarHBondContact O-N 3.27Å; S42-S89 WeakPolarHBondContact CA-O 3.28Å; S42-S90 WeakPolarHBondContact OG-CA 3.24Å; S42-N222 PolarHBondContact OG-ND2 3.31Å
43	I	89.9	Confident	86.1	Confident	2 Å²	2	54.8 Å²	54.8	1%	0.01	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	114.9	175.8	-59.7	169.7	0	0	0	108.8	M31 W46 C61 A85 G88 S89 I92 I98	M31-I43 HydrophobicContact CE-CD1 4.38Å; M31-I43 HydrophobicContact CE-CG1 3.99Å; I43-W46 HydrophobicContact CD1-CZ2 3.96Å; I43-W46 HydrophobicContact CG2-CG 4.47Å; I43-C61 HydrophobicContact CG2-CB 4.18Å; I43-A85 HydrophobicContact CD1-CB 3.63Å; I43-G88 WeakPolarHBondContact O-CA 3.45Å; I43-G88 PolarHBondContact O-N 3.06Å; I43-S89 PolarHBondContact N-O 3Å; I43-S89 VanDerWaalsContact N-O 3.09Å; I43-I92 HydrophobicContact CD1-CD1 3.62Å; I43-I92 HydrophobicContact CG1-CD1 3.84Å; I43-I98 HydrophobicContact CD1-CB 4.5Å; I43-I98 HydrophobicContact CD1-CG2 4.37Å
44	V	87.1	Confident	86.1	Confident	62 Å²	62	51 Å²	51	38%	0.376	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	-50.2	-178	-178.4	0	0	0	0	110.7	E62 Q64 V69 T87	V44-E62 HydrophobicContact CB-CB 4.28Å; V44-E62 PolarHBondContact N-O 3.47Å; V44-Q64 HydrophobicContact CG2-CB 3.46Å; V44-Q64 VanDerWaalsContact CG2-CB 3.46Å; V44-V69 HydrophobicContact CG2-CG1 4.11Å; V44-V69 HydrophobicContact CG2-CG2 4.4Å; V44-T87 WeakPolarHBondContact O-CG2 3.42Å
45	N	90.6	Very high	86.1	Confident	73 Å²	73	51 Å²	51	39%	0.39	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	140.6	-176.9	-169.2	27.9	0	0	0	111	C61 E62	N45-C61 CarbonylContact O-C 3.59Å; N45-C61 VanDerWaalsContact O-CA 3.26Å; N45-C61 WeakPolarHBondContact O-CA 3.49Å; N45-C61 VanDerWaalsContact O-CB 3.27Å; N45-C61 WeakPolarHBondContact O-CB 3.26Å; N45-E62 PolarHBondContact O-N 3.45Å
46	W	90.9	Very high	86.5	Confident	17 Å²	17	53.4 Å²	53.4	6%	0.064	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	128.7	169	-80.8	93.1	0	0	0	108.8	I43 L60 C61 L80 I83 A85 A99	I43-W46 HydrophobicContact CD1-CZ2 3.96Å; I43-W46 HydrophobicContact CG2-CG 4.47Å; W46-L60 HydrophobicContact CZ3-CB 4.21Å; W46-C61 HydrophobicContact CD2-CB 3.73Å; W46-C61 HydrophobicContact CE3-CB 3.72Å; W46-C61 HydrophobicContact CG-CB 4.14Å; W46-C61 HydrophobicContact CZ3-CB 4.12Å; W46-L80 HydrophobicContact CE3-CD2 4.41Å; W46-L80 HydrophobicContact CZ3-CD2 4.32Å; W46-I83 HydrophobicContact CD2-CD1 3.8Å; W46-I83 HydrophobicContact CD2-CG1 4.25Å; W46-I83 HydrophobicContact CD2-CG2 4.29Å; W46-I83 HydrophobicContact CE3-CD1 4Å; W46-I83 HydrophobicContact CE3-CG1 4.29Å; W46-I83 HydrophobicContact CG-CD1 4.02Å; W46-I83 HydrophobicContact CH2-CG1 4.43Å; W46-I83 HydrophobicContact CH2-CG2 4.48Å; W46-I83 HydrophobicContact CZ2-CG1 4.35Å; W46-I83 HydrophobicContact CZ2-CG2 3.67Å; W46-I83 HydrophobicContact CZ3-CG1 4.38Å; W46-A85 PolarHBondContact NE1-O 3.13Å; W46-A99 HydrophobicContact CH2-CB 3.76Å; W46-A99 HydrophobicContact CZ2-CB 4.48Å; W46-A99 HydrophobicContact CZ3-CB 4.45Å
47	V	89.6	Confident	86.9	Confident	71 Å²	71	49.6 Å²	49.6	43%	0.43	30%	0.301	S	S	.	.	S	Bend	trans	-86.7	-39.1	176.7	-179.5	0	0	0	0	109.9	V59 L60	V47-V59 HydrophobicContact CG2-CG1 4.05Å; V47-L60 PolarHBondContact N-O 3.3Å
48	K	89	Confident	87.6	Confident	25 Å²	25	48.9 Å²	48.9	11%	0.109	30%	0.295	C	S	.	.	S	Bend	trans	-95.3	141.4	177.9	-67.2	-70.9	-170.9	163.1	0	111.9	E52 D53 V54 D58 L60 L80	K48-E52 HydrophobicContact CD-CB 4.46Å; K48-E52 HydrophobicContact CD-CG 4.06Å; K48-E52 WeakPolarHBondContact CD-OE1 3.42Å; K48-E52 WeakPolarHBondContact CD-OE2 3.16Å; K48-E52 WeakPolarHBondContact CE-OE1 3.29Å; K48-E52 IonicContact NZ-OE1 3.33Å; K48-E52 PolarHBondContact NZ-OE1 2.99Å; K48-D53 PolarHBondContact NZ-O 3.03Å; K48-V54 HydrophobicContact CG-CG2 4.36Å; K48-D58 IonicContact NZ-OD2 2.65Å; K48-D58 PolarHBondContact NZ-OD2 3.43Å; K48-L60 HydrophobicContact CB-CD2 4.48Å; K48-L60 HydrophobicContact CG-CD2 4.27Å; K48-L60 PolarHBondContact N-O 2.95Å; K48-L80 HydrophobicContact CB-CD2 4.02Å
49	N	88.3	Confident	88	Confident	108 Å²	108	50.3 Å²	50.3	58%	0.578	30%	0.304	S	S	*	.	P	Polyproline II helix	trans	-100.6	161.5	178	-64.3	-67.8	0	0	0	112.6	G51 E52	N49-G51 PolarHBondContact O-N 2.95Å; N49-E52 PolarHBondContact N-OE2 3.14Å; N49-E52 WeakPolarHBondContact O-CB 3.31Å; N49-E52 PolarHBondContact O-N 2.97Å; N49-E52 VanDerWaalsContact O-N 3.15Å
50	E	89.6	Confident	88.3	Confident	74 Å²	74	46.8 Å²	46.8	35%	0.346	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	126.9	172.7	-59.2	-174.2	159.7	0	0	110.6	L80 K82 I83	E50-L80 CarbonylContact C-O 3.55Å; E50-L80 WeakPolarHBondContact CA-O 3.25Å; E50-K82 VanDerWaalsContact OE1-CD 3.28Å; E50-K82 WeakPolarHBondContact OE1-CD 3.47Å; E50-K82 WeakPolarHBondContact OE1-CE 3.32Å; E50-K82 IonicContact OE1-NZ 2.78Å; E50-K82 PolarHBondContact OE1-NZ 3.43Å; E50-K82 IonicContact OE2-NZ 2.82Å; E50-K82 PolarHBondContact OE2-NZ 3.42Å; E50-I83 HydrophobicContact CG-CB 4.46Å; E50-I83 HydrophobicContact CG-CD1 4.09Å; E50-I83 HydrophobicContact CG-CG1 4.05Å; E50-I83 PolarHBondContact OE1-N 3.48Å
51	G	85.5	Confident	88.5	Confident	31 Å²	31	43.7 Å²	43.7	32%	0.32	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.2	-0.3	-177.6	0	0	0	0	0	115.2	N49 L80	N49-G51 PolarHBondContact O-N 2.95Å; G51-L80 PolarHBondContact N-O 3.46Å
52	E	87.6	Confident	88.7	Confident	71 Å²	71	47.2 Å²	47.2	33%	0.332	28%	0.282	S	S	.	.			trans	-85.3	144.8	177.8	-159.5	-179.7	156.1	0	0	112.1	K48 N49 L80	K48-E52 HydrophobicContact CD-CB 4.46Å; K48-E52 HydrophobicContact CD-CG 4.06Å; K48-E52 WeakPolarHBondContact CD-OE1 3.42Å; K48-E52 WeakPolarHBondContact CD-OE2 3.16Å; K48-E52 WeakPolarHBondContact CE-OE1 3.29Å; K48-E52 IonicContact NZ-OE1 3.33Å; K48-E52 PolarHBondContact NZ-OE1 2.99Å; N49-E52 PolarHBondContact N-OE2 3.14Å; N49-E52 WeakPolarHBondContact O-CB 3.31Å; N49-E52 PolarHBondContact O-N 2.97Å; N49-E52 VanDerWaalsContact O-N 3.15Å; E52-L80 PolarHBondContact O-N 3.37Å
53	D	87	Confident	88.8	Confident	119 Å²	119	46.8 Å²	46.8	64%	0.636	28%	0.278	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.3	133.8	172.3	-65	-33.6	0	0	0	110.2	K48 V79	K48-D53 PolarHBondContact NZ-O 3.03Å; D53-V79 WeakPolarHBondContact OD1-CG2 3.16Å
54	V	87.8	Confident	88.6	Confident	6 Å²	6	49.2 Å²	49.2	4%	0.036	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	120	177.7	178.6	0	0	0	0	108	K48 D58 L60 E77 G78 L80 L101	K48-V54 HydrophobicContact CG-CG2 4.36Å; V54-D58 HydrophobicContact CG1-CB 4.23Å; V54-L60 HydrophobicContact CB-CD2 4.41Å; V54-L60 HydrophobicContact CG1-CD2 3.71Å; V54-L60 HydrophobicContact CG2-CD2 3.76Å; V54-E77 WeakPolarHBondContact O-CA 3.44Å; V54-G78 PolarHBondContact N-O 3.34Å; V54-G78 PolarHBondContact O-N 3.28Å; V54-L80 HydrophobicContact CG2-CB 4.27Å; V54-L101 HydrophobicContact CB-CD2 4.14Å; V54-L101 HydrophobicContact CG2-CD2 4.1Å
55	A	86.8	Confident	88.5	Confident	45 Å²	45	46.4 Å²	46.4	37%	0.372	27%	0.273	S	S	.	.			trans	-90.8	159.4	169.5	0	0	0	0	0	111.2	G57 D58	A55-G57 PolarHBondContact O-N 3.45Å; A55-D58 PolarHBondContact N-OD2 3.33Å; A55-D58 VanDerWaalsContact N-OD2 3.17Å; A55-D58 WeakPolarHBondContact O-CB 3.35Å; A55-D58 PolarHBondContact O-N 2.9Å
56	A	88	Confident	87.8	Confident	55 Å²	55	43.8 Å²	43.8	46%	0.455	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	124.4	170.2	0	0	0	0	0	110	S74 E77	A56-S74 CarbonylContact C-O 3.6Å; A56-S74 WeakPolarHBondContact CA-O 3.31Å; A56-E77 HydrophobicContact CB-CG 4.04Å
57	G	87	Confident	87	Confident	44 Å²	44	44 Å²	44	45%	0.454	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.6	-3.2	-173.8	0	0	0	0	0	115.1	A55 S74	A55-G57 PolarHBondContact O-N 3.45Å; G57-S74 PolarHBondContact N-O 3.28Å
58	D	89.3	Confident	86.6	Confident	56 Å²	56	41.3 Å²	41.3	30%	0.299	25%	0.245	S	C	.	.			trans	-74.1	138.1	175.2	-82.9	-3.4	0	0	0	111.4	K48 V54 A55 L60 E73 S74	K48-D58 IonicContact NZ-OD2 2.65Å; K48-D58 PolarHBondContact NZ-OD2 3.43Å; V54-D58 HydrophobicContact CG1-CB 4.23Å; A55-D58 PolarHBondContact N-OD2 3.33Å; A55-D58 VanDerWaalsContact N-OD2 3.17Å; A55-D58 WeakPolarHBondContact O-CB 3.35Å; A55-D58 PolarHBondContact O-N 2.9Å; D58-L60 PolarHBondContact O-N 2.96Å; D58-E73 CarbonylContact O-C 3.54Å; D58-E73 WeakPolarHBondContact O-CA 3.36Å; D58-S74 PolarHBondContact O-N 3.43Å
59	V	90.7	Very high	86.4	Confident	48 Å²	48	43.9 Å²	43.9	29%	0.291	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	119.1	174	-179.9	0	0	0	0	110.1	V47 A71 E73	V47-V59 HydrophobicContact CG2-CG1 4.05Å; V59-A71 HydrophobicContact CG1-CB 3.86Å; V59-A71 HydrophobicContact CG2-CB 4.34Å; V59-E73 HydrophobicContact CG2-CG 3.95Å
60	L	90.4	Very high	86.5	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	-53.3	179.2	-69.9	174.1	0	0	0	112.2	I29 W46 V47 K48 V54 D58 F72	I29-L60 HydrophobicContact CD1-CD1 3.67Å; I29-L60 HydrophobicContact CG2-CD1 4.47Å; W46-L60 HydrophobicContact CZ3-CB 4.21Å; V47-L60 PolarHBondContact N-O 3.3Å; K48-L60 HydrophobicContact CB-CD2 4.48Å; K48-L60 HydrophobicContact CG-CD2 4.27Å; K48-L60 PolarHBondContact N-O 2.95Å; V54-L60 HydrophobicContact CB-CD2 4.41Å; V54-L60 HydrophobicContact CG1-CD2 3.71Å; V54-L60 HydrophobicContact CG2-CD2 3.76Å; D58-L60 PolarHBondContact O-N 2.96Å; L60-F72 HydrophobicContact CB-CD1 4.27Å; L60-F72 HydrophobicContact CD1-CD1 4Å; L60-F72 HydrophobicContact CD1-CE1 3.65Å; L60-F72 HydrophobicContact CD1-CZ 4.34Å; L60-F72 PolarHBondContact N-O 3.39Å
61	C	90.3	Very high	86.5	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	161.2	-174.8	65	0	0	0	0	111.8	I43 N45 W46 F72	I43-C61 HydrophobicContact CG2-CB 4.18Å; N45-C61 CarbonylContact O-C 3.59Å; N45-C61 VanDerWaalsContact O-CA 3.26Å; N45-C61 WeakPolarHBondContact O-CA 3.49Å; N45-C61 VanDerWaalsContact O-CB 3.27Å; N45-C61 WeakPolarHBondContact O-CB 3.26Å; W46-C61 HydrophobicContact CD2-CB 3.73Å; W46-C61 HydrophobicContact CE3-CB 3.72Å; W46-C61 HydrophobicContact CG-CB 4.14Å; W46-C61 HydrophobicContact CZ3-CB 4.12Å; C61-F72 PolarHBondContact O-N 2.93Å
62	E	90.5	Very high	86.8	Confident	75 Å²	75	38.9 Å²	38.9	35%	0.35	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	120.6	172	-66.7	176.3	-178.1	0	0	109.3	V44 N45 V69	V44-E62 HydrophobicContact CB-CB 4.28Å; V44-E62 PolarHBondContact N-O 3.47Å; N45-E62 PolarHBondContact O-N 3.45Å; E62-V69 HydrophobicContact CB-CG1 4.08Å
63	V	89	Confident	87	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	123.1	-179	-179.1	0	0	0	0	109.3	M31 L34 M38 S42 T65 V69 I70 F72	M31-V63 HydrophobicContact CE-CG1 4.35Å; M31-V63 HydrophobicContact SD-CG1 4.06Å; M31-V63 HydrophobicContact SD-CG2 4.39Å; L34-V63 HydrophobicContact CD1-CB 3.65Å; L34-V63 HydrophobicContact CD1-CG1 3.99Å; L34-V63 HydrophobicContact CD1-CG2 4.06Å; M38-V63 HydrophobicContact CE-CG1 4.04Å; S42-V63 CarbonylContact O-C 3.56Å; S42-V63 WeakPolarHBondContact O-CA 3.31Å; V63-T65 PolarHBondContact O-N 3.43Å; V63-V69 WeakPolarHBondContact O-CA 3.49Å; V63-I70 PolarHBondContact N-O 2.9Å; V63-I70 PolarHBondContact O-N 3Å; V63-F72 HydrophobicContact CG2-CB 4.09Å
64	Q	85.7	Confident	87	Confident	54 Å²	54	35.4 Å²	35.4	25%	0.252	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	114.2	168.8	-178.7	172	24.2	0	0	109.4	S42 V44 V69	S42-Q64 PolarHBondContact N-O 2.88Å; S42-Q64 PolarHBondContact O-N 3.27Å; V44-Q64 HydrophobicContact CG2-CB 3.46Å; V44-Q64 VanDerWaalsContact CG2-CB 3.46Å; Q64-V69 HydrophobicContact CB-CG2 4.19Å; Q64-V69 HydrophobicContact CG-CG2 4.23Å
65	T	85	Confident	87	Confident	2 Å²	2	42.1 Å²	42.1	1%	0.012	25%	0.253	C	S	.	.			trans	-88.6	-177.3	170.3	68.4	0	0	0	0	110.7	L34 M38 V63 K67 A68 I70	L34-T65 HydrophobicContact CB-CG2 3.82Å; M38-T65 HydrophobicContact CE-CG2 4.29Å; M38-T65 HydrophobicContact SD-CG2 3.76Å; V63-T65 PolarHBondContact O-N 3.43Å; T65-K67 PolarHBondContact O-N 3.38Å; T65-K67 PolarHBondContact OG1-N 2.91Å; T65-A68 PolarHBondContact N-O 3.31Å; T65-A68 PolarHBondContact OG1-N 3.42Å; T65-A68 PolarHBondContact OG1-O 2.74Å; T65-I70 HydrophobicContact CG2-CD1 3.99Å
66	D	76.7	Confident	86.9	Confident	19 Å²	19	45 Å²	45	10%	0.102	26%	0.259	C	S	.	.	S	Bend	trans	-63.7	-22	170.3	59.9	-21.3	0	0	0	114	T37 S226 R230	T37-D66 PolarHBondContact OG1-OD2 3.28Å; D66-S226 WeakPolarHBondContact CB-OG 3.43Å; D66-R230 IonicContact OD2-CZ 3.17Å; D66-R230 IonicContact OD2-NH1 3.89Å; D66-R230 IonicContact OD2-NH2 3.65Å; D66-R230 PolarHBondContact OD2-NH2 3.28Å
67	K	74.1	Confident	86.8	Confident	20 Å²	20	49 Å²	49	9%	0.087	27%	0.268	C	S	.	.	S	Bend	trans	-112.9	-43.6	-173.7	-68.8	175.7	-172.2	164.3	0	114	S35 T37 T65 L353 D354	S35-K67 PolarHBondContact OG-NZ 2.76Å; T37-K67 WeakPolarHBondContact OG1-CE 3.37Å; T37-K67 PolarHBondContact OG1-NZ 3.24Å; T65-K67 PolarHBondContact O-N 3.38Å; T65-K67 PolarHBondContact OG1-N 2.91Å; K67-L353 HydrophobicContact CB-CD1 4.15Å; K67-D354 WeakPolarHBondContact CE-OD1 3.42Å; K67-D354 IonicContact NZ-OD1 2.86Å; K67-D354 PolarHBondContact NZ-OD1 3.07Å; K67-D354 IonicContact NZ-OD2 3.54Å; K67-D354 PolarHBondContact NZ-OD2 2.92Å
68	A	80.3	Confident	86.7	Confident	15 Å²	15	47.3 Å²	47.3	12%	0.124	25%	0.251	C	S	.	.			trans	-152.4	165.5	-173.7	0	0	0	0	0	111.8	T65 I70	T65-A68 PolarHBondContact N-O 3.31Å; T65-A68 PolarHBondContact OG1-N 3.42Å; T65-A68 PolarHBondContact OG1-O 2.74Å; A68-I70 HydrophobicContact CB-CG1 4.33Å
69	V	85.7	Confident	86.6	Confident	79 Å²	79	45.7 Å²	45.7	48%	0.479	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	123.2	166.4	-176.6	0	0	0	0	107.6	V44 E62 V63 Q64	V44-V69 HydrophobicContact CG2-CG1 4.11Å; V44-V69 HydrophobicContact CG2-CG2 4.4Å; E62-V69 HydrophobicContact CB-CG1 4.08Å; V63-V69 WeakPolarHBondContact O-CA 3.49Å; Q64-V69 HydrophobicContact CB-CG2 4.19Å; Q64-V69 HydrophobicContact CG-CG2 4.23Å
70	I	89.3	Confident	86.4	Confident	34 Å²	34	43.4 Å²	43.4	17%	0.174	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	136.4	-173.9	-58.1	173.6	0	0	0	108.5	L34 V63 T65 A68 P350	L34-I70 HydrophobicContact CB-CD1 4.06Å; L34-I70 HydrophobicContact CD1-CB 4.25Å; L34-I70 HydrophobicContact CD1-CG2 4.3Å; L34-I70 HydrophobicContact CD2-CG2 4.29Å; V63-I70 PolarHBondContact N-O 2.9Å; V63-I70 PolarHBondContact O-N 3Å; T65-I70 HydrophobicContact CG2-CD1 3.99Å; A68-I70 HydrophobicContact CB-CG1 4.33Å; I70-P350 HydrophobicContact CD1-CG 3.75Å; I70-P350 HydrophobicContact CG1-CG 4.41Å
71	A	90.4	Very high	86.2	Confident	49 Å²	49	43.4 Å²	43.4	41%	0.405	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	128.4	172.8	0	0	0	0	0	110.1	V59	V59-A71 HydrophobicContact CG1-CB 3.86Å; V59-A71 HydrophobicContact CG2-CB 4.34Å
72	F	91.1	Very high	86.1	Confident	25 Å²	25	46.5 Å²	46.5	11%	0.11	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	118	175.5	174.4	-133.2	0	0	0	110.4	I29 P32 L34 L60 C61 V63 I98	I29-F72 HydrophobicContact CG2-CE1 3.67Å; I29-F72 HydrophobicContact CG2-CZ 4.04Å; P32-F72 HydrophobicContact CB-CD2 4.42Å; P32-F72 HydrophobicContact CB-CE2 4.08Å; P32-F72 HydrophobicContact CG-CD2 3.59Å; P32-F72 HydrophobicContact CG-CE2 3.59Å; P32-F72 HydrophobicContact CG-CG 4.07Å; P32-F72 HydrophobicContact CG-CZ 4.07Å; L34-F72 HydrophobicContact CD1-CB 4.48Å; L60-F72 HydrophobicContact CB-CD1 4.27Å; L60-F72 HydrophobicContact CD1-CD1 4Å; L60-F72 HydrophobicContact CD1-CE1 3.65Å; L60-F72 HydrophobicContact CD1-CZ 4.34Å; L60-F72 PolarHBondContact N-O 3.39Å; C61-F72 PolarHBondContact O-N 2.93Å; V63-F72 HydrophobicContact CG2-CB 4.09Å; F72-I98 HydrophobicContact CD1-CD1 4.31Å; F72-I98 HydrophobicContact CE1-CD1 3.99Å
73	E	91.4	Very high	86	Confident	112 Å²	112	44.2 Å²	44.2	52%	0.523	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	142.3	178.1	-65.4	171.9	-173.2	0	0	110.9	D58 V59	D58-E73 CarbonylContact O-C 3.54Å; D58-E73 WeakPolarHBondContact O-CA 3.36Å; V59-E73 HydrophobicContact CG2-CG 3.95Å
74	S	88.1	Confident	85.8	Confident	5 Å²	5	46.3 Å²	46.3	4%	0.035	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-82.6	129.6	175.8	-167.8	0	0	0	0	111.2	A56 G57 D58 E76	A56-S74 CarbonylContact C-O 3.6Å; A56-S74 WeakPolarHBondContact CA-O 3.31Å; G57-S74 PolarHBondContact N-O 3.28Å; D58-S74 PolarHBondContact O-N 3.43Å; S74-E76 VanDerWaalsContact C-N 3.33Å; S74-E76 PolarHBondContact OG-N 3.45Å; S74-E76 PolarHBondContact OG-O 3.04Å
75	D	86.3	Confident	85.8	Confident	147 Å²	147	44.2 Å²	44.2	79%	0.786	24%	0.235	S	C	*	.	S	Bend	trans	-81.9	-16.6	168.1	-66.2	-38	0	0	0	112.6
76	E	85.1	Confident	85.8	Confident	107 Å²	107	47.9 Å²	47.9	50%	0.5	26%	0.259	S	S	.	.	S	Bend	trans	-109.5	144.6	-170.7	-63.3	-75.8	177.4	0	0	111.2	V27 S74 L101	V27-E76 HydrophobicContact CG1-CB 4.08Å; V27-E76 HydrophobicContact CG1-CG 3.88Å; S74-E76 VanDerWaalsContact C-N 3.33Å; S74-E76 PolarHBondContact OG-N 3.45Å; S74-E76 PolarHBondContact OG-O 3.04Å; E76-L101 HydrophobicContact CB-CD1 3.99Å
77	E	85.7	Confident	86.2	Confident	139 Å²	139	50.7 Å²	50.7	65%	0.65	28%	0.277	S	S	*	.			trans	-94.4	136.3	176.3	-63.6	177.6	178	0	0	110.8	V54 A56	V54-E77 WeakPolarHBondContact O-CA 3.44Å; A56-E77 HydrophobicContact CB-CG 4.04Å
78	G	86.1	Confident	86.6	Confident	8 Å²	8	52.5 Å²	52.5	8%	0.082	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	168.2	-173	176.8	0	0	0	0	0	113.9	V54 A102	V54-G78 PolarHBondContact N-O 3.34Å; V54-G78 PolarHBondContact O-N 3.28Å; G78-A102 WeakPolarHBondContact CA-O 3.32Å
79	V	86.5	Confident	86.6	Confident	22 Å²	22	53.3 Å²	53.3	13%	0.133	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	128.7	174.3	-173.7	0	0	0	0	108.8	D53 A81 L101 A102 W108	D53-V79 WeakPolarHBondContact OD1-CG2 3.16Å; V79-A81 PolarHBondContact O-N 3.21Å; V79-L101 CarbonylContact O-C 3.53Å; V79-L101 WeakPolarHBondContact O-CA 3.38Å; V79-A102 PolarHBondContact N-O 2.66Å; V79-A102 PolarHBondContact O-N 3.07Å; V79-W108 HydrophobicContact CB-CB 4.37Å; V79-W108 HydrophobicContact CG1-CB 3.91Å; V79-W108 HydrophobicContact CG1-CG 4.2Å
80	L	87.7	Confident	86.4	Confident	0 Å²	0	53 Å²	53	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	97.2	178.7	-170.6	66.5	0	0	0	110.3	I29 W46 K48 E50 G51 E52 V54 I83 A99 L101	I29-L80 HydrophobicContact CD1-CD1 4.34Å; W46-L80 HydrophobicContact CE3-CD2 4.41Å; W46-L80 HydrophobicContact CZ3-CD2 4.32Å; K48-L80 HydrophobicContact CB-CD2 4.02Å; E50-L80 CarbonylContact C-O 3.55Å; E50-L80 WeakPolarHBondContact CA-O 3.25Å; G51-L80 PolarHBondContact N-O 3.46Å; E52-L80 PolarHBondContact O-N 3.37Å; V54-L80 HydrophobicContact CG2-CB 4.27Å; L80-I83 HydrophobicContact CD2-CD1 4.06Å; L80-I83 HydrophobicContact CD2-CG1 3.97Å; L80-I83 HydrophobicContact CG-CG1 4.44Å; L80-A99 HydrophobicContact CD1-CB 3.89Å; L80-L101 HydrophobicContact CD1-CD2 4.34Å
81	A	86.2	Confident	85.9	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	-49	-170.6	0	0	0	0	0	112.6	V79 V100 A102 W108 V111 A112	V79-A81 PolarHBondContact O-N 3.21Å; A81-V100 WeakPolarHBondContact CB-O 3.5Å; A81-V100 PolarHBondContact N-O 3.45Å; A81-A102 HydrophobicContact CB-CB 4.07Å; A81-W108 HydrophobicContact CB-CB 4.31Å; A81-V111 HydrophobicContact CB-CB 3.96Å; A81-V111 HydrophobicContact CB-CG1 3.8Å; A81-A112 WeakPolarHBondContact O-CB 3.47Å
82	K	86.8	Confident	85.7	Confident	65 Å²	65	53.5 Å²	53.5	28%	0.283	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	133.1	-179	-167.1	73.9	-160.9	149.1	0	111.8	E50 L84 A99 V100 A112 A115	E50-K82 VanDerWaalsContact OE1-CD 3.28Å; E50-K82 WeakPolarHBondContact OE1-CD 3.47Å; E50-K82 WeakPolarHBondContact OE1-CE 3.32Å; E50-K82 IonicContact OE1-NZ 2.78Å; E50-K82 PolarHBondContact OE1-NZ 3.43Å; E50-K82 IonicContact OE2-NZ 2.82Å; E50-K82 PolarHBondContact OE2-NZ 3.42Å; K82-L84 HydrophobicContact CG-CD2 4.34Å; K82-A99 WeakPolarHBondContact O-CA 3.45Å; K82-V100 PolarHBondContact N-O 3.39Å; K82-V100 PolarHBondContact O-N 2.89Å; K82-A112 HydrophobicContact CB-CB 4.1Å; K82-A112 HydrophobicContact CD-CB 4.22Å; K82-A115 HydrophobicContact CB-CB 4.22Å
83	I	88.3	Confident	85.6	Confident	27 Å²	27	59.8 Å²	59.8	14%	0.138	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	117.5	168.7	-63.2	168.5	0	0	0	107.4	W46 E50 L80 A85	W46-I83 HydrophobicContact CD2-CD1 3.8Å; W46-I83 HydrophobicContact CD2-CG1 4.25Å; W46-I83 HydrophobicContact CD2-CG2 4.29Å; W46-I83 HydrophobicContact CE3-CD1 4Å; W46-I83 HydrophobicContact CE3-CG1 4.29Å; W46-I83 HydrophobicContact CG-CD1 4.02Å; W46-I83 HydrophobicContact CH2-CG1 4.43Å; W46-I83 HydrophobicContact CH2-CG2 4.48Å; W46-I83 HydrophobicContact CZ2-CG1 4.35Å; W46-I83 HydrophobicContact CZ2-CG2 3.67Å; W46-I83 HydrophobicContact CZ3-CG1 4.38Å; E50-I83 HydrophobicContact CG-CB 4.46Å; E50-I83 HydrophobicContact CG-CD1 4.09Å; E50-I83 HydrophobicContact CG-CG1 4.05Å; E50-I83 PolarHBondContact OE1-N 3.48Å; L80-I83 HydrophobicContact CD2-CD1 4.06Å; L80-I83 HydrophobicContact CD2-CG1 3.97Å; L80-I83 HydrophobicContact CG-CG1 4.44Å; I83-A85 WeakPolarHBondContact CG2-O 3.39Å
84	L	85.5	Confident	85.5	Confident	44 Å²	44	57 Å²	57	23%	0.23	32%	0.321	C	S	.	.	S	Bend	trans	-87.8	-29.7	177.9	-63.9	174.5	0	0	0	111.7	K82 P86 L97 I98 V100 A115	K82-L84 HydrophobicContact CG-CD2 4.34Å; L84-P86 WeakPolarHBondContact O-CD 3.24Å; L84-L97 HydrophobicContact CD1-CB 4.25Å; L84-L97 HydrophobicContact CD1-CD2 3.34Å; L84-L97 HydrophobicContact CD1-CG 3.63Å; L84-I98 PolarHBondContact N-O 3.03Å; L84-V100 HydrophobicContact CD1-CG2 4.16Å; L84-A115 HydrophobicContact CD2-CB 4.38Å
85	A	85.3	Confident	85.5	Confident	9 Å²	9	58.6 Å²	58.6	7%	0.074	34%	0.339	C	S	.	.	S	Bend	trans	-109.7	94.7	177.3	0	0	0	0	0	110	I43 W46 I83 I92 I98	I43-A85 HydrophobicContact CD1-CB 3.63Å; W46-A85 PolarHBondContact NE1-O 3.13Å; I83-A85 WeakPolarHBondContact CG2-O 3.39Å; A85-I92 HydrophobicContact CB-CD1 3.68Å; A85-I98 HydrophobicContact CB-CB 4.34Å; A85-I98 HydrophobicContact CB-CG2 4.3Å; A85-I98 PolarHBondContact N-O 2.69Å; A85-I98 VanDerWaalsContact N-O 3.15Å
86	P	85.5	Confident	85.6	Confident	79 Å²	79	53.6 Å²	53.6	51%	0.513	32%	0.315	S	S	.	.			trans	-63.9	162.7	-177.6	26.5	-35	0	0	0	112.4	L84 G88 S89	L84-P86 WeakPolarHBondContact O-CD 3.24Å; P86-G88 PolarHBondContact O-N 3.28Å; P86-S89 VanDerWaalsContact CD-OG 3.25Å; P86-S89 WeakPolarHBondContact CD-OG 3.25Å; P86-S89 VanDerWaalsContact O-CB 3.24Å; P86-S89 WeakPolarHBondContact O-CB 3.2Å; P86-S89 PolarHBondContact O-N 3.41Å; P86-S89 PolarHBondContact O-OG 3.43Å
87	T	85.1	Confident	85.8	Confident	79 Å²	79	51 Å²	51	49%	0.485	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.3	130.7	174.4	-51.1	0	0	0	0	111.4	V44	V44-T87 WeakPolarHBondContact O-CG2 3.42Å
88	G	81.7	Confident	86	Confident	58 Å²	58	44.3 Å²	44.3	60%	0.598	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.8	0.8	-176.9	0	0	0	0	0	114.9	I43 P86 S90	I43-G88 WeakPolarHBondContact O-CA 3.45Å; I43-G88 PolarHBondContact O-N 3.06Å; P86-G88 PolarHBondContact O-N 3.28Å; G88-S90 PolarHBondContact O-N 3.01Å
89	S	80.9	Confident	86.1	Confident	31 Å²	31	44 Å²	44	22%	0.217	27%	0.269	C	S	.	.			trans	-65.5	118.2	173.2	-63.2	0	0	0	0	110.8	S42 I43 P86	S42-S89 WeakPolarHBondContact CA-O 3.28Å; I43-S89 PolarHBondContact N-O 3Å; I43-S89 VanDerWaalsContact N-O 3.09Å; P86-S89 VanDerWaalsContact CD-OG 3.25Å; P86-S89 WeakPolarHBondContact CD-OG 3.25Å; P86-S89 VanDerWaalsContact O-CB 3.24Å; P86-S89 WeakPolarHBondContact O-CB 3.2Å; P86-S89 PolarHBondContact O-N 3.41Å; P86-S89 PolarHBondContact O-OG 3.43Å
90	S	80.7	Confident	86.2	Confident	73 Å²	73	43 Å²	43	51%	0.51	26%	0.264	S	S	.	.			trans	-101.5	152.6	-179.6	57.7	0	0	0	0	113	S42 G88	S42-S90 WeakPolarHBondContact OG-CA 3.24Å; G88-S90 PolarHBondContact O-N 3.01Å
91	N	80.3	Confident	86.3	Confident	73 Å²	73	43.1 Å²	43.1	39%	0.39	26%	0.264	S	S	.	.			trans	64.8	41.1	173.4	-58.5	-21.8	0	0	0	114.9	E40 G41 K93 N222	E40-N91 WeakPolarHBondContact OE2-CB 3.4Å; E40-N91 PolarHBondContact OE2-OD1 3Å; G41-N91 PolarHBondContact O-N 2.87Å; N91-K93 PolarHBondContact O-N 3.22Å; N91-N222 PolarHBondContact N-ND2 3.25Å; N91-N222 PolarHBondContact OD1-ND2 2.84Å; N91-N222 PolarHBondContact OD1-OD1 2.84Å
92	I	85.9	Confident	86.2	Confident	21 Å²	21	43.1 Å²	43.1	11%	0.108	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	116	175.3	-58.7	168.6	0	0	0	108.5	M31 E40 G41 I43 A85 S96 I98	M31-I92 HydrophobicContact CB-CG2 4.04Å; M31-I92 HydrophobicContact CE-CB 3.67Å; M31-I92 HydrophobicContact CE-CD1 3.73Å; M31-I92 HydrophobicContact CE-CG1 4.32Å; M31-I92 HydrophobicContact CE-CG2 3.68Å; M31-I92 HydrophobicContact CG-CG2 4.23Å; E40-I92 CarbonylContact C-O 3.53Å; E40-I92 VanDerWaalsContact CA-O 3.27Å; E40-I92 WeakPolarHBondContact CA-O 3.35Å; G41-I92 PolarHBondContact N-O 3.49Å; G41-I92 WeakPolarHBondContact O-CB 3.2Å; G41-I92 PolarHBondContact O-N 3.2Å; I43-I92 HydrophobicContact CD1-CD1 3.62Å; I43-I92 HydrophobicContact CG1-CD1 3.84Å; A85-I92 HydrophobicContact CB-CD1 3.68Å; I92-S96 WeakPolarHBondContact CG2-OG 3.49Å; I92-I98 HydrophobicContact CD1-CG2 4.48Å; I92-I98 HydrophobicContact CG2-CG2 3.92Å
93	K	89.2	Confident	85.8	Confident	156 Å²	156	40.9 Å²	40.9	68%	0.678	26%	0.256	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64	141	179.1	-68	-175	178.4	-178.1	0	111.5	N91 G95 S96	N91-K93 PolarHBondContact O-N 3.22Å; K93-G95 PolarHBondContact O-N 3.17Å; K93-S96 WeakPolarHBondContact O-CB 3.39Å; K93-S96 PolarHBondContact O-N 2.97Å; K93-S96 PolarHBondContact O-OG 2.79Å
94	V	88.2	Confident	84.9	Confident	53 Å²	53	44.8 Å²	44.8	32%	0.321	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	133.7	172.3	174.2	0	0	0	0	109.7	M38 S39	M38-V94 HydrophobicContact CE-CG2 4.43Å; M38-V94 HydrophobicContact CG-CG2 3.98Å; M38-V94 WeakPolarHBondContact O-CG2 3.33Å; M38-V94 HydrophobicContact SD-CG2 4.39Å; S39-V94 PolarHBondContact O-N 3.05Å
95	G	88.7	Confident	84.2	Confident	40 Å²	40	49.6 Å²	49.6	41%	0.412	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.5	-6	-176.6	0	0	0	0	0	115.8	K30 M31 K93	K30-G95 WeakPolarHBondContact CD-O 3.39Å; M31-G95 PolarHBondContact O-N 3.43Å; K93-G95 PolarHBondContact O-N 3.17Å
96	S	88.4	Confident	83.3	Confident	42 Å²	42	52 Å²	52	29%	0.294	32%	0.319	S	S	.	.	S	Bend	trans	-75.5	151.4	171.5	63.5	0	0	0	0	111.7	K30 M31 I92 K93 I98	K30-S96 CarbonylContact C-O 3.47Å; K30-S96 WeakPolarHBondContact CA-O 3.34Å; M31-S96 PolarHBondContact N-O 3.41Å; I92-S96 WeakPolarHBondContact CG2-OG 3.49Å; K93-S96 WeakPolarHBondContact O-CB 3.39Å; K93-S96 PolarHBondContact O-N 2.97Å; K93-S96 PolarHBondContact O-OG 2.79Å; S96-I98 PolarHBondContact O-N 3.38Å
97	L	89.9	Confident	82.8	Confident	51 Å²	51	54.3 Å²	54.3	27%	0.267	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	121.7	-174.8	-167.1	71.6	0	0	0	110.5	H28 I29 K30 L84 V100	H28-L97 HydrophobicContact CB-CD1 3.39Å; I29-L97 WeakPolarHBondContact O-CD1 3.4Å; K30-L97 HydrophobicContact CG-CD1 4.39Å; L84-L97 HydrophobicContact CD1-CB 4.25Å; L84-L97 HydrophobicContact CD1-CD2 3.34Å; L84-L97 HydrophobicContact CD1-CG 3.63Å; L97-V100 HydrophobicContact CD2-CG2 4.18Å
98	I	89.5	Confident	82.4	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	-33.4	-177.6	55.8	171.1	0	0	0	112.9	I29 M31 I43 F72 L84 A85 I92 S96	I29-I98 HydrophobicContact CB-CG1 4.22Å; I29-I98 HydrophobicContact CG2-CD1 3.76Å; I29-I98 HydrophobicContact CG2-CG1 3.68Å; I29-I98 VanDerWaalsContact O-CG1 3.28Å; I29-I98 WeakPolarHBondContact O-CG1 3.49Å; I29-I98 PolarHBondContact O-N 3.38Å; M31-I98 HydrophobicContact CB-CG2 3.9Å; M31-I98 HydrophobicContact CE-CG2 4.08Å; I43-I98 HydrophobicContact CD1-CB 4.5Å; I43-I98 HydrophobicContact CD1-CG2 4.37Å; F72-I98 HydrophobicContact CD1-CD1 4.31Å; F72-I98 HydrophobicContact CE1-CD1 3.99Å; L84-I98 PolarHBondContact N-O 3.03Å; A85-I98 HydrophobicContact CB-CB 4.34Å; A85-I98 HydrophobicContact CB-CG2 4.3Å; A85-I98 PolarHBondContact N-O 2.69Å; A85-I98 VanDerWaalsContact N-O 3.15Å; I92-I98 HydrophobicContact CD1-CG2 4.48Å; I92-I98 HydrophobicContact CG2-CG2 3.92Å; S96-I98 PolarHBondContact O-N 3.38Å
99	A	88.8	Confident	82.1	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	165.8	178.9	0	0	0	0	0	111.1	I29 W46 L80 K82	I29-A99 WeakPolarHBondContact CA-O 3.28Å; I29-A99 HydrophobicContact CB-CB 4.25Å; I29-A99 WeakPolarHBondContact CB-O 2.94Å; I29-A99 HydrophobicContact CD1-CB 4.16Å; I29-A99 PolarHBondContact N-O 3.17Å; I29-A99 PolarHBondContact O-N 3.47Å; W46-A99 HydrophobicContact CH2-CB 3.76Å; W46-A99 HydrophobicContact CZ2-CB 4.48Å; W46-A99 HydrophobicContact CZ3-CB 4.45Å; L80-A99 HydrophobicContact CD1-CB 3.89Å; K82-A99 WeakPolarHBondContact O-CA 3.45Å
100	V	88.7	Confident	81.8	Confident	3 Å²	3	62.9 Å²	62.9	2%	0.018	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	128.8	177.2	-176.9	0	0	0	0	109	P26 A81 K82 L84 L97 V111 A115	P26-V100 HydrophobicContact CB-CG1 3.66Å; P26-V100 HydrophobicContact CG-CG1 4.42Å; A81-V100 WeakPolarHBondContact CB-O 3.5Å; A81-V100 PolarHBondContact N-O 3.45Å; K82-V100 PolarHBondContact N-O 3.39Å; K82-V100 PolarHBondContact O-N 2.89Å; L84-V100 HydrophobicContact CD1-CG2 4.16Å; L97-V100 HydrophobicContact CD2-CG2 4.18Å; V100-V111 HydrophobicContact CG1-CG1 3.61Å; V100-A115 HydrophobicContact CB-CB 4.38Å; V100-A115 HydrophobicContact CG2-CB 3.9Å
101	L	87.9	Confident	81.5	Confident	1 Å²	1	59.9 Å²	59.9	1%	0.005	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	133.2	172.3	-75.5	162	0	0	0	109.5	V27 I29 V54 E76 V79 L80	V27-L101 HydrophobicContact CB-CB 3.96Å; V27-L101 HydrophobicContact CG1-CB 4.42Å; V27-L101 HydrophobicContact CG1-CD1 4.2Å; V27-L101 PolarHBondContact N-O 3.15Å; V27-L101 PolarHBondContact O-N 3.27Å; I29-L101 HydrophobicContact CD1-CD1 3.56Å; I29-L101 HydrophobicContact CD1-CD2 4.36Å; I29-L101 HydrophobicContact CD1-CG 3.63Å; I29-L101 HydrophobicContact CG1-CD1 3.7Å; I29-L101 HydrophobicContact CG1-CG 3.94Å; V54-L101 HydrophobicContact CB-CD2 4.14Å; V54-L101 HydrophobicContact CG2-CD2 4.1Å; E76-L101 HydrophobicContact CB-CD1 3.99Å; V79-L101 CarbonylContact O-C 3.53Å; V79-L101 WeakPolarHBondContact O-CA 3.38Å; L80-L101 HydrophobicContact CD1-CD2 4.34Å
102	A	84.4	Confident	81.1	Confident	1 Å²	1	57.1 Å²	57.1	1%	0.008	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	139.9	167.1	0	0	0	0	0	109.4	G78 V79 A81 E106 W108 V111	G78-A102 WeakPolarHBondContact CA-O 3.32Å; V79-A102 PolarHBondContact N-O 2.66Å; V79-A102 PolarHBondContact O-N 3.07Å; A81-A102 HydrophobicContact CB-CB 4.07Å; A102-E106 HydrophobicContact CB-CB 4.41Å; A102-W108 HydrophobicContact CB-CB 4.22Å; A102-V111 HydrophobicContact CB-CB 4.21Å; A102-V111 HydrophobicContact CB-CG1 4.44Å; A102-V111 HydrophobicContact CB-CG2 3.91Å
103	T	79.2	Confident	80.3	Confident	17 Å²	17	59.3 Å²	59.3	10%	0.104	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-71.1	159	172.1	56	0	0	0	0	110.2	D105 E106	T103-D105 PolarHBondContact O-N 3.27Å; T103-E106 PolarHBondContact O-N 2.82Å
104	P	70.1	Confident	79.5	Confident	110 Å²	110	55.4 Å²	55.4	71%	0.714	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-21.7	-176.8	-26	34.1	0	0	0	115.2
105	D	69	Low	78.4	Confident	144 Å²	144	53.1 Å²	53.1	77%	0.77	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-2.6	-178.5	-63.8	-40.2	0	0	0	113.4	T103	T103-D105 PolarHBondContact O-N 3.27Å
106	E	67.8	Low	77.1	Confident	61 Å²	61	53.7 Å²	53.7	29%	0.285	30%	0.301	S	S	.	.	S	Bend	trans	-110.3	135.8	-178.5	-69.8	-177.1	167.6	0	0	112	A102 T103 W108 V111	A102-E106 HydrophobicContact CB-CB 4.41Å; T103-E106 PolarHBondContact O-N 2.82Å; E106-W108 PolarHBondContact O-N 2.78Å; E106-W108 VanDerWaalsContact O-N 3.13Å; E106-V111 HydrophobicContact CB-CG2 4.07Å; E106-V111 VanDerWaalsContact OE2-CG2 3.28Å; E106-V111 WeakPolarHBondContact OE2-CG2 3.22Å
107	H	75.4	Confident	75.7	Confident	127 Å²	127	55.8 Å²	55.8	59%	0.588	32%	0.316	S	S	*	.			trans	-68.9	112.9	170.4	-86.7	-60.8	0	0	0	109.4	Q109 E110 V111	H107-Q109 PolarHBondContact O-N 3.38Å; H107-E110 HydrophobicContact CB-CG 4.3Å; H107-E110 PolarHBondContact O-N 3.08Å; H107-V111 PolarHBondContact O-N 3.35Å
108	W	75.9	Confident	74.1	Confident	91 Å²	91	59 Å²	59	35%	0.345	33%	0.333	S	S	.	.	H	α-helix	trans	-50.4	-28.3	-177.8	67.7	-94.3	0	0	0	114.1	V79 A81 A102 E106 A112	V79-W108 HydrophobicContact CB-CB 4.37Å; V79-W108 HydrophobicContact CG1-CB 3.91Å; V79-W108 HydrophobicContact CG1-CG 4.2Å; A81-W108 HydrophobicContact CB-CB 4.31Å; A102-W108 HydrophobicContact CB-CB 4.22Å; E106-W108 PolarHBondContact O-N 2.78Å; E106-W108 VanDerWaalsContact O-N 3.13Å; W108-A112 VanDerWaalsContact O-CB 3.24Å; W108-A112 WeakPolarHBondContact O-CB 3.44Å; W108-A112 PolarHBondContact O-N 3.06Å
109	Q	75.4	Confident	72.3	Confident	114 Å²	114	62.5 Å²	62.5	53%	0.533	36%	0.357	S	S	.	.	H	α-helix	trans	-67.6	-36.7	177.4	-68.3	156.1	-10.8	0	0	113.2	H107 A113	H107-Q109 PolarHBondContact O-N 3.38Å; Q109-A113 WeakPolarHBondContact O-CB 3.09Å; Q109-A113 PolarHBondContact O-N 2.89Å
110	E	74.9	Confident	69.8	Low	142 Å²	142	70.5 Å²	70.5	66%	0.664	40%	0.395	S	S	*	.	H	α-helix	trans	-71.2	-41.7	177.8	-64.1	-174.4	176.8	0	0	110.6	H107 A112 A113 S114	H107-E110 HydrophobicContact CB-CG 4.3Å; H107-E110 PolarHBondContact O-N 3.08Å; E110-A112 VanDerWaalsContact C-N 3.35Å; E110-A113 PolarHBondContact O-N 3.49Å; E110-S114 PolarHBondContact O-N 3.46Å
111	V	73.9	Confident	67.3	Low	11 Å²	11	76.1 Å²	76.1	7%	0.067	43%	0.431	C	S	.	.	H	α-helix	trans	-64.3	-41.5	175.2	-179.6	0	0	0	0	110.7	P26 A81 V100 A102 E106 H107 A113 S114 A115	P26-V111 HydrophobicContact CB-CG1 3.63Å; P26-V111 HydrophobicContact CG-CG1 4.41Å; A81-V111 HydrophobicContact CB-CB 3.96Å; A81-V111 HydrophobicContact CB-CG1 3.8Å; V100-V111 HydrophobicContact CG1-CG1 3.61Å; A102-V111 HydrophobicContact CB-CB 4.21Å; A102-V111 HydrophobicContact CB-CG1 4.44Å; A102-V111 HydrophobicContact CB-CG2 3.91Å; E106-V111 HydrophobicContact CB-CG2 4.07Å; E106-V111 VanDerWaalsContact OE2-CG2 3.28Å; E106-V111 WeakPolarHBondContact OE2-CG2 3.22Å; H107-V111 PolarHBondContact O-N 3.35Å; V111-A113 PolarHBondContact O-N 3.06Å; V111-S114 PolarHBondContact O-N 2.9Å; V111-A115 WeakPolarHBondContact O-CB 3.39Å; V111-A115 PolarHBondContact O-N 2.91Å
112	A	72	Confident	64.9	Low	14 Å²	14	81.4 Å²	81.4	12%	0.116	47%	0.468	C	S	.	.	H	α-helix	trans	-62.3	-40.6	176.4	0	0	0	0	0	112.8	A81 K82 W108 E110 A115 A116	A81-A112 WeakPolarHBondContact O-CB 3.47Å; K82-A112 HydrophobicContact CB-CB 4.1Å; K82-A112 HydrophobicContact CD-CB 4.22Å; W108-A112 VanDerWaalsContact O-CB 3.24Å; W108-A112 WeakPolarHBondContact O-CB 3.44Å; W108-A112 PolarHBondContact O-N 3.06Å; E110-A112 VanDerWaalsContact C-N 3.35Å; A112-A115 PolarHBondContact O-N 3.44Å; A112-A116 PolarHBondContact O-N 2.9Å; A112-A116 VanDerWaalsContact O-N 3.08Å
113	A	69.9	Low	62.3	Low	68 Å²	68	88.3 Å²	88.3	56%	0.562	51%	0.51	S	S	*	.	H	α-helix	trans	-65.8	-39.4	176.2	0	0	0	0	0	112	Q109 E110 V111	Q109-A113 WeakPolarHBondContact O-CB 3.09Å; Q109-A113 PolarHBondContact O-N 2.89Å; E110-A113 PolarHBondContact O-N 3.49Å; V111-A113 PolarHBondContact O-N 3.06Å
114	S	72.5	Confident	60.1	Low	73 Å²	73	91.4 Å²	91.4	51%	0.51	54%	0.538	S	S	.	.	H	α-helix	trans	-65.3	-44.8	174.9	-170.6	0	0	0	0	111.6	E110 V111 A116 S117	E110-S114 PolarHBondContact O-N 3.46Å; V111-S114 PolarHBondContact O-N 2.9Å; S114-A116 VanDerWaalsContact C-N 3.34Å; S114-A116 PolarHBondContact O-N 2.92Å; S114-S117 WeakPolarHBondContact O-CB 3.34Å; S114-S117 PolarHBondContact O-N 3.07Å; S114-S117 VanDerWaalsContact O-N 3.15Å; S114-S117 PolarHBondContact O-OG 3.37Å
115	A	64	Low	58.4	Low	5 Å²	5	93.7 Å²	93.7	4%	0.041	54%	0.544	C	S	.	.	H	α-helix	trans	-64.1	-34.5	179.8	0	0	0	0	0	113.2	K82 L84 V100 V111 A112 S117 L118	K82-A115 HydrophobicContact CB-CB 4.22Å; L84-A115 HydrophobicContact CD2-CB 4.38Å; V100-A115 HydrophobicContact CB-CB 4.38Å; V100-A115 HydrophobicContact CG2-CB 3.9Å; V111-A115 WeakPolarHBondContact O-CB 3.39Å; V111-A115 PolarHBondContact O-N 2.91Å; A112-A115 PolarHBondContact O-N 3.44Å; A115-S117 PolarHBondContact O-N 3.32Å; A115-L118 PolarHBondContact O-N 2.97Å; A115-L118 VanDerWaalsContact O-N 3.17Å
116	A	61.6	Low	57	Low	53 Å²	53	92.3 Å²	92.3	44%	0.438	55%	0.546	S	S	.	.	H	α-helix	trans	-61.7	-29.7	175.8	0	0	0	0	0	112.9	A112 S114 L118 S119	A112-A116 PolarHBondContact O-N 2.9Å; A112-A116 VanDerWaalsContact O-N 3.08Å; S114-A116 VanDerWaalsContact C-N 3.34Å; S114-A116 PolarHBondContact O-N 2.92Å; A116-L118 VanDerWaalsContact C-N 3.27Å; A116-L118 PolarHBondContact O-N 3.1Å; A116-S119 PolarHBondContact O-N 2.85Å
117	S	58.3	Low	55.6	Low	86 Å²	86	97.2 Å²	97.2	60%	0.601	57%	0.572	S	S	*	*	H	α-helix	trans	-70.5	-20.8	178.5	76.6	0	0	0	0	113.8	S114 A115 S119	S114-S117 WeakPolarHBondContact O-CB 3.34Å; S114-S117 PolarHBondContact O-N 3.07Å; S114-S117 VanDerWaalsContact O-N 3.15Å; S114-S117 PolarHBondContact O-OG 3.37Å; A115-S117 PolarHBondContact O-N 3.32Å; S117-S119 VanDerWaalsContact C-N 3.3Å; S117-S119 PolarHBondContact O-N 3.24Å
118	L	57.6	Low	53.9	Low	118 Å²	118	96.7 Å²	96.7	62%	0.618	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	-6.3	178.9	-71.8	160.3	0	0	0	113.5	A115 A116	A115-L118 PolarHBondContact O-N 2.97Å; A115-L118 VanDerWaalsContact O-N 3.17Å; A116-L118 VanDerWaalsContact C-N 3.27Å; A116-L118 PolarHBondContact O-N 3.1Å
119	S	50.6	Low	52	Low	74 Å²	74	102 Å²	102	52%	0.517	61%	0.606	S	S	.	*	T	Hydrogen-bonded Turn	trans	-97.2	2.2	-171.6	-50.9	0	0	0	0	114.6	A116 S117	A116-S119 PolarHBondContact O-N 2.85Å; S117-S119 VanDerWaalsContact C-N 3.3Å; S117-S119 PolarHBondContact O-N 3.24Å
120	Q	37.3	Very low	50	Low	168 Å²	168	106.3 Å²	106.3	79%	0.785	63%	0.626	S	S	*	*	S	Bend	trans	-99.8	123.3	176.2	-74	-174.4	-16.5	0	0	111.2	S122	Q120-S122 PolarHBondContact O-N 2.68Å; Q120-S122 VanDerWaalsContact O-N 3.17Å
121	P	36.5	Very low	48.2	Very low	121 Å²	121	105.3 Å²	105.3	79%	0.786	64%	0.635	S	S	*	*			trans	-71.5	111.3	171.1	4.3	9.7	0	0	0	108.7	T123	P121-T123 PolarHBondContact O-N 3.04Å
122	S	36.3	Very low	46.3	Very low	112 Å²	112	108.3 Å²	108.3	78%	0.783	67%	0.667	S	S	*	*			trans	-75.3	102.2	166	60.8	0	0	0	0	109.1	Q120 A124	Q120-S122 PolarHBondContact O-N 2.68Å; Q120-S122 VanDerWaalsContact O-N 3.17Å; S122-A124 PolarHBondContact O-N 3.36Å
123	T	29.4	Very low	44.5	Very low	145 Å²	145	115.6 Å²	115.6	89%	0.89	70%	0.703	S	S	*	*			trans	-64	104.5	156.1	38.1	0	0	0	0	108.2	P121	P121-T123 PolarHBondContact O-N 3.04Å
124	A	34.9	Very low	42.8	Very low	83 Å²	83	119.9 Å²	119.9	69%	0.686	72%	0.716	S	S	*	*			trans	-140.6	106.9	168.2	0	0	0	0	0	109.7	S122	S122-A124 PolarHBondContact O-N 3.36Å
125	D	34.2	Very low	41	Very low	158 Å²	158	127.8 Å²	127.8	85%	0.845	74%	0.735	S	S	*	*			trans	-42.8	140.5	167.5	-70	-56.9	0	0	0	113.6
126	S	39.7	Very low	39.4	Very low	115 Å²	115	134 Å²	134	80%	0.804	77%	0.772	S	S	*	*			trans	-159.2	97.6	149.1	6	0	0	0	0	111.2
127	I	37.2	Very low	38.1	Very low	164 Å²	164	138.9 Å²	138.9	84%	0.841	79%	0.79	S	S	*	*			trans	-85.7	135.7	160.6	-59.1	163.4	0	0	0	107.8
128	P	39.6	Very low	37	Very low	116 Å²	116	143.6 Å²	143.6	75%	0.753	80%	0.802	S	S	*	*			trans	-120.3	115.6	155.2	27.2	-11.1	0	0	0	113
129	K	37.5	Very low	35.9	Very low	203 Å²	203	146.7 Å²	146.7	88%	0.883	81%	0.813	S	S	*	*			trans	28.3	123.4	140	-74.6	174.9	176.7	175.1	0	120.7
130	Q	31.9	Very low	35.1	Very low	203 Å²	203	149.2 Å²	149.2	95%	0.949	83%	0.828	S	S	*	*			trans	-56	151.5	162.2	-68.5	163.8	-24.1	0	0	114.4
131	S	37.9	Very low	35	Very low	122 Å²	122	149.4 Å²	149.4	85%	0.853	83%	0.829	S	S	*	*			trans	-119.8	120.7	158.1	-171	0	0	0	0	108.3
132	G	33	Very low	34.6	Very low	73 Å²	73	149.3 Å²	149.3	75%	0.753	83%	0.831	S	S	*	*			trans	-91.8	146.5	-177.3	0	0	0	0	0	113.1
133	I	35.4	Very low	34.4	Very low	168 Å²	168	152.5 Å²	152.5	86%	0.862	83%	0.827	S	S	*	*			trans	-121.9	119.6	168.2	-69.9	171.2	0	0	0	108.4
134	N	33.4	Very low	34.7	Very low	158 Å²	158	156.3 Å²	156.3	85%	0.845	83%	0.825	S	S	*	*			trans	-58.1	139.8	172.1	-90.7	-27.5	0	0	0	112.7
135	R	34.7	Very low	35	Very low	239 Å²	239	161.3 Å²	161.3	90%	0.902	84%	0.839	S	S	*	*			trans	-154.6	111	144.1	-109.1	166.7	-170.3	172.5	2.7	112.4
136	T	31.5	Very low	35.7	Very low	135 Å²	135	156.5 Å²	156.5	83%	0.828	82%	0.818	S	S	*	*			trans	8.3	125.1	152.4	-34.9	0	0	0	0	119.9
137	I	32.7	Very low	36.9	Very low	156 Å²	156	155.2 Å²	155.2	80%	0.8	81%	0.808	S	S	*	*			trans	-88.1	136.3	170.8	-62.4	166.2	0	0	0	109.8
138	Q	35.1	Very low	38.9	Very low	184 Å²	184	149.5 Å²	149.5	86%	0.86	78%	0.779	S	S	*	*			trans	-121.4	142.2	159.5	-86.6	-177.4	-22.7	0	0	109.2
139	E	35.8	Very low	41	Very low	183 Å²	183	145.5 Å²	145.5	86%	0.855	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-60.8	145.5	-171.4	-73.1	166	125.6	0	0	115
140	P	33.8	Very low	43.4	Very low	127 Å²	127	141.1 Å²	141.1	83%	0.825	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-86.5	130.7	-178.4	33.5	-31.2	0	0	0	112.6
141	Q	34.1	Very low	46.1	Very low	173 Å²	173	133.9 Å²	133.9	81%	0.808	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-86.3	134.1	166.2	-69.4	-171.7	-23.7	0	0	110.8
142	S	28	Very low	48.6	Very low	118 Å²	118	128.4 Å²	128.4	83%	0.825	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-65.2	120.3	176.3	173.2	0	0	0	0	113.1
143	Y	31.8	Very low	51.2	Low	179 Å²	179	131.8 Å²	131.8	70%	0.702	68%	0.677	S	S	*	*			trans	-168.5	121.6	145.1	50	-87.6	0	0	0	115.2
144	R	35.9	Very low	53.8	Low	226 Å²	226	129.2 Å²	129.2	85%	0.853	66%	0.664	S	S	*	*			trans	55.5	109.3	137.7	-60.2	-178.7	-167.3	-176.7	4	119.8	C146	R144-C146 PolarHBondContact O-N 2.96Å
145	L	41.2	Very low	56.5	Low	187 Å²	187	123 Å²	123	98%	0.979	63%	0.631	S	S	*	*			trans	25.9	69.8	144.1	-79.2	139.3	0	0	0	115.4
146	C	49.6	Very low	59.2	Low	58 Å²	58	112.3 Å²	112.3	39%	0.392	59%	0.591	S	S	.	*			trans	-74.8	135.8	172.6	-82.6	0	0	0	0	111	R144 M148 G173	R144-C146 PolarHBondContact O-N 2.96Å; C146-M148 WeakPolarHBondContact O-CG 3.42Å; C146-M148 PolarHBondContact O-N 3.15Å; C146-G173 PolarHBondContact SG-O 2.91Å; C146-G173 VanDerWaalsContact SG-O 3.38Å
147	S	64.3	Low	61.9	Low	87 Å²	87	113.6 Å²	113.6	61%	0.608	59%	0.588	S	S	*	*			trans	-60.6	116.4	175	178.1	0	0	0	0	110.7
148	M	79.5	Confident	64.6	Low	45 Å²	45	108 Å²	108	22%	0.222	56%	0.562	C	S	.	*			trans	-105.1	140.9	-175	-43.3	-178.6	72.4	0	0	111.5	C146 V152 R153 L156 L175	C146-M148 WeakPolarHBondContact O-CG 3.42Å; C146-M148 PolarHBondContact O-N 3.15Å; M148-V152 HydrophobicContact CB-CG1 4.45Å; M148-V152 HydrophobicContact CE-CG1 3.71Å; M148-R153 HydrophobicContact CB-CG 4.39Å; M148-R153 VanDerWaalsContact O-CZ 3.31Å; M148-R153 PolarHBondContact O-NE 3.13Å; M148-R153 PolarHBondContact O-NH2 2.98Å; M148-L156 HydrophobicContact CE-CD1 3.15Å; M148-L156 HydrophobicContact SD-CD1 4.24Å; M148-L175 HydrophobicContact CE-CB 4.1Å; M148-L175 HydrophobicContact CE-CD2 3.35Å; M148-L175 HydrophobicContact CE-CG 4.32Å
149	G	84.5	Confident	67.1	Low	31 Å²	31	100.5 Å²	100.5	32%	0.32	53%	0.527	S	S	.	.			trans	-67.4	159	176.5	0	0	0	0	0	113.8	A151 V152 R153	G149-A151 PolarHBondContact O-N 3Å; G149-V152 WeakPolarHBondContact O-CB 3.42Å; G149-V152 PolarHBondContact O-N 3.38Å; G149-R153 PolarHBondContact O-N 2.91Å; G149-R153 VanDerWaalsContact O-N 3.07Å
150	P	87.3	Confident	69.5	Low	112 Å²	112	98.2 Å²	98.2	73%	0.727	52%	0.521	S	S	*	.	H	α-helix	trans	-58.6	-41.2	179.8	-24.5	33.7	0	0	0	113.8	V152 R153 L154	P150-V152 VanDerWaalsContact C-N 3.33Å; P150-V152 PolarHBondContact O-N 2.87Å; P150-R153 PolarHBondContact O-N 2.93Å; P150-L154 PolarHBondContact O-N 3.49Å
151	A	87.8	Confident	72	Confident	50 Å²	50	93 Å²	93	41%	0.413	49%	0.486	S	S	.	.	H	α-helix	trans	-65.7	-35.7	178.1	0	0	0	0	0	112.7	G149 L154 L155 K177	G149-A151 PolarHBondContact O-N 3Å; A151-L154 PolarHBondContact O-N 2.81Å; A151-L155 WeakPolarHBondContact O-CG 3.45Å; A151-L155 PolarHBondContact O-N 3.39Å; A151-K177 HydrophobicContact CB-CD 4.38Å
152	V	90.7	Very high	74.5	Confident	7 Å²	7	89.4 Å²	89.4	4%	0.042	47%	0.472	C	S	.	.	H	α-helix	trans	-67.5	-45.7	177.4	-179	0	0	0	0	109.6	M148 G149 P150 L154 L155 L156 L175 K177 V180	M148-V152 HydrophobicContact CB-CG1 4.45Å; M148-V152 HydrophobicContact CE-CG1 3.71Å; G149-V152 WeakPolarHBondContact O-CB 3.42Å; G149-V152 PolarHBondContact O-N 3.38Å; P150-V152 VanDerWaalsContact C-N 3.33Å; P150-V152 PolarHBondContact O-N 2.87Å; V152-L154 VanDerWaalsContact C-N 3.34Å; V152-L154 PolarHBondContact O-N 2.89Å; V152-L155 PolarHBondContact O-N 3.48Å; V152-L156 HydrophobicContact CG1-CD1 4.19Å; V152-L156 WeakPolarHBondContact O-CG 3.42Å; V152-L156 PolarHBondContact O-N 3.34Å; V152-L175 HydrophobicContact CG1-CB 4.21Å; V152-L175 HydrophobicContact CG1-CD2 3.7Å; V152-L175 HydrophobicContact CG1-CG 3.93Å; V152-L175 WeakPolarHBondContact CG2-O 3.27Å; V152-K177 HydrophobicContact CG2-CB 4.41Å; V152-V180 HydrophobicContact CG1-CG2 3.68Å
153	R	88.9	Confident	77.1	Confident	144 Å²	144	84.7 Å²	84.7	54%	0.543	44%	0.443	S	S	.	.	H	α-helix	trans	-57.7	-44.1	173.6	-90	-178	-98.5	-139.5	0.5	112.7	M148 G149 P150 L156 Q157	M148-R153 HydrophobicContact CB-CG 4.39Å; M148-R153 VanDerWaalsContact O-CZ 3.31Å; M148-R153 PolarHBondContact O-NE 3.13Å; M148-R153 PolarHBondContact O-NH2 2.98Å; G149-R153 PolarHBondContact O-N 2.91Å; G149-R153 VanDerWaalsContact O-N 3.07Å; P150-R153 PolarHBondContact O-N 2.93Å; R153-L156 PolarHBondContact O-N 2.95Å; R153-Q157 VanDerWaalsContact O-CB 3.31Å; R153-Q157 WeakPolarHBondContact O-CB 3.19Å; R153-Q157 PolarHBondContact O-N 3Å
154	L	90.3	Very high	79.6	Confident	115 Å²	115	80.8 Å²	80.8	60%	0.602	44%	0.442	S	S	*	.	H	α-helix	trans	-64.3	-41.7	178.8	-167.2	153.1	0	0	0	111.8	P150 A151 V152 S158	P150-L154 PolarHBondContact O-N 3.49Å; A151-L154 PolarHBondContact O-N 2.81Å; V152-L154 VanDerWaalsContact C-N 3.34Å; V152-L154 PolarHBondContact O-N 2.89Å; L154-S158 VanDerWaalsContact O-CB 3.31Å; L154-S158 WeakPolarHBondContact O-CB 3.46Å; L154-S158 PolarHBondContact O-N 2.63Å; L154-S158 PolarHBondContact O-OG 3.44Å
155	L	89.8	Confident	81.8	Confident	26 Å²	26	75.6 Å²	75.6	14%	0.136	43%	0.427	C	S	.	.	H	α-helix	trans	-66.1	-43.9	177.1	-74.3	173.2	0	0	0	112.6	A151 V152 S158 H159 K177 V180 L181	A151-L155 WeakPolarHBondContact O-CG 3.45Å; A151-L155 PolarHBondContact O-N 3.39Å; V152-L155 PolarHBondContact O-N 3.48Å; L155-S158 WeakPolarHBondContact CA-OG 3.49Å; L155-S158 PolarHBondContact O-N 3.36Å; L155-S158 PolarHBondContact O-OG 2.87Å; L155-H159 PolarHBondContact O-N 3.05Å; L155-H159 VanDerWaalsContact O-N 3.14Å; L155-H159 PolarHBondContact O-ND1 2.91Å; L155-K177 HydrophobicContact CD1-CG 3.87Å; L155-V180 HydrophobicContact CB-CG1 3.75Å; L155-V180 HydrophobicContact CD1-CB 4.42Å; L155-V180 HydrophobicContact CD1-CG1 4.29Å; L155-L181 HydrophobicContact CD1-CD2 3.97Å; L155-L181 HydrophobicContact CD1-CG 4.07Å; L155-L181 HydrophobicContact CD2-CD2 4.32Å
156	L	90.1	Very high	83.9	Confident	15 Å²	15	67.4 Å²	67.4	8%	0.079	38%	0.384	C	S	.	.	H	α-helix	trans	-63.6	-42.5	176.9	-67.8	175.9	0	0	0	111.8	M148 V152 R153 H159 D160 I161 I166 L175 V180	M148-L156 HydrophobicContact CE-CD1 3.15Å; M148-L156 HydrophobicContact SD-CD1 4.24Å; V152-L156 HydrophobicContact CG1-CD1 4.19Å; V152-L156 WeakPolarHBondContact O-CG 3.42Å; V152-L156 PolarHBondContact O-N 3.34Å; R153-L156 PolarHBondContact O-N 2.95Å; L156-H159 PolarHBondContact O-N 2.8Å; L156-D160 WeakPolarHBondContact O-CA 3.28Å; L156-D160 PolarHBondContact O-N 3.18Å; L156-I161 HydrophobicContact CD2-CB 3.77Å; L156-I161 HydrophobicContact CD2-CG2 3.88Å; L156-I161 WeakPolarHBondContact CD2-O 3.33Å; L156-I161 PolarHBondContact O-N 3.37Å; L156-I166 HydrophobicContact CD2-CD1 3.73Å; L156-L175 HydrophobicContact CD1-CD2 4.04Å; L156-V180 HydrophobicContact CD2-CG1 3.98Å; L156-V180 HydrophobicContact CD2-CG2 4.21Å; L156-V180 HydrophobicContact CG-CG1 4.46Å; L156-V180 HydrophobicContact CG-CG2 4.47Å
157	Q	88.7	Confident	85.7	Confident	163 Å²	163	71.2 Å²	71.2	76%	0.762	40%	0.399	S	S	*	.	H	α-helix	trans	-68.4	-37.8	178.2	-171.9	177.9	1.1	0	0	112.5	R153 H159	R153-Q157 VanDerWaalsContact O-CB 3.31Å; R153-Q157 WeakPolarHBondContact O-CB 3.19Å; R153-Q157 PolarHBondContact O-N 3Å; Q157-H159 VanDerWaalsContact C-N 3.32Å; Q157-H159 PolarHBondContact O-N 3.46Å
158	S	88.6	Confident	86.7	Confident	37 Å²	37	69.5 Å²	69.5	26%	0.259	39%	0.387	S	S	.	.	H	α-helix	trans	-74	-20.1	179.5	52	0	0	0	0	114	L154 L155 P191 V192	L154-S158 VanDerWaalsContact O-CB 3.31Å; L154-S158 WeakPolarHBondContact O-CB 3.46Å; L154-S158 PolarHBondContact O-N 2.63Å; L154-S158 PolarHBondContact O-OG 3.44Å; L155-S158 WeakPolarHBondContact CA-OG 3.49Å; L155-S158 PolarHBondContact O-N 3.36Å; L155-S158 PolarHBondContact O-OG 2.87Å; S158-P191 CarbonylContact O-C 3.6Å; S158-V192 PolarHBondContact O-N 3.22Å
159	H	89.1	Confident	87.1	Confident	27 Å²	27	72.3 Å²	72.3	13%	0.125	41%	0.407	C	S	.	.	H	α-helix	trans	-113.4	2.7	180	-62.9	73.3	0	0	0	113.2	L155 L156 Q157 I161 I184 I189	L155-H159 PolarHBondContact O-N 3.05Å; L155-H159 VanDerWaalsContact O-N 3.14Å; L155-H159 PolarHBondContact O-ND1 2.91Å; L156-H159 PolarHBondContact O-N 2.8Å; Q157-H159 VanDerWaalsContact C-N 3.32Å; Q157-H159 PolarHBondContact O-N 3.46Å; H159-I161 VanDerWaalsContact C-N 3.3Å; H159-I161 HydrophobicContact CB-CD1 3.53Å; H159-I161 HydrophobicContact CB-CG1 3.75Å; H159-I161 PolarHBondContact O-N 3.49Å; H159-I184 HydrophobicContact CB-CD1 4.5Å; H159-I189 HydrophobicContact CB-CG2 4.07Å; H159-I189 PolarHBondContact CD2-O 2.87Å
160	D	86.3	Confident	87.1	Confident	136 Å²	136	71.3 Å²	71.3	73%	0.727	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	51	45.5	-175.9	-157.4	30.6	0	0	0	113.3	L156 V192	L156-D160 WeakPolarHBondContact O-CA 3.28Å; L156-D160 PolarHBondContact O-N 3.18Å; D160-V192 HydrophobicContact CB-CG2 4.21Å
161	I	86.2	Confident	86.9	Confident	16 Å²	16	70.3 Å²	70.3	8%	0.082	39%	0.39	C	S	.	.			trans	-102.4	129.9	-178	-56.3	168.8	0	0	0	109.5	L156 H159 I166 Y183 I184 I189	L156-I161 HydrophobicContact CD2-CB 3.77Å; L156-I161 HydrophobicContact CD2-CG2 3.88Å; L156-I161 WeakPolarHBondContact CD2-O 3.33Å; L156-I161 PolarHBondContact O-N 3.37Å; H159-I161 VanDerWaalsContact C-N 3.3Å; H159-I161 HydrophobicContact CB-CD1 3.53Å; H159-I161 HydrophobicContact CB-CG1 3.75Å; H159-I161 PolarHBondContact O-N 3.49Å; I161-I166 HydrophobicContact CG2-CD1 3.89Å; I161-I166 HydrophobicContact CG2-CG1 4.27Å; I161-Y183 HydrophobicContact CD1-CD1 4.17Å; I161-Y183 HydrophobicContact CD1-CE1 4.46Å; I161-Y183 HydrophobicContact CG2-CD1 4.08Å; I161-Y183 HydrophobicContact CG2-CE1 3.79Å; I161-I184 HydrophobicContact CD1-CD1 4.22Å; I161-I184 HydrophobicContact CD1-CG1 3.54Å; I161-I189 HydrophobicContact CD1-CD1 3.59Å; I161-I189 HydrophobicContact CD1-CG2 4.33Å; I161-I189 HydrophobicContact CG1-CD1 3.89Å; I161-I189 HydrophobicContact CG1-CG2 4.44Å
162	D	85.6	Confident	86.4	Confident	98 Å²	98	76.8 Å²	76.8	52%	0.524	41%	0.412	S	S	.	.			trans	-78.3	123.9	172.2	-165.6	1.1	0	0	0	110.4	S164 Q165	D162-S164 PolarHBondContact O-N 3.49Å; D162-S164 PolarHBondContact OD2-OG 3.15Å; D162-Q165 HydrophobicContact CB-CG 4.39Å; D162-Q165 PolarHBondContact O-N 2.86Å
163	G	82.5	Confident	85.9	Confident	20 Å²	20	77.7 Å²	77.7	21%	0.206	42%	0.422	C	S	.	.	G	3₁₀ helix	trans	-61.7	-18.6	-175.4	0	0	0	0	0	113.9	Q165	G163-Q165 VanDerWaalsContact C-N 3.26Å; G163-Q165 PolarHBondContact O-N 2.89Å
164	S	84.1	Confident	85.7	Confident	96 Å²	96	74.7 Å²	74.7	67%	0.671	41%	0.414	S	S	*	.	G	3₁₀ helix	trans	-72.1	-15.7	175.6	60.3	0	0	0	0	114.2	D162 I166	D162-S164 PolarHBondContact O-N 3.49Å; D162-S164 PolarHBondContact OD2-OG 3.15Å; S164-I166 VanDerWaalsContact C-N 3.32Å
165	Q	83.6	Confident	85.7	Confident	117 Å²	117	69.9 Å²	69.9	55%	0.547	39%	0.389	S	S	.	.	G	3₁₀ helix	trans	-84.2	-10.8	179.6	-59.4	-177.3	9.8	0	0	112.9	D162 G163 Y183	D162-Q165 HydrophobicContact CB-CG 4.39Å; D162-Q165 PolarHBondContact O-N 2.86Å; G163-Q165 VanDerWaalsContact C-N 3.26Å; G163-Q165 PolarHBondContact O-N 2.89Å; Q165-Y183 HydrophobicContact CB-CE2 4.43Å; Q165-Y183 PolarHBondContact OE1-OH 3.3Å; Q165-Y183 VanDerWaalsContact OE1-OH 3.04Å
166	I	85.4	Confident	85.7	Confident	15 Å²	15	72.1 Å²	72.1	8%	0.077	40%	0.401	C	S	.	.	S	Bend	trans	-105.9	129.2	-173.8	-46	-177.6	0	0	0	109.2	L156 I161 S164 S168 L175 D179 V180 Y183	L156-I166 HydrophobicContact CD2-CD1 3.73Å; I161-I166 HydrophobicContact CG2-CD1 3.89Å; I161-I166 HydrophobicContact CG2-CG1 4.27Å; S164-I166 VanDerWaalsContact C-N 3.32Å; I166-S168 PolarHBondContact O-N 2.76Å; I166-L175 HydrophobicContact CB-CD1 3.73Å; I166-L175 HydrophobicContact CB-CD2 4.46Å; I166-L175 HydrophobicContact CD1-CD2 4.33Å; I166-L175 HydrophobicContact CG2-CD1 3.57Å; I166-D179 HydrophobicContact CG2-CB 4.03Å; I166-V180 HydrophobicContact CD1-CB 4.35Å; I166-V180 HydrophobicContact CD1-CG1 4.27Å; I166-V180 HydrophobicContact CD1-CG2 4Å; I166-Y183 HydrophobicContact CB-CD2 4.39Å; I166-Y183 HydrophobicContact CD1-CD1 4.04Å; I166-Y183 HydrophobicContact CD1-CG 3.96Å; I166-Y183 HydrophobicContact CG1-CD1 4.04Å; I166-Y183 HydrophobicContact CG1-CD2 3.85Å; I166-Y183 HydrophobicContact CG1-CE1 4.42Å; I166-Y183 HydrophobicContact CG1-CE2 4.24Å; I166-Y183 HydrophobicContact CG1-CG 3.74Å; I166-Y183 HydrophobicContact CG2-CD2 4.31Å; I166-Y183 HydrophobicContact CG2-CG 4.36Å
167	I	86.2	Confident	85.7	Confident	138 Å²	138	77.1 Å²	77.1	71%	0.708	42%	0.422	S	S	*	.			trans	-69.2	117.1	174.6	-58.4	172	0	0	0	108
168	S	85.9	Confident	85.7	Confident	52 Å²	52	71.7 Å²	71.7	36%	0.364	41%	0.409	S	S	.	.			trans	-80	118	178.1	54.8	0	0	0	0	111.1	I166 G173	I166-S168 PolarHBondContact O-N 2.76Å; S168-G173 WeakPolarHBondContact CB-O 3.29Å; S168-G173 PolarHBondContact OG-O 2.83Å
169	T	88.4	Confident	85.8	Confident	104 Å²	104	71 Å²	71	64%	0.638	40%	0.403	S	S	*	.			trans	-96.3	-5.9	179.2	-42.6	0	0	0	0	112.4	D179	T169-D179 VanDerWaalsContact CB-OD1 3.26Å; T169-D179 WeakPolarHBondContact CB-OD1 3.26Å; T169-D179 PolarHBondContact N-OD2 3.04Å; T169-D179 PolarHBondContact OG1-OD1 2.78Å
170	G	83.8	Confident	85.9	Confident	9 Å²	9	69.7 Å²	69.7	9%	0.093	40%	0.397	C	S	.	.	S	Bend	trans	-75.6	162.6	-173.2	0	0	0	0	0	115.6	H172 G173 Q174	G170-H172 PolarHBondContact O-N 3.09Å; G170-G173 PolarHBondContact O-N 2.9Å; G170-Q174 WeakPolarHBondContact CA-O 3.45Å; G170-Q174 PolarHBondContact N-O 3.34Å
171	P	82.4	Confident	86.1	Confident	92 Å²	92	67 Å²	67	60%	0.597	38%	0.382	S	S	*	.	G	3₁₀ helix	trans	-53	137.5	173.5	-21.7	31.7	0	0	0	111	G173 Q174	P171-G173 PolarHBondContact O-N 2.96Å; P171-Q174 WeakPolarHBondContact O-CG 3.44Å; P171-Q174 PolarHBondContact O-N 2.63Å
172	H	78	Confident	86.3	Confident	186 Å²	186	68.5 Å²	68.5	86%	0.861	40%	0.397	S	S	*	.	G	3₁₀ helix	trans	59.3	22	-176.7	-51.1	-73.1	0	0	0	115.5	G170	G170-H172 PolarHBondContact O-N 3.09Å
173	G	80.7	Confident	86.5	Confident	26 Å²	26	66.2 Å²	66.2	27%	0.268	38%	0.381	S	S	.	.	G	3₁₀ helix	trans	78.2	19.8	-179.3	0	0	0	0	0	113.7	C146 S168 G170 P171	C146-G173 PolarHBondContact SG-O 2.91Å; C146-G173 VanDerWaalsContact SG-O 3.38Å; S168-G173 WeakPolarHBondContact CB-O 3.29Å; S168-G173 PolarHBondContact OG-O 2.83Å; G170-G173 PolarHBondContact O-N 2.9Å; P171-G173 PolarHBondContact O-N 2.96Å
174	Q	85.2	Confident	86.9	Confident	81 Å²	81	66.3 Å²	66.3	38%	0.379	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-72.4	137.4	175.8	-69.9	-176.6	8.3	0	0	111.3	G170 P171 L176	G170-Q174 WeakPolarHBondContact CA-O 3.45Å; G170-Q174 PolarHBondContact N-O 3.34Å; P171-Q174 WeakPolarHBondContact O-CG 3.44Å; P171-Q174 PolarHBondContact O-N 2.63Å; Q174-L176 PolarHBondContact O-N 2.98Å
175	L	88.7	Confident	87.1	Confident	13 Å²	13	65 Å²	65	7%	0.068	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-76	117.6	172.9	-171.5	66.6	0	0	0	109.7	M148 V152 L156 I166 D179 V180	M148-L175 HydrophobicContact CE-CB 4.1Å; M148-L175 HydrophobicContact CE-CD2 3.35Å; M148-L175 HydrophobicContact CE-CG 4.32Å; V152-L175 HydrophobicContact CG1-CB 4.21Å; V152-L175 HydrophobicContact CG1-CD2 3.7Å; V152-L175 HydrophobicContact CG1-CG 3.93Å; V152-L175 WeakPolarHBondContact CG2-O 3.27Å; L156-L175 HydrophobicContact CD1-CD2 4.04Å; I166-L175 HydrophobicContact CB-CD1 3.73Å; I166-L175 HydrophobicContact CB-CD2 4.46Å; I166-L175 HydrophobicContact CD1-CD2 4.33Å; I166-L175 HydrophobicContact CG2-CD1 3.57Å; L175-D179 HydrophobicContact CD1-CB 3.77Å; L175-V180 HydrophobicContact CD1-CG2 4.44Å; L175-V180 HydrophobicContact CD2-CG2 3.69Å; L175-V180 HydrophobicContact CG-CG2 3.89Å
176	L	90.3	Very high	87.4	Confident	74 Å²	74	66 Å²	66	39%	0.387	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-87.4	158.3	-179.8	-65.8	169.6	0	0	0	111.5	Q174 G178 D179 V180	Q174-L176 PolarHBondContact O-N 2.98Å; L176-G178 PolarHBondContact O-N 2.98Å; L176-D179 WeakPolarHBondContact CB-OD2 3.46Å; L176-D179 PolarHBondContact N-OD2 3.18Å; L176-D179 PolarHBondContact O-N 3.31Å; L176-D179 VanDerWaalsContact O-N 3.13Å; L176-V180 PolarHBondContact O-N 2.86Å
177	K	90.6	Very high	87.5	Confident	120 Å²	120	69.3 Å²	69.3	52%	0.522	40%	0.399	S	S	.	.	H	α-helix	trans	-56.8	-37.5	173.1	-178.1	-178.4	174.9	-176.6	0	111.5	A151 V152 L155 V180 L181	A151-K177 HydrophobicContact CB-CD 4.38Å; V152-K177 HydrophobicContact CG2-CB 4.41Å; L155-K177 HydrophobicContact CD1-CG 3.87Å; K177-V180 PolarHBondContact O-N 2.92Å; K177-L181 HydrophobicContact CG-CD1 4.02Å; K177-L181 HydrophobicContact CG-CG 4.42Å; K177-L181 WeakPolarHBondContact O-CG 3.36Å; K177-L181 PolarHBondContact O-N 2.99Å
178	G	89.3	Confident	87.3	Confident	48 Å²	48	71 Å²	71	50%	0.495	40%	0.404	S	S	.	.	H	α-helix	trans	-62.3	-39.7	176.9	0	0	0	0	0	113.1	L176 L181 A182	L176-G178 PolarHBondContact O-N 2.98Å; G178-L181 PolarHBondContact O-N 2.91Å; G178-A182 VanDerWaalsContact O-CB 3.31Å; G178-A182 WeakPolarHBondContact O-CB 3.4Å; G178-A182 PolarHBondContact O-N 3.44Å
179	D	90.4	Very high	87	Confident	22 Å²	22	70.7 Å²	70.7	12%	0.118	40%	0.398	C	S	.	.	H	α-helix	trans	-64.9	-43.3	178.7	-58	-33.2	0	0	0	110.8	I166 T169 L175 L176 A182 Y183	I166-D179 HydrophobicContact CG2-CB 4.03Å; T169-D179 VanDerWaalsContact CB-OD1 3.26Å; T169-D179 WeakPolarHBondContact CB-OD1 3.26Å; T169-D179 PolarHBondContact N-OD2 3.04Å; T169-D179 PolarHBondContact OG1-OD1 2.78Å; L175-D179 HydrophobicContact CD1-CB 3.77Å; L176-D179 WeakPolarHBondContact CB-OD2 3.46Å; L176-D179 PolarHBondContact N-OD2 3.18Å; L176-D179 PolarHBondContact O-N 3.31Å; L176-D179 VanDerWaalsContact O-N 3.13Å; D179-A182 PolarHBondContact O-N 3.44Å; D179-Y183 WeakPolarHBondContact O-CB 3.27Å; D179-Y183 PolarHBondContact O-N 3.46Å
180	V	90.2	Very high	86.4	Confident	0 Å²	0	74.1 Å²	74.1	0%	0	40%	0.404	C	S	.	.	H	α-helix	trans	-66.4	-42.8	177.6	-175.5	0	0	0	0	111.7	V152 L155 L156 I166 L175 L176 K177 Y183 I184	V152-V180 HydrophobicContact CG1-CG2 3.68Å; L155-V180 HydrophobicContact CB-CG1 3.75Å; L155-V180 HydrophobicContact CD1-CB 4.42Å; L155-V180 HydrophobicContact CD1-CG1 4.29Å; L156-V180 HydrophobicContact CD2-CG1 3.98Å; L156-V180 HydrophobicContact CD2-CG2 4.21Å; L156-V180 HydrophobicContact CG-CG1 4.46Å; L156-V180 HydrophobicContact CG-CG2 4.47Å; I166-V180 HydrophobicContact CD1-CB 4.35Å; I166-V180 HydrophobicContact CD1-CG1 4.27Å; I166-V180 HydrophobicContact CD1-CG2 4Å; L175-V180 HydrophobicContact CD1-CG2 4.44Å; L175-V180 HydrophobicContact CD2-CG2 3.69Å; L175-V180 HydrophobicContact CG-CG2 3.89Å; L176-V180 PolarHBondContact O-N 2.86Å; K177-V180 PolarHBondContact O-N 2.92Å; V180-Y183 PolarHBondContact O-N 3.3Å; V180-I184 HydrophobicContact CG1-CD1 3.81Å; V180-I184 HydrophobicContact CG1-CG1 4.38Å; V180-I184 VanDerWaalsContact O-CG1 3.25Å; V180-I184 WeakPolarHBondContact O-CG1 3.4Å; V180-I184 PolarHBondContact O-N 2.86Å
181	L	91.4	Very high	86.1	Confident	79 Å²	79	77.4 Å²	77.4	41%	0.414	42%	0.424	S	S	.	.	H	α-helix	trans	-66.2	-38.5	177.1	-71	174.9	0	0	0	112.2	L155 K177 G178 Y183 I184 A185	L155-L181 HydrophobicContact CD1-CD2 3.97Å; L155-L181 HydrophobicContact CD1-CG 4.07Å; L155-L181 HydrophobicContact CD2-CD2 4.32Å; K177-L181 HydrophobicContact CG-CD1 4.02Å; K177-L181 HydrophobicContact CG-CG 4.42Å; K177-L181 WeakPolarHBondContact O-CG 3.36Å; K177-L181 PolarHBondContact O-N 2.99Å; G178-L181 PolarHBondContact O-N 2.91Å; L181-Y183 VanDerWaalsContact C-N 3.34Å; L181-I184 PolarHBondContact O-N 2.92Å; L181-A185 VanDerWaalsContact O-CB 3.29Å; L181-A185 WeakPolarHBondContact O-CB 3.48Å; L181-A185 PolarHBondContact O-N 3.4Å
182	A	89.8	Confident	85.5	Confident	49 Å²	49	76.5 Å²	76.5	41%	0.405	42%	0.416	S	S	.	.	H	α-helix	trans	-65.1	-38.7	174.8	0	0	0	0	0	111.7	G178 D179 A185 N186	G178-A182 VanDerWaalsContact O-CB 3.31Å; G178-A182 WeakPolarHBondContact O-CB 3.4Å; G178-A182 PolarHBondContact O-N 3.44Å; D179-A182 PolarHBondContact O-N 3.44Å; A182-A185 PolarHBondContact O-N 2.73Å; A182-N186 WeakPolarHBondContact O-CB 3.19Å; A182-N186 VanDerWaalsContact O-CG 3.28Å; A182-N186 PolarHBondContact O-N 3.4Å
183	Y	90.1	Very high	84.4	Confident	49 Å²	49	73.4 Å²	73.4	19%	0.192	41%	0.41	C	S	.	.	H	α-helix	trans	-66.3	-44.8	174.5	-170.9	-89.8	0	0	0	112.3	I161 Q165 I166 D179 V180 L181 A185 N186 N187 I189	I161-Y183 HydrophobicContact CD1-CD1 4.17Å; I161-Y183 HydrophobicContact CD1-CE1 4.46Å; I161-Y183 HydrophobicContact CG2-CD1 4.08Å; I161-Y183 HydrophobicContact CG2-CE1 3.79Å; Q165-Y183 HydrophobicContact CB-CE2 4.43Å; Q165-Y183 PolarHBondContact OE1-OH 3.3Å; Q165-Y183 VanDerWaalsContact OE1-OH 3.04Å; I166-Y183 HydrophobicContact CB-CD2 4.39Å; I166-Y183 HydrophobicContact CD1-CD1 4.04Å; I166-Y183 HydrophobicContact CD1-CG 3.96Å; I166-Y183 HydrophobicContact CG1-CD1 4.04Å; I166-Y183 HydrophobicContact CG1-CD2 3.85Å; I166-Y183 HydrophobicContact CG1-CE1 4.42Å; I166-Y183 HydrophobicContact CG1-CE2 4.24Å; I166-Y183 HydrophobicContact CG1-CG 3.74Å; I166-Y183 HydrophobicContact CG2-CD2 4.31Å; I166-Y183 HydrophobicContact CG2-CG 4.36Å; D179-Y183 WeakPolarHBondContact O-CB 3.27Å; D179-Y183 PolarHBondContact O-N 3.46Å; V180-Y183 PolarHBondContact O-N 3.3Å; L181-Y183 VanDerWaalsContact C-N 3.34Å; Y183-A185 VanDerWaalsContact C-N 3.32Å; Y183-A185 PolarHBondContact O-N 3.14Å; Y183-N186 PolarHBondContact O-N 2.88Å; Y183-N187 VanDerWaalsContact CE1-ND2 3.35Å; Y183-N187 WeakPolarHBondContact CE1-ND2 3.41Å; Y183-N187 WeakPolarHBondContact O-CB 3.33Å; Y183-N187 PolarHBondContact O-N 3.03Å; Y183-N187 PolarHBondContact OH-ND2 2.96Å; Y183-I189 HydrophobicContact CD1-CD1 3.97Å; Y183-I189 HydrophobicContact CE1-CD1 3.68Å
184	I	90.6	Very high	82.8	Confident	22 Å²	22	75.8 Å²	75.8	11%	0.113	42%	0.423	C	S	.	.	H	α-helix	trans	-60.4	-42.8	174.9	-69.3	164.9	0	0	0	110.8	H159 I161 V180 L181 E188 I189	H159-I184 HydrophobicContact CB-CD1 4.5Å; I161-I184 HydrophobicContact CD1-CD1 4.22Å; I161-I184 HydrophobicContact CD1-CG1 3.54Å; V180-I184 HydrophobicContact CG1-CD1 3.81Å; V180-I184 HydrophobicContact CG1-CG1 4.38Å; V180-I184 VanDerWaalsContact O-CG1 3.25Å; V180-I184 WeakPolarHBondContact O-CG1 3.4Å; V180-I184 PolarHBondContact O-N 2.86Å; L181-I184 PolarHBondContact O-N 2.92Å; I184-E188 WeakPolarHBondContact O-CA 3.48Å; I184-E188 PolarHBondContact O-N 3.4Å; I184-I189 PolarHBondContact O-N 3.4Å
185	A	89	Confident	80.9	Confident	70 Å²	70	77.4 Å²	77.4	58%	0.579	44%	0.443	S	S	*	.	H	α-helix	trans	-67.7	-40.8	179.3	0	0	0	0	0	112.7	L181 A182 Y183	L181-A185 VanDerWaalsContact O-CB 3.29Å; L181-A185 WeakPolarHBondContact O-CB 3.48Å; L181-A185 PolarHBondContact O-N 3.4Å; A182-A185 PolarHBondContact O-N 2.73Å; Y183-A185 VanDerWaalsContact C-N 3.32Å; Y183-A185 PolarHBondContact O-N 3.14Å
186	N	89.7	Confident	78.7	Confident	136 Å²	136	84.8 Å²	84.8	73%	0.727	48%	0.477	S	S	*	.	H	α-helix	trans	-72.8	-30.3	180	-76	-13.3	0	0	0	113.3	A182 Y183	A182-N186 WeakPolarHBondContact O-CB 3.19Å; A182-N186 VanDerWaalsContact O-CG 3.28Å; A182-N186 PolarHBondContact O-N 3.4Å; Y183-N186 PolarHBondContact O-N 2.88Å
187	N	86.6	Confident	76.4	Confident	86 Å²	86	90.6 Å²	90.6	46%	0.46	50%	0.502	S	S	.	.	H	α-helix	trans	-101.4	3.5	-178.9	-73.3	0.5	0	0	0	113.9	Y183 I189	Y183-N187 VanDerWaalsContact CE1-ND2 3.35Å; Y183-N187 WeakPolarHBondContact CE1-ND2 3.41Å; Y183-N187 WeakPolarHBondContact O-CB 3.33Å; Y183-N187 PolarHBondContact O-N 3.03Å; Y183-N187 PolarHBondContact OH-ND2 2.96Å; N187-I189 HydrophobicContact CB-CD1 3.74Å; N187-I189 HydrophobicContact CB-CG1 3.63Å; N187-I189 PolarHBondContact O-N 2.82Å; N187-I189 VanDerWaalsContact O-N 3.14Å
188	E	81.9	Confident	74	Confident	172 Å²	172	94 Å²	94	80%	0.804	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.2	41.1	-178.1	-61.8	-172.2	160.1	0	0	113.6	I184 K190	I184-E188 WeakPolarHBondContact O-CA 3.48Å; I184-E188 PolarHBondContact O-N 3.4Å; E188-K190 PolarHBondContact O-N 3.01Å
189	I	79	Confident	71.3	Confident	46 Å²	46	96 Å²	96	24%	0.236	52%	0.524	C	S	.	.			trans	-76.5	115.3	-175.1	-55.9	171.7	0	0	0	108.8	H159 I161 Y183 I184 N187	H159-I189 HydrophobicContact CB-CG2 4.07Å; H159-I189 PolarHBondContact CD2-O 2.87Å; I161-I189 HydrophobicContact CD1-CD1 3.59Å; I161-I189 HydrophobicContact CD1-CG2 4.33Å; I161-I189 HydrophobicContact CG1-CD1 3.89Å; I161-I189 HydrophobicContact CG1-CG2 4.44Å; Y183-I189 HydrophobicContact CD1-CD1 3.97Å; Y183-I189 HydrophobicContact CE1-CD1 3.68Å; I184-I189 PolarHBondContact O-N 3.4Å; N187-I189 HydrophobicContact CB-CD1 3.74Å; N187-I189 HydrophobicContact CB-CG1 3.63Å; N187-I189 PolarHBondContact O-N 2.82Å; N187-I189 VanDerWaalsContact O-N 3.14Å
190	K	77.4	Confident	69.2	Low	177 Å²	177	101.2 Å²	101.2	77%	0.77	55%	0.55	S	S	*	*			trans	-77	145.1	174.2	-71.9	-178.8	-179.5	178	0	110.6	E188 V192	E188-K190 PolarHBondContact O-N 3.01Å; K190-V192 PolarHBondContact O-N 3.22Å
191	P	76	Confident	67	Low	78 Å²	78	107.2 Å²	107.2	51%	0.506	58%	0.583	S	S	.	*			trans	-60.9	127.3	178.7	23.3	-32.3	0	0	0	110.5	S158 V193	S158-P191 CarbonylContact O-C 3.6Å; P191-V193 VanDerWaalsContact C-N 3.26Å; P191-V193 HydrophobicContact CB-CG2 4.43Å; P191-V193 PolarHBondContact O-N 2.86Å
192	V	69.8	Low	64.7	Low	73 Å²	73	111.2 Å²	111.2	44%	0.442	60%	0.604	S	S	.	*			trans	-82.6	81.7	172.4	-175.7	0	0	0	0	106.4	S158 D160 K190 S194	S158-V192 PolarHBondContact O-N 3.22Å; D160-V192 HydrophobicContact CB-CG2 4.21Å; K190-V192 PolarHBondContact O-N 3.22Å; V192-S194 PolarHBondContact O-N 3.33Å
193	V	56.5	Low	63	Low	120 Å²	120	115.1 Å²	115.1	73%	0.727	62%	0.617	S	S	*	*			trans	-72	81.5	164.4	-161.1	0	0	0	0	106.2	P191 S195	P191-V193 VanDerWaalsContact C-N 3.26Å; P191-V193 HydrophobicContact CB-CG2 4.43Å; P191-V193 PolarHBondContact O-N 2.86Å; V193-S195 VanDerWaalsContact C-N 3.3Å; V193-S195 PolarHBondContact O-N 2.84Å
194	S	47.2	Very low	61	Low	77 Å²	77	118.2 Å²	118.2	54%	0.538	64%	0.643	S	S	.	*			trans	-71.3	95.8	169.3	56	0	0	0	0	107.7	V192 Q196	V192-S194 PolarHBondContact O-N 3.33Å; S194-Q196 PolarHBondContact O-N 2.79Å
195	S	44.7	Very low	58.7	Low	115 Å²	115	121.6 Å²	121.6	80%	0.804	67%	0.674	S	S	*	*			trans	-62.9	75	151.8	-12.3	0	0	0	0	106.9	V193	V193-S195 VanDerWaalsContact C-N 3.3Å; V193-S195 PolarHBondContact O-N 2.84Å
196	Q	43.2	Very low	56.8	Low	167 Å²	167	125.7 Å²	125.7	78%	0.78	69%	0.685	S	S	*	*			trans	-105.5	91.3	167	-82.9	-173.1	-12	0	0	108.1	S194 K198	S194-Q196 PolarHBondContact O-N 2.79Å; Q196-K198 PolarHBondContact O-N 2.93Å
197	E	40.2	Very low	54.6	Low	196 Å²	196	127.2 Å²	127.2	92%	0.916	69%	0.687	S	S	*	*			trans	-49.5	103.9	155	-74.2	173.2	143.1	0	0	108.7	S199	E197-S199 PolarHBondContact O-N 2.81Å
198	K	40.4	Very low	52.6	Low	191 Å²	191	129.4 Å²	129.4	83%	0.83	70%	0.704	S	S	*	*			trans	-71.9	111	153.9	-90.3	178.7	176	174.7	0	106.8	Q196 I200	Q196-K198 PolarHBondContact O-N 2.93Å; K198-I200 VanDerWaalsContact C-N 3.31Å; K198-I200 PolarHBondContact O-N 3.38Å
199	S	33.3	Very low	50.7	Low	92 Å²	92	126.9 Å²	126.9	64%	0.643	70%	0.7	S	S	*	*			trans	-48.7	94.3	159.5	152.2	0	0	0	0	109.5	E197 N201	E197-S199 PolarHBondContact O-N 2.81Å; S199-N201 PolarHBondContact OG-ND2 3.12Å
200	I	45.7	Very low	49.2	Very low	130 Å²	130	129.9 Å²	129.9	67%	0.667	73%	0.725	S	S	*	*			trans	-94.9	87.3	153.1	-58.3	175.7	0	0	0	104.1	K198 I203	K198-I200 VanDerWaalsContact C-N 3.31Å; K198-I200 PolarHBondContact O-N 3.38Å; I200-I203 HydrophobicContact CG2-CD1 4.28Å; I200-I203 HydrophobicContact CG2-CG1 4.44Å
201	N	43.6	Very low	47.8	Very low	127 Å²	127	126.3 Å²	126.3	68%	0.679	72%	0.722	S	S	*	*			trans	-64.2	141.7	164.2	-70.8	-23.8	0	0	0	107.7	S199	S199-N201 PolarHBondContact OG-ND2 3.12Å
202	D	44	Very low	46.8	Very low	162 Å²	162	126.9 Å²	126.9	87%	0.866	73%	0.734	S	S	*	*			trans	78.8	55.7	174.9	-54.9	-24.1	0	0	0	117.1
203	I	54	Low	46.2	Very low	131 Å²	131	127.5 Å²	127.5	67%	0.672	75%	0.747	S	S	*	*	S	Bend	trans	-131.5	131.4	146	-53.2	176.4	0	0	0	107.2	I200 A205	I200-I203 HydrophobicContact CG2-CD1 4.28Å; I200-I203 HydrophobicContact CG2-CG1 4.44Å; I203-A205 PolarHBondContact O-N 2.93Å
204	P	48.3	Very low	47	Very low	115 Å²	115	129.4 Å²	129.4	75%	0.747	75%	0.753	S	S	*	*			trans	-56.4	130.1	-176.3	-18.6	30.3	0	0	0	109.7	I206	P204-I206 PolarHBondContact O-N 3.38Å
205	A	42.2	Very low	48.6	Very low	92 Å²	92	132.4 Å²	132.4	76%	0.76	76%	0.762	S	S	*	*			trans	-51.7	104.9	174.6	0	0	0	0	0	109.5	I203 Q207	I203-A205 PolarHBondContact O-N 2.93Å; A205-Q207 VanDerWaalsContact C-N 3.31Å; A205-Q207 PolarHBondContact O-N 2.95Å
206	I	48.9	Very low	50.3	Low	157 Å²	157	133 Å²	133	81%	0.805	76%	0.761	S	S	*	*			trans	-62.3	107.2	154.3	-64.4	174.9	0	0	0	103.6	P204 T208	P204-I206 PolarHBondContact O-N 3.38Å; I206-T208 VanDerWaalsContact C-N 3.33Å; I206-T208 PolarHBondContact O-N 3.4Å
207	Q	44.7	Very low	52.2	Low	167 Å²	167	132.6 Å²	132.6	78%	0.78	76%	0.764	S	S	*	*			trans	-54.2	101.9	171.4	-69.7	174.7	-16.2	0	0	107.1	A205 V209	A205-Q207 VanDerWaalsContact C-N 3.31Å; A205-Q207 PolarHBondContact O-N 2.95Å; Q207-V209 PolarHBondContact O-N 2.93Å
208	T	42.9	Very low	54.3	Low	133 Å²	133	130.3 Å²	130.3	82%	0.816	76%	0.757	S	S	*	*			trans	-64.6	87.8	157.4	43.9	0	0	0	0	105.8	I206 S210	I206-T208 VanDerWaalsContact C-N 3.33Å; I206-T208 PolarHBondContact O-N 3.4Å; T208-S210 PolarHBondContact O-N 3.45Å
209	V	43.5	Very low	56.4	Low	118 Å²	118	127.7 Å²	127.7	72%	0.715	76%	0.757	S	S	*	*			trans	-51.7	110.3	159.1	-83.7	0	0	0	0	106.2	Q207 S211	Q207-V209 PolarHBondContact O-N 2.93Å; V209-S211 PolarHBondContact O-N 2.83Å
210	S	46.1	Very low	58.6	Low	110 Å²	110	126.2 Å²	126.2	77%	0.769	75%	0.746	S	S	*	*			trans	-62.3	85.3	164.9	56.8	0	0	0	0	107.3	T208 A212	T208-S210 PolarHBondContact O-N 3.45Å; S210-A212 PolarHBondContact O-N 2.76Å
211	S	48.8	Very low	60.3	Low	101 Å²	101	122.6 Å²	122.6	71%	0.706	73%	0.733	S	S	*	*			trans	-78.2	39.7	176.1	63.3	0	0	0	0	111.4	V209 A213	V209-S211 PolarHBondContact O-N 2.83Å; S211-A213 VanDerWaalsContact C-N 3.28Å; S211-A213 PolarHBondContact O-N 2.82Å
212	A	54.7	Low	62.1	Low	90 Å²	90	117.5 Å²	117.5	74%	0.744	71%	0.706	S	S	*	*			trans	-86.8	10.8	-175.7	0	0	0	0	0	113.5	S210	S210-A212 PolarHBondContact O-N 2.76Å
213	A	56.8	Low	63.7	Low	86 Å²	86	111.3 Å²	111.3	71%	0.711	67%	0.672	S	S	*	*	S	Bend	trans	-115.5	2.1	-164.4	0	0	0	0	0	116.3	S211	S211-A213 VanDerWaalsContact C-N 3.28Å; S211-A213 PolarHBondContact O-N 2.82Å
214	N	73.7	Confident	65.1	Low	161 Å²	161	112.9 Å²	112.9	86%	0.861	67%	0.669	S	S	*	*			trans	-131.6	51	-175.7	-64.1	-23.2	0	0	0	113.1
215	L	81.1	Confident	66.9	Low	140 Å²	140	110 Å²	110	73%	0.733	65%	0.648	S	S	*	*			trans	-121.4	134.5	169	-66.1	95.9	0	0	0	110.1
216	T	81.1	Confident	68.8	Low	126 Å²	126	106.6 Å²	106.6	77%	0.773	62%	0.618	S	S	*	*			trans	-116.2	109.5	170.8	52.2	0	0	0	0	108.6
217	D	82.6	Confident	70.4	Confident	159 Å²	159	103.2 Å²	103.2	85%	0.85	60%	0.598	S	S	*	*			trans	-80.6	122.4	176	-65.6	-24.4	0	0	0	109.7
218	I	84.6	Confident	72.5	Confident	148 Å²	148	97.5 Å²	97.5	76%	0.759	58%	0.579	S	S	*	*			trans	-109.9	126.9	175.8	-58.3	172.1	0	0	0	107.5
219	T	83.3	Confident	74.7	Confident	137 Å²	137	95.8 Å²	95.8	84%	0.84	56%	0.562	S	S	*	*	P	Polyproline II helix	trans	-66.7	133.1	175.1	50.1	0	0	0	0	110.4
220	S	80.4	Confident	76.8	Confident	60 Å²	60	94.5 Å²	94.5	42%	0.42	54%	0.544	S	S	.	.	P	Polyproline II helix	trans	-75.2	140.6	176.6	51	0	0	0	0	111	N225	S220-N225 WeakPolarHBondContact CB-OD1 3.41Å; S220-N225 PolarHBondContact OG-ND2 2.64Å; S220-N225 PolarHBondContact OG-OD1 2.8Å
221	S	81.9	Confident	78.9	Confident	55 Å²	55	91.3 Å²	91.3	39%	0.385	52%	0.518	S	S	.	.	P	Polyproline II helix	trans	-70.7	153.6	173.2	64.2	0	0	0	0	111.2	M223 R224 N225	S221-M223 VanDerWaalsContact C-N 3.28Å; S221-M223 PolarHBondContact O-N 2.82Å; S221-R224 WeakPolarHBondContact O-CA 3.13Å; S221-R224 WeakPolarHBondContact O-CB 3.38Å; S221-R224 PolarHBondContact O-N 3.29Å; S221-R224 WeakPolarHBondContact OG-CB 3.27Å; S221-R224 PolarHBondContact OG-N 3.05Å; S221-N225 PolarHBondContact O-N 3.49Å
222	N	79.7	Confident	81	Confident	20 Å²	20	89.7 Å²	89.7	11%	0.107	51%	0.507	C	S	.	.	H	α-helix	trans	-55.8	-42.6	177.1	-78.2	35.3	0	0	0	112.7	S42 N91 R224 N225 S226	S42-N222 PolarHBondContact OG-ND2 3.31Å; N91-N222 PolarHBondContact N-ND2 3.25Å; N91-N222 PolarHBondContact OD1-ND2 2.84Å; N91-N222 PolarHBondContact OD1-OD1 2.84Å; N222-R224 VanDerWaalsContact C-N 3.28Å; N222-R224 PolarHBondContact O-N 3.5Å; N222-N225 PolarHBondContact O-N 2.94Å; N222-S226 PolarHBondContact O-N 2.9Å; N222-S226 PolarHBondContact O-OG 2.97Å
223	M	78.3	Confident	82.8	Confident	31 Å²	31	90.2 Å²	90.2	15%	0.153	49%	0.494	C	S	.	.	H	α-helix	trans	-60.4	-36.8	175.2	-176.2	-174.6	-74.4	0	0	112.3	S221 S226 F227	S221-M223 VanDerWaalsContact C-N 3.28Å; S221-M223 PolarHBondContact O-N 2.82Å; M223-S226 PolarHBondContact O-OG 3.01Å; M223-F227 VanDerWaalsContact O-CB 3.32Å; M223-F227 WeakPolarHBondContact O-CB 3.26Å; M223-F227 PolarHBondContact O-N 3.44Å; M223-F227 VanDerWaalsContact O-N 3.12Å
224	R	83.7	Confident	84.5	Confident	165 Å²	165	86.2 Å²	86.2	62%	0.623	46%	0.461	S	S	*	.	H	α-helix	trans	-71.9	-37.3	176.4	-176.1	174.6	-73.9	179.2	-3.1	111.5	S221 N222 A228	S221-R224 WeakPolarHBondContact O-CA 3.13Å; S221-R224 WeakPolarHBondContact O-CB 3.38Å; S221-R224 PolarHBondContact O-N 3.29Å; S221-R224 WeakPolarHBondContact OG-CB 3.27Å; S221-R224 PolarHBondContact OG-N 3.05Å; N222-R224 VanDerWaalsContact C-N 3.28Å; N222-R224 PolarHBondContact O-N 3.5Å; R224-A228 VanDerWaalsContact O-CB 3.29Å; R224-A228 WeakPolarHBondContact O-CB 3.41Å; R224-A228 PolarHBondContact O-N 3.39Å
225	N	85.7	Confident	85.4	Confident	54 Å²	54	82.9 Å²	82.9	29%	0.289	44%	0.439	S	S	.	.	H	α-helix	trans	-65.6	-45.8	177.2	-67.4	-22.8	0	0	0	111.5	S220 S221 N222 F227 A228 Q229	S220-N225 WeakPolarHBondContact CB-OD1 3.41Å; S220-N225 PolarHBondContact OG-ND2 2.64Å; S220-N225 PolarHBondContact OG-OD1 2.8Å; S221-N225 PolarHBondContact O-N 3.49Å; N222-N225 PolarHBondContact O-N 2.94Å; N225-F227 VanDerWaalsContact C-N 3.34Å; N225-F227 PolarHBondContact O-N 2.88Å; N225-A228 PolarHBondContact O-N 3.44Å; N225-Q229 WeakPolarHBondContact O-CB 3.32Å; N225-Q229 PolarHBondContact O-N 3.5Å
226	S	82.2	Confident	86.1	Confident	20 Å²	20	83.7 Å²	83.7	14%	0.14	44%	0.443	C	S	.	.	H	α-helix	trans	-62.5	-41.8	176.7	63	0	0	0	0	111.8	D66 N222 M223 Q229 R230	D66-S226 WeakPolarHBondContact CB-OG 3.43Å; N222-S226 PolarHBondContact O-N 2.9Å; N222-S226 PolarHBondContact O-OG 2.97Å; M223-S226 PolarHBondContact O-OG 3.01Å; S226-Q229 PolarHBondContact O-N 2.95Å; S226-R230 WeakPolarHBondContact O-CG 3.41Å; S226-R230 PolarHBondContact O-N 2.98Å
227	F	83.1	Confident	86.5	Confident	87 Å²	87	80.4 Å²	80.4	38%	0.382	43%	0.425	S	S	.	.	H	α-helix	trans	-62.7	-46.2	174.9	-176.1	-104.2	0	0	0	112.1	M223 N225 Q229 R230 L231 L316	M223-F227 VanDerWaalsContact O-CB 3.32Å; M223-F227 WeakPolarHBondContact O-CB 3.26Å; M223-F227 PolarHBondContact O-N 3.44Å; M223-F227 VanDerWaalsContact O-N 3.12Å; N225-F227 VanDerWaalsContact C-N 3.34Å; N225-F227 PolarHBondContact O-N 2.88Å; F227-Q229 VanDerWaalsContact C-N 3.33Å; F227-Q229 PolarHBondContact O-N 3.38Å; F227-R230 PolarHBondContact O-N 3.01Å; F227-L231 HydrophobicContact CD1-CD1 3.8Å; F227-L231 HydrophobicContact CD1-CG 4.29Å; F227-L231 HydrophobicContact CE1-CD1 3.2Å; F227-L231 HydrophobicContact CE1-CG 3.95Å; F227-L231 HydrophobicContact CE2-CD1 4.33Å; F227-L231 HydrophobicContact CE2-CD2 4.41Å; F227-L231 HydrophobicContact CE2-CG 4.29Å; F227-L231 HydrophobicContact CZ-CD1 3.51Å; F227-L231 HydrophobicContact CZ-CD2 4.17Å; F227-L231 HydrophobicContact CZ-CG 3.95Å; F227-L231 WeakPolarHBondContact O-CG 3.34Å; F227-L231 PolarHBondContact O-N 2.71Å; F227-L316 HydrophobicContact CZ-CD2 4.45Å
228	A	88	Confident	87	Confident	47 Å²	47	73.1 Å²	73.1	39%	0.388	39%	0.386	S	S	.	.	H	α-helix	trans	-62.1	-40.4	178.1	0	0	0	0	0	112.2	R224 N225 S232	R224-A228 VanDerWaalsContact O-CB 3.29Å; R224-A228 WeakPolarHBondContact O-CB 3.41Å; R224-A228 PolarHBondContact O-N 3.39Å; N225-A228 PolarHBondContact O-N 3.44Å; A228-S232 WeakPolarHBondContact O-CB 3.45Å; A228-S232 PolarHBondContact O-N 3.45Å; A228-S232 PolarHBondContact O-OG 2.82Å
229	Q	90	Very high	87.5	Confident	97 Å²	97	68.8 Å²	68.8	45%	0.453	37%	0.368	S	S	.	.	H	α-helix	trans	-61.4	-51.2	174.6	-178.7	179.3	-9.8	0	0	111	N225 S226 F227 L231 S232 E233	N225-Q229 WeakPolarHBondContact O-CB 3.32Å; N225-Q229 PolarHBondContact O-N 3.5Å; S226-Q229 PolarHBondContact O-N 2.95Å; F227-Q229 VanDerWaalsContact C-N 3.33Å; F227-Q229 PolarHBondContact O-N 3.38Å; Q229-L231 PolarHBondContact O-N 3.42Å; Q229-S232 WeakPolarHBondContact O-CB 3.23Å; Q229-S232 PolarHBondContact O-N 2.68Å; Q229-S232 VanDerWaalsContact O-N 3.14Å; Q229-E233 HydrophobicContact CG-CG 4.43Å; Q229-E233 VanDerWaalsContact CG-OE1 3.27Å; Q229-E233 WeakPolarHBondContact CG-OE1 3.27Å; Q229-E233 PolarHBondContact NE2-OE1 2.92Å; Q229-E233 WeakPolarHBondContact O-CG 3.45Å; Q229-E233 PolarHBondContact O-N 2.94Å
230	R	87.9	Confident	88	Confident	90 Å²	90	63.6 Å²	63.6	34%	0.34	33%	0.334	S	S	.	.	H	α-helix	trans	-58.8	-44.4	179.2	-76.6	-178.8	176	156.5	6	113.2	T37 D66 S226 F227 S232 E233 S234	T37-R230 VanDerWaalsContact CB-NH2 3.28Å; T37-R230 PolarHBondContact OG1-NH2 3.37Å; D66-R230 IonicContact OD2-CZ 3.17Å; D66-R230 IonicContact OD2-NH1 3.89Å; D66-R230 IonicContact OD2-NH2 3.65Å; D66-R230 PolarHBondContact OD2-NH2 3.28Å; S226-R230 WeakPolarHBondContact O-CG 3.41Å; S226-R230 PolarHBondContact O-N 2.98Å; F227-R230 PolarHBondContact O-N 3.01Å; R230-S232 VanDerWaalsContact C-N 3.31Å; R230-S232 PolarHBondContact O-N 3.28Å; R230-E233 PolarHBondContact O-N 3.33Å; R230-S234 WeakPolarHBondContact O-CB 3.32Å; R230-S234 PolarHBondContact O-N 2.94Å
231	L	89.6	Confident	88.7	Confident	44 Å²	44	62.7 Å²	62.7	23%	0.23	32%	0.323	C	S	.	.	H	α-helix	trans	-64	-39.5	177.2	-72.7	-173.4	0	0	0	111.8	F227 Q229 K235 I374	F227-L231 HydrophobicContact CD1-CD1 3.8Å; F227-L231 HydrophobicContact CD1-CG 4.29Å; F227-L231 HydrophobicContact CE1-CD1 3.2Å; F227-L231 HydrophobicContact CE1-CG 3.95Å; F227-L231 HydrophobicContact CE2-CD1 4.33Å; F227-L231 HydrophobicContact CE2-CD2 4.41Å; F227-L231 HydrophobicContact CE2-CG 4.29Å; F227-L231 HydrophobicContact CZ-CD1 3.51Å; F227-L231 HydrophobicContact CZ-CD2 4.17Å; F227-L231 HydrophobicContact CZ-CG 3.95Å; F227-L231 WeakPolarHBondContact O-CG 3.34Å; F227-L231 PolarHBondContact O-N 2.71Å; Q229-L231 PolarHBondContact O-N 3.42Å; L231-K235 VanDerWaalsContact O-CB 3.27Å; L231-K235 WeakPolarHBondContact O-CB 3.26Å; L231-K235 PolarHBondContact O-N 3.3Å; L231-I374 HydrophobicContact CD2-CB 4.2Å; L231-I374 HydrophobicContact CD2-CD1 4.46Å; L231-I374 HydrophobicContact CD2-CG2 4.21Å
232	S	92.6	Very high	89.4	Confident	66 Å²	66	64.5 Å²	64.5	46%	0.462	32%	0.322	S	S	.	.	H	α-helix	trans	-65.1	-47	177.4	-58.1	0	0	0	0	110.9	A228 Q229 R230 K235 L236	A228-S232 WeakPolarHBondContact O-CB 3.45Å; A228-S232 PolarHBondContact O-N 3.45Å; A228-S232 PolarHBondContact O-OG 2.82Å; Q229-S232 WeakPolarHBondContact O-CB 3.23Å; Q229-S232 PolarHBondContact O-N 2.68Å; Q229-S232 VanDerWaalsContact O-N 3.14Å; R230-S232 VanDerWaalsContact C-N 3.31Å; R230-S232 PolarHBondContact O-N 3.28Å; S232-K235 PolarHBondContact O-N 3.44Å; S232-L236 WeakPolarHBondContact O-CB 3.48Å; S232-L236 WeakPolarHBondContact O-CD1 3.33Å; S232-L236 WeakPolarHBondContact O-CG 3.33Å; S232-L236 PolarHBondContact O-N 3.35Å
233	E	91.8	Very high	90.1	Very high	101 Å²	101	64.9 Å²	64.9	47%	0.472	32%	0.324	S	S	.	.	H	α-helix	trans	-60.4	-47.1	176.4	-72.9	171.5	-176.5	0	0	111.6	Q229 R230 K235 L236 S237	Q229-E233 HydrophobicContact CG-CG 4.43Å; Q229-E233 VanDerWaalsContact CG-OE1 3.27Å; Q229-E233 WeakPolarHBondContact CG-OE1 3.27Å; Q229-E233 PolarHBondContact NE2-OE1 2.92Å; Q229-E233 WeakPolarHBondContact O-CG 3.45Å; Q229-E233 PolarHBondContact O-N 2.94Å; R230-E233 PolarHBondContact O-N 3.33Å; E233-K235 PolarHBondContact O-N 2.87Å; E233-L236 PolarHBondContact O-N 3.06Å; E233-S237 VanDerWaalsContact O-CB 3.23Å; E233-S237 WeakPolarHBondContact O-CB 3.37Å; E233-S237 PolarHBondContact O-N 3.38Å; E233-S237 PolarHBondContact O-OG 3.26Å
234	S	92.7	Very high	91	Very high	2 Å²	2	70.8 Å²	70.8	1%	0.014	34%	0.344	C	S	.	.	H	α-helix	trans	-60	-48.1	177.3	176.7	0	0	0	0	111.7	R230 L236 S237 I238 V375	R230-S234 WeakPolarHBondContact O-CB 3.32Å; R230-S234 PolarHBondContact O-N 2.94Å; S234-L236 VanDerWaalsContact C-N 3.32Å; S234-L236 PolarHBondContact O-N 3.27Å; S234-S237 PolarHBondContact O-N 3.17Å; S234-S237 PolarHBondContact O-OG 2.67Å; S234-I238 WeakPolarHBondContact O-CB 3.38Å; S234-I238 PolarHBondContact O-N 3.06Å; S234-V375 WeakPolarHBondContact CB-O 3.49Å; S234-V375 PolarHBondContact OG-O 3.46Å
235	K	94.2	Very high	91.5	Very high	92 Å²	92	64 Å²	64	40%	0.4	32%	0.324	S	S	.	.	H	α-helix	trans	-70.9	-27.4	-175.8	-168.5	53.6	174	163.2	0	113.6	L231 S232 E233 Y242 I374	L231-K235 VanDerWaalsContact O-CB 3.27Å; L231-K235 WeakPolarHBondContact O-CB 3.26Å; L231-K235 PolarHBondContact O-N 3.3Å; S232-K235 PolarHBondContact O-N 3.44Å; E233-K235 PolarHBondContact O-N 2.87Å; K235-Y242 PolarHBondContact NZ-OH 2.89Å; K235-I374 HydrophobicContact CB-CD1 4.26Å; K235-I374 HydrophobicContact CB-CG2 4.24Å; K235-I374 HydrophobicContact CD-CD1 4.5Å; K235-I374 HydrophobicContact CD-CG1 4.32Å; K235-I374 HydrophobicContact CG-CD1 4.37Å
236	L	94.2	Very high	91.9	Very high	156 Å²	156	66 Å²	66	82%	0.817	34%	0.337	S	S	*	.	H	α-helix	trans	-81.8	-34.9	175.4	-70.4	171	0	0	0	112.8	S232 E233 S234	S232-L236 WeakPolarHBondContact O-CB 3.48Å; S232-L236 WeakPolarHBondContact O-CD1 3.33Å; S232-L236 WeakPolarHBondContact O-CG 3.33Å; S232-L236 PolarHBondContact O-N 3.35Å; E233-L236 PolarHBondContact O-N 3.06Å; S234-L236 VanDerWaalsContact C-N 3.32Å; S234-L236 PolarHBondContact O-N 3.27Å
237	S	91.1	Very high	92.4	Very high	58 Å²	58	65.3 Å²	65.3	41%	0.406	33%	0.333	S	S	.	.	H	α-helix	trans	-88.9	-35	-174.6	61.4	0	0	0	0	114.1	E233 S234 R418	E233-S237 VanDerWaalsContact O-CB 3.23Å; E233-S237 WeakPolarHBondContact O-CB 3.37Å; E233-S237 PolarHBondContact O-N 3.38Å; E233-S237 PolarHBondContact O-OG 3.26Å; S234-S237 PolarHBondContact O-N 3.17Å; S234-S237 PolarHBondContact O-OG 2.67Å; S237-R418 PolarHBondContact O-NH1 2.78Å
238	I	92.8	Very high	92.8	Very high	6 Å²	6	67.6 Å²	67.6	3%	0.031	34%	0.339	C	S	.	.	S	Bend	trans	-94.2	121.4	-176	-60.7	175.7	0	0	0	109.9	S234 H240 V375 H377 D416	S234-I238 WeakPolarHBondContact O-CB 3.38Å; S234-I238 PolarHBondContact O-N 3.06Å; I238-H240 VanDerWaalsContact C-N 3.33Å; I238-H240 PolarHBondContact O-N 3.28Å; I238-H240 PolarHBondContact O-ND1 3.2Å; I238-V375 HydrophobicContact CD1-CB 4.15Å; I238-V375 HydrophobicContact CD1-CG1 4.11Å; I238-H377 HydrophobicContact CD1-CB 4.34Å; I238-D416 HydrophobicContact CG2-CB 3.61Å
239	P	93.8	Very high	93.1	Very high	57 Å²	57	65.4 Å²	65.4	37%	0.37	32%	0.321	S	S	.	.			trans	-71.1	91.2	167.3	30.3	-31.7	0	0	0	109.4	E241 S417 R418	P239-E241 PolarHBondContact O-N 2.67Å; P239-S417 WeakPolarHBondContact CG-OG 3.01Å; P239-S417 PolarHBondContact O-N 3.12Å; P239-S417 PolarHBondContact O-OG 2.87Å; P239-S417 VanDerWaalsContact O-OG 3.05Å; P239-R418 HydrophobicContact CG-CG 3.59Å
240	H	94.7	Very high	93.2	Very high	27 Å²	27	62.9 Å²	62.9	13%	0.125	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	127.8	-177.5	-74.6	66.5	0	0	0	111.5	I238 Y242 V375 M415	I238-H240 VanDerWaalsContact C-N 3.33Å; I238-H240 PolarHBondContact O-N 3.28Å; I238-H240 PolarHBondContact O-ND1 3.2Å; H240-Y242 HydrophobicContact CB-CE1 4.23Å; H240-Y242 HydrophobicContact CB-CE2 4.22Å; H240-V375 PolarHBondContact NE2-N 2.92Å; H240-M415 WeakPolarHBondContact CA-O 3.16Å
241	E	94.8	Very high	93.4	Very high	42 Å²	42	65.2 Å²	65.2	20%	0.196	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	150.6	166.2	-165.7	-175.2	149.4	0	0	110.4	P239 S414 M415 E422	P239-E241 PolarHBondContact O-N 2.67Å; E241-S414 WeakPolarHBondContact O-CA 3.49Å; E241-M415 HydrophobicContact CB-CG 4.07Å; E241-M415 PolarHBondContact N-O 2.74Å; E241-M415 PolarHBondContact O-N 3.01Å; E241-E422 VanDerWaalsContact OE1-CG 3.25Å; E241-E422 WeakPolarHBondContact OE1-CG 3.4Å
242	Y	96.4	Very high	93.6	Very high	93 Å²	93	63.1 Å²	63.1	37%	0.365	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	123.4	-173.1	-54.3	-70.3	0	0	0	111.2	K235 H240 T372 L413 S414	K235-Y242 PolarHBondContact NZ-OH 2.89Å; H240-Y242 HydrophobicContact CB-CE1 4.23Å; H240-Y242 HydrophobicContact CB-CE2 4.22Å; Y242-T372 HydrophobicContact CD1-CG2 3.87Å; Y242-T372 HydrophobicContact CE1-CG2 4.29Å; Y242-T372 HydrophobicContact CG-CG2 4.2Å; Y242-L413 WeakPolarHBondContact CA-O 3.38Å; Y242-S414 WeakPolarHBondContact CD1-OG 3.25Å
243	I	95.6	Very high	93.6	Very high	28 Å²	28	62.1 Å²	62.1	14%	0.144	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	133.6	177.5	-60.9	167.6	0	0	0	108.9	T412 L413 A425 L429	I243-T412 CarbonylContact O-C 3.6Å; I243-T412 WeakPolarHBondContact O-CA 3.26Å; I243-L413 PolarHBondContact N-O 3.29Å; I243-L413 PolarHBondContact O-N 3.44Å; I243-A425 HydrophobicContact CD1-CB 3.33Å; I243-L429 HydrophobicContact CB-CD1 3.98Å; I243-L429 HydrophobicContact CG2-CD1 3.52Å
244	R	96.2	Very high	93.6	Very high	155 Å²	155	62.9 Å²	62.9	59%	0.585	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.4	135.2	-176.5	-175.8	-177.9	63.9	179.8	-1	110.4	E370 T410 L411	R244-E370 VanDerWaalsContact CD-OE2 3.31Å; R244-E370 WeakPolarHBondContact CD-OE2 3.42Å; R244-E370 IonicContact CZ-OE2 2.91Å; R244-E370 IonicContact NE-OE2 3.79Å; R244-E370 IonicContact NH1-OE1 3.45Å; R244-E370 IonicContact NH1-OE2 2.75Å; R244-E370 PolarHBondContact NH1-OE2 3.43Å; R244-T410 HydrophobicContact CG-CG2 3.67Å; R244-L411 CarbonylContact C-O 3.5Å; R244-L411 WeakPolarHBondContact CA-O 3.49Å
245	A	94.6	Very high	93.5	Very high	23 Å²	23	63.8 Å²	63.8	19%	0.19	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	150.3	171.7	0	0	0	0	0	110.4	L411 L429	A245-L411 PolarHBondContact N-O 2.96Å; A245-L411 PolarHBondContact O-N 3.27Å; A245-L429 HydrophobicContact CB-CB 4.21Å; A245-L429 HydrophobicContact CB-CD1 4.27Å
246	T	93.6	Very high	93.4	Very high	94 Å²	94	59.8 Å²	59.8	58%	0.577	29%	0.289	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.3	131.6	176	52.3	0	0	0	0	108.9	I409	T246-I409 WeakPolarHBondContact CA-O 3.46Å
247	A	92.2	Very high	93.2	Very high	6 Å²	6	56.4 Å²	56.4	5%	0.05	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	133.4	177	0	0	0	0	0	110.1	D408 I409 C433	A247-D408 WeakPolarHBondContact O-CA 3.39Å; A247-I409 HydrophobicContact CB-CG2 4.01Å; A247-I409 PolarHBondContact N-O 2.98Å; A247-I409 PolarHBondContact O-N 3.21Å; A247-C433 HydrophobicContact CB-CB 3.9Å
248	R	92.5	Very high	93.2	Very high	135 Å²	135	59.2 Å²	59.2	51%	0.509	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	121.8	173.2	-177.9	172.1	-66.1	154.9	-2.7	109.4	D250 S406 D408 G437	R248-D250 VanDerWaalsContact CD-OD2 3.25Å; R248-D250 WeakPolarHBondContact CD-OD2 3.23Å; R248-D250 WeakPolarHBondContact CG-OD2 3.4Å; R248-S406 PolarHBondContact NE-OG 3.25Å; R248-D408 WeakPolarHBondContact CA-OD1 3.34Å; R248-D408 WeakPolarHBondContact CB-OD1 3.45Å; R248-D408 WeakPolarHBondContact CG-OD1 3.37Å; R248-D408 IonicContact NE-OD1 3.06Å; R248-D408 PolarHBondContact NE-OD1 2.79Å; R248-G437 WeakPolarHBondContact O-CA 3.25Å
249	I	93.2	Very high	93	Very high	1 Å²	1	60.4 Å²	60.4	1%	0.005	29%	0.288	C	S	.	.			trans	-110.3	14.7	-170.7	59.2	162.4	0	0	0	113.9	R251 L252 N253 I269 D388 T407 I409	I249-R251 VanDerWaalsContact C-N 3.31Å; I249-R251 PolarHBondContact O-N 2.99Å; I249-L252 HydrophobicContact CB-CB 4.26Å; I249-L252 HydrophobicContact CB-CD2 4.48Å; I249-L252 HydrophobicContact CG2-CD2 4.44Å; I249-L252 WeakPolarHBondContact O-CA 3.48Å; I249-L252 WeakPolarHBondContact O-CB 3.38Å; I249-L252 PolarHBondContact O-N 3.27Å; I249-N253 PolarHBondContact O-N 2.94Å; I249-I269 HydrophobicContact CD1-CD1 4.25Å; I249-D388 HydrophobicContact CD1-CB 3.82Å; I249-T407 HydrophobicContact CD1-CG2 3.91Å; I249-T407 HydrophobicContact CG1-CG2 3.81Å; I249-T407 VanDerWaalsContact CG1-O 3.28Å; I249-T407 WeakPolarHBondContact CG1-O 3.49Å; I249-T407 PolarHBondContact N-O 2.85Å; I249-I409 HydrophobicContact CD1-CB 4.41Å; I249-I409 HydrophobicContact CG2-CB 4.29Å; I249-I409 HydrophobicContact CG2-CG2 3.62Å
250	D	92.5	Very high	92.7	Very high	45 Å²	45	62.7 Å²	62.7	24%	0.241	29%	0.292	C	S	.	.	H	α-helix	trans	-55.1	-45.4	-178.8	-62.5	-46.1	0	0	0	112.3	R248 L252 N253 E254 S406 T407	R248-D250 VanDerWaalsContact CD-OD2 3.25Å; R248-D250 WeakPolarHBondContact CD-OD2 3.23Å; R248-D250 WeakPolarHBondContact CG-OD2 3.4Å; D250-L252 VanDerWaalsContact C-N 3.28Å; D250-L252 PolarHBondContact O-N 2.87Å; D250-N253 WeakPolarHBondContact O-CB 3.38Å; D250-N253 PolarHBondContact O-N 3.05Å; D250-E254 WeakPolarHBondContact O-CG 3.47Å; D250-E254 PolarHBondContact O-N 3.28Å; D250-S406 WeakPolarHBondContact OD2-CB 3.36Å; D250-T407 WeakPolarHBondContact OD1-CB 3.32Å; D250-T407 PolarHBondContact OD1-N 3.36Å; D250-T407 PolarHBondContact OD1-OG1 3.42Å
251	R	92	Very high	92.4	Very high	138 Å²	138	67.2 Å²	67.2	52%	0.521	32%	0.322	S	S	.	.	H	α-helix	trans	-63.7	-32.5	176.3	-66.4	-175.7	-179.7	169.9	3.7	113.2	I249 L255 G437 D438 P440	I249-R251 VanDerWaalsContact C-N 3.31Å; I249-R251 PolarHBondContact O-N 2.99Å; R251-L255 WeakPolarHBondContact O-CB 3.44Å; R251-L255 PolarHBondContact O-N 2.99Å; R251-G437 WeakPolarHBondContact CD-O 3.47Å; R251-D438 PolarHBondContact NH1-O 3.22Å; R251-P440 HydrophobicContact CB-CG 3.93Å
252	L	93.2	Very high	91.9	Very high	1 Å²	1	71.6 Å²	71.6	1%	0.005	35%	0.346	C	S	.	.	H	α-helix	trans	-70.9	-40.8	177.1	177.4	62.5	0	0	0	110.6	I249 D250 E254 L255 I256 I269 F272 L436 P440	I249-L252 HydrophobicContact CB-CB 4.26Å; I249-L252 HydrophobicContact CB-CD2 4.48Å; I249-L252 HydrophobicContact CG2-CD2 4.44Å; I249-L252 WeakPolarHBondContact O-CA 3.48Å; I249-L252 WeakPolarHBondContact O-CB 3.38Å; I249-L252 PolarHBondContact O-N 3.27Å; D250-L252 VanDerWaalsContact C-N 3.28Å; D250-L252 PolarHBondContact O-N 2.87Å; L252-E254 VanDerWaalsContact C-N 3.34Å; L252-L255 PolarHBondContact O-N 2.58Å; L252-I256 HydrophobicContact CD1-CD1 4.25Å; L252-I256 HydrophobicContact CD1-CG1 4.37Å; L252-I256 HydrophobicContact CG-CD1 4Å; L252-I256 VanDerWaalsContact O-CG1 3.26Å; L252-I256 WeakPolarHBondContact O-CG1 3.34Å; L252-I256 PolarHBondContact O-N 3.45Å; L252-I269 HydrophobicContact CD2-CG2 4.24Å; L252-F272 HydrophobicContact CD1-CB 3.99Å; L252-F272 HydrophobicContact CD1-CD1 3.65Å; L252-F272 HydrophobicContact CD1-CD2 3.97Å; L252-F272 HydrophobicContact CD1-CE1 4.07Å; L252-F272 HydrophobicContact CD1-CE2 4.39Å; L252-F272 HydrophobicContact CD1-CG 3.6Å; L252-F272 HydrophobicContact CD1-CZ 4.42Å; L252-F272 HydrophobicContact CD2-CB 4.2Å; L252-L436 HydrophobicContact CD2-CD2 4.05Å; L252-P440 HydrophobicContact CB-CB 4.23Å; L252-P440 HydrophobicContact CD1-CB 3.88Å
253	N	92.7	Very high	91.1	Very high	44 Å²	44	69 Å²	69	24%	0.235	34%	0.341	C	S	.	.	H	α-helix	trans	-61.7	-43.5	175	-73.9	-25.1	0	0	0	111.3	I249 D250 I256 T257	I249-N253 PolarHBondContact O-N 2.94Å; D250-N253 WeakPolarHBondContact O-CB 3.38Å; D250-N253 PolarHBondContact O-N 3.05Å; N253-I256 PolarHBondContact O-N 3.38Å; N253-T257 VanDerWaalsContact O-CG2 3.29Å; N253-T257 WeakPolarHBondContact O-CG2 3.42Å; N253-T257 PolarHBondContact O-N 3.32Å
254	E	92.5	Very high	90.5	Very high	117 Å²	117	76 Å²	76	55%	0.547	38%	0.38	S	S	.	.	H	α-helix	trans	-56.8	-51.3	172.1	-70	171.5	178.7	0	0	111.2	D250 L252 I256 T257 E258	D250-E254 WeakPolarHBondContact O-CG 3.47Å; D250-E254 PolarHBondContact O-N 3.28Å; L252-E254 VanDerWaalsContact C-N 3.34Å; E254-I256 VanDerWaalsContact C-N 3.34Å; E254-I256 PolarHBondContact O-N 3Å; E254-T257 PolarHBondContact O-N 3.09Å; E254-T257 PolarHBondContact O-OG1 2.73Å; E254-E258 PolarHBondContact O-N 2.92Å
255	L	91.2	Very high	89.9	Confident	21 Å²	21	70.6 Å²	70.6	11%	0.11	36%	0.361	C	S	.	.	H	α-helix	trans	-59	-42.5	178.8	-174.5	68.4	0	0	0	112.7	R251 L252 T257 E258 L259 F272 P440 L444	R251-L255 WeakPolarHBondContact O-CB 3.44Å; R251-L255 PolarHBondContact O-N 2.99Å; L252-L255 PolarHBondContact O-N 2.58Å; L255-T257 VanDerWaalsContact C-N 3.28Å; L255-T257 PolarHBondContact O-N 3.06Å; L255-E258 PolarHBondContact O-N 2.68Å; L255-L259 HydrophobicContact CD1-CD1 4.49Å; L255-L259 HydrophobicContact CD2-CD1 4.48Å; L255-L259 HydrophobicContact CG-CD1 3.97Å; L255-L259 HydrophobicContact CG-CG 4.43Å; L255-L259 WeakPolarHBondContact O-CB 3.45Å; L255-L259 VanDerWaalsContact O-CG 3.27Å; L255-L259 WeakPolarHBondContact O-CG 3.31Å; L255-L259 PolarHBondContact O-N 3.17Å; L255-F272 HydrophobicContact CD2-CE1 4.24Å; L255-P440 HydrophobicContact CD2-CB 3.88Å; L255-P440 HydrophobicContact CD2-CG 4.42Å; L255-L444 HydrophobicContact CD1-CD1 4.16Å; L255-L444 HydrophobicContact CD2-CD1 4.27Å; L255-L444 HydrophobicContact CD2-CG 4.48Å
256	I	91	Very high	89.5	Confident	8 Å²	8	75.2 Å²	75.2	4%	0.041	38%	0.383	C	S	.	.	H	α-helix	trans	-61.3	-40	176.7	-70.9	168.8	0	0	0	110.5	L252 N253 E254 L259 K260 I269 F272	L252-I256 HydrophobicContact CD1-CD1 4.25Å; L252-I256 HydrophobicContact CD1-CG1 4.37Å; L252-I256 HydrophobicContact CG-CD1 4Å; L252-I256 VanDerWaalsContact O-CG1 3.26Å; L252-I256 WeakPolarHBondContact O-CG1 3.34Å; L252-I256 PolarHBondContact O-N 3.45Å; N253-I256 PolarHBondContact O-N 3.38Å; E254-I256 VanDerWaalsContact C-N 3.34Å; E254-I256 PolarHBondContact O-N 3Å; I256-L259 PolarHBondContact O-N 3.09Å; I256-K260 HydrophobicContact CG2-CD 4.02Å; I256-K260 HydrophobicContact CG2-CG 4.5Å; I256-K260 WeakPolarHBondContact O-CB 3.38Å; I256-K260 VanDerWaalsContact O-CG 3.26Å; I256-K260 WeakPolarHBondContact O-CG 3.3Å; I256-K260 PolarHBondContact O-N 3.01Å; I256-I269 HydrophobicContact CD1-CB 4.5Å; I256-I269 HydrophobicContact CD1-CG1 3.67Å; I256-F272 HydrophobicContact CD1-CD2 3.98Å; I256-F272 HydrophobicContact CD1-CE2 3.88Å; I256-F272 HydrophobicContact CG1-CD2 4.08Å; I256-F272 HydrophobicContact CG1-CE2 3.47Å; I256-F272 VanDerWaalsContact CG1-CE2 3.47Å; I256-F272 HydrophobicContact CG1-CZ 4.03Å
257	T	91.2	Very high	89.3	Confident	86 Å²	86	71.6 Å²	71.6	53%	0.528	36%	0.359	S	S	.	.	H	α-helix	trans	-65.7	-39.7	177.2	63.2	0	0	0	0	111.9	N253 E254 L255 V261	N253-T257 VanDerWaalsContact O-CG2 3.29Å; N253-T257 WeakPolarHBondContact O-CG2 3.42Å; N253-T257 PolarHBondContact O-N 3.32Å; E254-T257 PolarHBondContact O-N 3.09Å; E254-T257 PolarHBondContact O-OG1 2.73Å; L255-T257 VanDerWaalsContact C-N 3.28Å; L255-T257 PolarHBondContact O-N 3.06Å; T257-V261 WeakPolarHBondContact O-CG2 3.34Å; T257-V261 PolarHBondContact O-N 2.85Å
258	E	90.2	Very high	89.3	Confident	116 Å²	116	74.1 Å²	74.1	54%	0.542	38%	0.377	S	S	.	.	H	α-helix	trans	-65.3	-43.6	175.5	-67.5	179.9	175	0	0	112.2	E254 L255 K260 V261 N262	E254-E258 PolarHBondContact O-N 2.92Å; L255-E258 PolarHBondContact O-N 2.68Å; E258-K260 VanDerWaalsContact C-N 3.34Å; E258-K260 PolarHBondContact O-N 2.98Å; E258-V261 PolarHBondContact O-N 2.65Å; E258-N262 PolarHBondContact O-N 2.58Å; E258-N262 PolarHBondContact O-ND2 3.31Å
259	L	88.5	Confident	89.3	Confident	31 Å²	31	69 Å²	69	16%	0.162	36%	0.359	C	S	.	.	H	α-helix	trans	-66.6	-35.6	179.9	-69.9	169.6	0	0	0	112.5	L255 I256 V261 N262 S263 F267 F272 L444	L255-L259 HydrophobicContact CD1-CD1 4.49Å; L255-L259 HydrophobicContact CD2-CD1 4.48Å; L255-L259 HydrophobicContact CG-CD1 3.97Å; L255-L259 HydrophobicContact CG-CG 4.43Å; L255-L259 WeakPolarHBondContact O-CB 3.45Å; L255-L259 VanDerWaalsContact O-CG 3.27Å; L255-L259 WeakPolarHBondContact O-CG 3.31Å; L255-L259 PolarHBondContact O-N 3.17Å; I256-L259 PolarHBondContact O-N 3.09Å; L259-V261 PolarHBondContact O-N 3.26Å; L259-N262 PolarHBondContact O-N 3.47Å; L259-S263 PolarHBondContact O-N 3.29Å; L259-S263 PolarHBondContact O-OG 2.94Å; L259-F267 HydrophobicContact CB-CD2 3.84Å; L259-F267 HydrophobicContact CB-CE2 3.9Å; L259-F267 HydrophobicContact CD1-CD2 4.5Å; L259-F272 HydrophobicContact CD1-CE1 4.43Å; L259-F272 HydrophobicContact CD1-CZ 3.8Å; L259-L444 HydrophobicContact CD1-CD1 4.34Å; L259-L444 HydrophobicContact CD1-CD2 3.83Å; L259-L444 HydrophobicContact CD2-CD1 4.16Å; L259-L444 HydrophobicContact CD2-CD2 4.45Å
260	K	87	Confident	89.3	Confident	105 Å²	105	70.6 Å²	70.6	46%	0.457	37%	0.368	S	S	.	.	H	α-helix	trans	-63.9	-27.7	174.2	-77.7	171.9	178.3	174.2	0	113	I256 E258	I256-K260 HydrophobicContact CG2-CD 4.02Å; I256-K260 HydrophobicContact CG2-CG 4.5Å; I256-K260 WeakPolarHBondContact O-CB 3.38Å; I256-K260 VanDerWaalsContact O-CG 3.26Å; I256-K260 WeakPolarHBondContact O-CG 3.3Å; I256-K260 PolarHBondContact O-N 3.01Å; E258-K260 VanDerWaalsContact C-N 3.34Å; E258-K260 PolarHBondContact O-N 2.98Å
261	V	88.8	Confident	89.4	Confident	123 Å²	123	68.6 Å²	68.6	75%	0.745	36%	0.357	S	S	*	.	H	α-helix	trans	-77.8	-36	175.6	175.3	0	0	0	0	111.1	T257 E258 L259	T257-V261 WeakPolarHBondContact O-CG2 3.34Å; T257-V261 PolarHBondContact O-N 2.85Å; E258-V261 PolarHBondContact O-N 2.65Å; L259-V261 PolarHBondContact O-N 3.26Å
262	N	84.6	Confident	89.5	Confident	134 Å²	134	62 Å²	62	72%	0.717	33%	0.332	S	S	*	.	H	α-helix	trans	-89.4	-13.4	-173.9	-67.6	-34.1	0	0	0	114.3	E258 L259	E258-N262 PolarHBondContact O-N 2.58Å; E258-N262 PolarHBondContact O-ND2 3.31Å; L259-N262 PolarHBondContact O-N 3.47Å
263	S	79.8	Confident	89.6	Confident	37 Å²	37	62 Å²	62	26%	0.259	33%	0.332	S	S	.	.			trans	-143.4	147.4	-174.7	69	0	0	0	0	112.3	L259 I265 F267	L259-S263 PolarHBondContact O-N 3.29Å; L259-S263 PolarHBondContact O-OG 2.94Å; S263-I265 PolarHBondContact O-N 2.97Å; S263-I265 VanDerWaalsContact O-N 3.13Å; S263-F267 VanDerWaalsContact OG-CE2 3.3Å; S263-F267 WeakPolarHBondContact OG-CE2 3.46Å
264	D	82	Confident	89.7	Confident	177 Å²	177	59.9 Å²	59.9	95%	0.947	32%	0.321	S	S	*	.	S	Bend	trans	-76.5	11	177.7	-63.1	-35.5	0	0	0	113.4
265	I	83.8	Confident	89.8	Confident	40 Å²	40	54.3 Å²	54.3	21%	0.205	30%	0.295	C	S	.	.			trans	-100.8	125.2	-176	-58.6	174.9	0	0	0	109.7	S263 F267	S263-I265 PolarHBondContact O-N 2.97Å; S263-I265 VanDerWaalsContact O-N 3.13Å; I265-F267 HydrophobicContact CB-CE2 4.12Å; I265-F267 HydrophobicContact CB-CZ 4.17Å; I265-F267 HydrophobicContact CG2-CD1 4.42Å; I265-F267 HydrophobicContact CG2-CE1 4.19Å; I265-F267 HydrophobicContact CG2-CE2 4.37Å; I265-F267 HydrophobicContact CG2-CZ 4.16Å; I265-F267 WeakPolarHBondContact O-CD2 3.37Å; I265-F267 PolarHBondContact O-N 2.91Å; I265-F267 VanDerWaalsContact O-N 3.07Å
266	N	86.4	Confident	90	Very high	121 Å²	121	53.3 Å²	53.3	65%	0.647	29%	0.29	S	S	*	.			trans	-78.1	91.2	174.1	-74.8	-33.9	0	0	0	110.9	S333	N266-S333 PolarHBondContact O-OG 2.92Å
267	F	90.3	Very high	90.2	Very high	17 Å²	17	53 Å²	53	8%	0.075	29%	0.288	C	S	.	.			trans	-71.1	134.9	173	-63.5	-77.6	0	0	0	112.1	L259 S263 I265 F272 V329	L259-F267 HydrophobicContact CB-CD2 3.84Å; L259-F267 HydrophobicContact CB-CE2 3.9Å; L259-F267 HydrophobicContact CD1-CD2 4.5Å; S263-F267 VanDerWaalsContact OG-CE2 3.3Å; S263-F267 WeakPolarHBondContact OG-CE2 3.46Å; I265-F267 HydrophobicContact CB-CE2 4.12Å; I265-F267 HydrophobicContact CB-CZ 4.17Å; I265-F267 HydrophobicContact CG2-CD1 4.42Å; I265-F267 HydrophobicContact CG2-CE1 4.19Å; I265-F267 HydrophobicContact CG2-CE2 4.37Å; I265-F267 HydrophobicContact CG2-CZ 4.16Å; I265-F267 WeakPolarHBondContact O-CD2 3.37Å; I265-F267 PolarHBondContact O-N 2.91Å; I265-F267 VanDerWaalsContact O-N 3.07Å; F267-F272 HydrophobicContact CB-CE2 4.04Å; F267-V329 HydrophobicContact CD1-CG1 3.87Å; F267-V329 HydrophobicContact CE1-CB 4.46Å; F267-V329 HydrophobicContact CE1-CG1 3.99Å
268	S	91.3	Very high	90.3	Very high	59 Å²	59	48.9 Å²	48.9	41%	0.413	26%	0.263	S	S	.	.			trans	-104.9	151.5	171.9	179.7	0	0	0	0	110.8	N270 D271 F272	S268-N270 PolarHBondContact O-N 3.11Å; S268-N270 PolarHBondContact OG-N 3.04Å; S268-D271 PolarHBondContact N-OD2 2.83Å; S268-D271 WeakPolarHBondContact O-CB 3.49Å; S268-D271 PolarHBondContact O-N 2.86Å; S268-F272 WeakPolarHBondContact O-CD2 3.42Å
269	I	93	Very high	90.4	Very high	29 Å²	29	43.3 Å²	43.3	15%	0.149	24%	0.237	C	C	.	.	H	α-helix	trans	-54.2	-35.5	170.4	-63.1	170.2	0	0	0	110.2	I249 L252 I256 D271 F272 I273 D388	I249-I269 HydrophobicContact CD1-CD1 4.25Å; L252-I269 HydrophobicContact CD2-CG2 4.24Å; I256-I269 HydrophobicContact CD1-CB 4.5Å; I256-I269 HydrophobicContact CD1-CG1 3.67Å; I269-D271 VanDerWaalsContact C-N 3.25Å; I269-D271 PolarHBondContact O-N 2.89Å; I269-F272 PolarHBondContact O-N 2.76Å; I269-F272 VanDerWaalsContact O-N 3.15Å; I269-I273 HydrophobicContact CG2-CD1 3.96Å; I269-I273 HydrophobicContact CG2-CG1 4.3Å; I269-I273 WeakPolarHBondContact O-CG1 3.35Å; I269-I273 PolarHBondContact O-N 3.14Å; I269-D388 HydrophobicContact CD1-CB 4.45Å; I269-D388 VanDerWaalsContact CD1-OD2 3.24Å; I269-D388 WeakPolarHBondContact CD1-OD2 3.44Å
270	N	93.7	Very high	90.5	Very high	34 Å²	34	41.9 Å²	41.9	18%	0.182	23%	0.229	C	C	.	.	H	α-helix	trans	-59.1	-34.6	177.9	-167.8	71.4	0	0	0	113	S268 F272 I273 V274	S268-N270 PolarHBondContact O-N 3.11Å; S268-N270 PolarHBondContact OG-N 3.04Å; N270-F272 VanDerWaalsContact C-N 3.31Å; N270-F272 PolarHBondContact O-N 2.99Å; N270-I273 PolarHBondContact O-N 3.12Å; N270-V274 VanDerWaalsContact O-CG2 3.25Å; N270-V274 WeakPolarHBondContact O-CG2 3.06Å; N270-V274 PolarHBondContact O-N 3.12Å
271	D	94	Very high	90.8	Very high	3 Å²	3	36.9 Å²	36.9	2%	0.016	21%	0.208	C	C	.	.	H	α-helix	trans	-66.2	-37.6	180	-56.8	-36.1	0	0	0	110.8	S268 I269 K275 V329 I332 S333 S336	S268-D271 PolarHBondContact N-OD2 2.83Å; S268-D271 WeakPolarHBondContact O-CB 3.49Å; S268-D271 PolarHBondContact O-N 2.86Å; I269-D271 VanDerWaalsContact C-N 3.25Å; I269-D271 PolarHBondContact O-N 2.89Å; D271-K275 PolarHBondContact O-N 2.86Å; D271-K275 VanDerWaalsContact O-N 3.07Å; D271-V329 HydrophobicContact CB-CG1 4.07Å; D271-I332 HydrophobicContact CB-CG2 4.27Å; D271-S333 VanDerWaalsContact OD2-CB 3.22Å; D271-S333 WeakPolarHBondContact OD2-CB 3.34Å; D271-S333 PolarHBondContact OD2-OG 2.76Å; D271-S336 PolarHBondContact OD1-OG 2.9Å
272	F	94.5	Very high	90.8	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-71.5	-38	175.2	-67.4	-88.6	0	0	0	112.3	L252 L255 I256 L259 F267 S268 I269 N270 K275 A276 V329 L436 L443 L444	L252-F272 HydrophobicContact CD1-CB 3.99Å; L252-F272 HydrophobicContact CD1-CD1 3.65Å; L252-F272 HydrophobicContact CD1-CD2 3.97Å; L252-F272 HydrophobicContact CD1-CE1 4.07Å; L252-F272 HydrophobicContact CD1-CE2 4.39Å; L252-F272 HydrophobicContact CD1-CG 3.6Å; L252-F272 HydrophobicContact CD1-CZ 4.42Å; L252-F272 HydrophobicContact CD2-CB 4.2Å; L255-F272 HydrophobicContact CD2-CE1 4.24Å; I256-F272 HydrophobicContact CD1-CD2 3.98Å; I256-F272 HydrophobicContact CD1-CE2 3.88Å; I256-F272 HydrophobicContact CG1-CD2 4.08Å; I256-F272 HydrophobicContact CG1-CE2 3.47Å; I256-F272 VanDerWaalsContact CG1-CE2 3.47Å; I256-F272 HydrophobicContact CG1-CZ 4.03Å; L259-F272 HydrophobicContact CD1-CE1 4.43Å; L259-F272 HydrophobicContact CD1-CZ 3.8Å; F267-F272 HydrophobicContact CB-CE2 4.04Å; S268-F272 WeakPolarHBondContact O-CD2 3.42Å; I269-F272 PolarHBondContact O-N 2.76Å; I269-F272 VanDerWaalsContact O-N 3.15Å; N270-F272 VanDerWaalsContact C-N 3.31Å; N270-F272 PolarHBondContact O-N 2.99Å; F272-K275 PolarHBondContact O-N 3.29Å; F272-A276 VanDerWaalsContact O-CB 3.26Å; F272-A276 WeakPolarHBondContact O-CB 3.45Å; F272-A276 PolarHBondContact O-N 3.14Å; F272-V329 HydrophobicContact CD1-CG1 4.36Å; F272-V329 HydrophobicContact CE1-CG1 4.12Å; F272-V329 HydrophobicContact CE2-CG1 4.27Å; F272-V329 HydrophobicContact CZ-CG1 4.07Å; F272-L436 HydrophobicContact CB-CD2 4.18Å; F272-L443 HydrophobicContact CB-CD1 4.06Å; F272-L443 HydrophobicContact CD1-CB 4.14Å; F272-L443 HydrophobicContact CD1-CD1 3.8Å; F272-L443 HydrophobicContact CG-CD1 4.43Å; F272-L444 HydrophobicContact CE1-CD2 4.21Å
273	I	95.4	Very high	90.9	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-61.9	-46.8	174.1	-64.9	173.6	0	0	0	110.2	I269 N270 K275 A276 C277 I360 L383 V385 I409 L436	I269-I273 HydrophobicContact CG2-CD1 3.96Å; I269-I273 HydrophobicContact CG2-CG1 4.3Å; I269-I273 WeakPolarHBondContact O-CG1 3.35Å; I269-I273 PolarHBondContact O-N 3.14Å; N270-I273 PolarHBondContact O-N 3.12Å; I273-K275 VanDerWaalsContact C-N 3.35Å; I273-K275 PolarHBondContact O-N 3.19Å; I273-A276 PolarHBondContact O-N 3.43Å; I273-C277 WeakPolarHBondContact O-CB 3.3Å; I273-C277 PolarHBondContact O-N 2.99Å; I273-C277 PolarHBondContact O-SG 2.86Å; I273-I360 HydrophobicContact CG2-CG2 4.32Å; I273-L383 HydrophobicContact CG2-CD2 4.32Å; I273-V385 HydrophobicContact CD1-CG1 3.61Å; I273-V385 HydrophobicContact CD1-CG2 4.25Å; I273-V385 HydrophobicContact CG2-CG2 4.13Å; I273-I409 HydrophobicContact CD1-CD1 3.91Å; I273-L436 HydrophobicContact CG1-CD1 4.07Å; I273-L436 HydrophobicContact CG1-CD2 4.13Å
274	V	95.6	Very high	91.4	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-56.9	-48.6	176.2	170.3	0	0	0	0	110.7	N270 C277 A278 L306 M308 L321 I332 I360	N270-V274 VanDerWaalsContact O-CG2 3.25Å; N270-V274 WeakPolarHBondContact O-CG2 3.06Å; N270-V274 PolarHBondContact O-N 3.12Å; V274-C277 PolarHBondContact O-N 3.17Å; V274-A278 WeakPolarHBondContact O-CB 3.27Å; V274-A278 PolarHBondContact O-N 3.2Å; V274-L306 HydrophobicContact CG1-CD1 3.78Å; V274-L306 VanDerWaalsContact O-CD1 3.26Å; V274-L306 WeakPolarHBondContact O-CD1 3.45Å; V274-M308 HydrophobicContact CG2-CG 4.42Å; V274-M308 HydrophobicContact CG2-SD 4.2Å; V274-L321 HydrophobicContact CG1-CD1 3.64Å; V274-L321 HydrophobicContact CG2-CD1 4.45Å; V274-I332 HydrophobicContact CB-CG2 4.17Å; V274-I332 HydrophobicContact CG1-CD1 4.39Å; V274-I332 HydrophobicContact CG1-CG2 3.85Å; V274-I360 HydrophobicContact CB-CD1 4.36Å; V274-I360 HydrophobicContact CG2-CD1 3.88Å
275	K	94.4	Very high	91.7	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-64	-43.5	178.6	-174.3	63.8	177.5	179.3	0	112.2	D271 F272 I273 A278 L279 D325 L327 V329 I332 L443	D271-K275 PolarHBondContact O-N 2.86Å; D271-K275 VanDerWaalsContact O-N 3.07Å; F272-K275 PolarHBondContact O-N 3.29Å; I273-K275 VanDerWaalsContact C-N 3.35Å; I273-K275 PolarHBondContact O-N 3.19Å; K275-A278 PolarHBondContact O-N 2.95Å; K275-L279 HydrophobicContact CD-CG 4.49Å; K275-L279 HydrophobicContact CG-CD1 4.31Å; K275-L279 WeakPolarHBondContact O-CG 3.16Å; K275-L279 PolarHBondContact O-N 2.82Å; K275-D325 PolarHBondContact NZ-O 3.06Å; K275-L327 WeakPolarHBondContact CE-O 3.45Å; K275-L327 PolarHBondContact NZ-O 3.36Å; K275-V329 HydrophobicContact CB-CG2 4.15Å; K275-V329 HydrophobicContact CG-CG2 4Å; K275-I332 HydrophobicContact CB-CD1 3.92Å; K275-I332 HydrophobicContact CD-CD1 3.87Å; K275-I332 HydrophobicContact CG-CD1 4.41Å; K275-L443 HydrophobicContact CB-CD2 4.46Å; K275-L443 HydrophobicContact CG-CB 4.5Å; K275-L443 HydrophobicContact CG-CD2 4.12Å
276	A	94.2	Very high	91.9	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-62.8	-43.9	178.8	0	0	0	0	0	111.7	F272 I273 L279 G280 V432 L435 L436 L443	F272-A276 VanDerWaalsContact O-CB 3.26Å; F272-A276 WeakPolarHBondContact O-CB 3.45Å; F272-A276 PolarHBondContact O-N 3.14Å; I273-A276 PolarHBondContact O-N 3.43Å; A276-L279 PolarHBondContact O-N 3.42Å; A276-G280 PolarHBondContact O-N 3.28Å; A276-V432 HydrophobicContact CB-CG1 4.23Å; A276-L435 HydrophobicContact CB-CB 4.22Å; A276-L435 HydrophobicContact CB-CD1 4.15Å; A276-L436 HydrophobicContact CB-CD2 3.97Å; A276-L436 HydrophobicContact CB-CG 4.05Å; A276-L443 HydrophobicContact CB-CD1 4.49Å; A276-L443 HydrophobicContact CB-CD2 3.96Å
277	C	95.4	Very high	92.2	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-62.7	-43.4	174	-69.3	0	0	0	0	111.7	I273 V274 L279 G280 L281 L306 I360 L383 F428	I273-C277 WeakPolarHBondContact O-CB 3.3Å; I273-C277 PolarHBondContact O-N 2.99Å; I273-C277 PolarHBondContact O-SG 2.86Å; V274-C277 PolarHBondContact O-N 3.17Å; C277-L279 PolarHBondContact O-N 2.93Å; C277-G280 PolarHBondContact O-N 2.78Å; C277-L281 VanDerWaalsContact O-CG 3.32Å; C277-L281 WeakPolarHBondContact O-CG 3.38Å; C277-L281 PolarHBondContact O-N 3.3Å; C277-L306 HydrophobicContact CB-CD1 4.32Å; C277-I360 HydrophobicContact CB-CD1 3.94Å; C277-L383 WeakPolarHBondContact SG-CD2 3.41Å; C277-F428 HydrophobicContact CB-CZ 4.44Å
278	A	94.1	Very high	92.3	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-60.9	-44.4	179.7	0	0	0	0	0	112.2	V274 K275 R282 V304 L306 A324 D325	V274-A278 WeakPolarHBondContact O-CB 3.27Å; V274-A278 PolarHBondContact O-N 3.2Å; K275-A278 PolarHBondContact O-N 2.95Å; A278-R282 PolarHBondContact O-N 2.85Å; A278-V304 HydrophobicContact CB-CG1 4.23Å; A278-L306 HydrophobicContact CB-CD1 3.82Å; A278-A324 HydrophobicContact CB-CB 3.91Å; A278-D325 HydrophobicContact CB-CB 4.39Å
279	L	91.5	Very high	92.3	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-66.9	-38.3	175	-65	174.5	0	0	0	111.9	K275 A276 C277 R282 L283 Y431 L435 L443 P448 V449	K275-L279 HydrophobicContact CD-CG 4.49Å; K275-L279 HydrophobicContact CG-CD1 4.31Å; K275-L279 WeakPolarHBondContact O-CG 3.16Å; K275-L279 PolarHBondContact O-N 2.82Å; A276-L279 PolarHBondContact O-N 3.42Å; C277-L279 PolarHBondContact O-N 2.93Å; L279-R282 WeakPolarHBondContact O-CB 3.25Å; L279-R282 PolarHBondContact O-N 3.11Å; L279-L283 PolarHBondContact O-N 2.9Å; L279-Y431 HydrophobicContact CB-CE1 4.08Å; L279-L435 HydrophobicContact CB-CD1 4.29Å; L279-L435 HydrophobicContact CD1-CD1 4.27Å; L279-L443 HydrophobicContact CD1-CD2 4.04Å; L279-P448 HydrophobicContact CD1-CG 3.54Å; L279-P448 HydrophobicContact CD2-CG 4.22Å; L279-V449 HydrophobicContact CB-CG2 4.18Å; L279-V449 HydrophobicContact CD2-CG2 3.95Å
280	G	91.3	Very high	92.3	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-63.5	-41.4	176.9	0	0	0	0	0	113.1	A276 C277 R282 L283 V284 Y431	A276-G280 PolarHBondContact O-N 3.28Å; C277-G280 PolarHBondContact O-N 2.78Å; G280-R282 VanDerWaalsContact C-N 3.26Å; G280-R282 PolarHBondContact O-N 2.88Å; G280-L283 PolarHBondContact O-N 2.87Å; G280-L283 VanDerWaalsContact O-N 3.16Å; G280-V284 PolarHBondContact O-N 2.73Å; G280-Y431 VanDerWaalsContact CA-CD1 3.47Å
281	L	92.6	Very high	92.2	Very high	1 Å²	1	17.7 Å²	17.7	1%	0.005	9%	0.09	C	C	.	.	H	α-helix	trans	-65.6	-29.5	176.2	-71.9	174.4	0	0	0	112.5	C277 V284 L287 N288 V304 L306 F358 F428	C277-L281 VanDerWaalsContact O-CG 3.32Å; C277-L281 WeakPolarHBondContact O-CG 3.38Å; C277-L281 PolarHBondContact O-N 3.3Å; L281-V284 CarbonylContact O-C 3.56Å; L281-L287 HydrophobicContact CD2-CB 3.48Å; L281-L287 VanDerWaalsContact CD2-CB 3.48Å; L281-N288 HydrophobicContact CB-CB 4.3Å; L281-N288 HydrophobicContact CD2-CB 4.37Å; L281-V304 HydrophobicContact CB-CG1 3.98Å; L281-V304 HydrophobicContact CB-CG2 4.29Å; L281-V304 HydrophobicContact CD1-CG1 3.63Å; L281-V304 HydrophobicContact CG-CG1 4.45Å; L281-L306 HydrophobicContact CD1-CD2 3.53Å; L281-F358 HydrophobicContact CD1-CB 3.68Å; L281-F358 HydrophobicContact CD1-CD1 4.34Å; L281-F358 HydrophobicContact CD1-CD2 4.35Å; L281-F358 HydrophobicContact CD1-CG 3.91Å; L281-F358 HydrophobicContact CD2-CD2 3.96Å; L281-F358 HydrophobicContact CD2-CE2 4.37Å; L281-F358 HydrophobicContact CD2-CG 4.35Å; L281-F428 HydrophobicContact CD2-CE2 4Å; L281-F428 HydrophobicContact CG-CE2 4Å
282	R	88.3	Confident	92	Very high	84 Å²	84	19.8 Å²	19.8	32%	0.317	10%	0.101	S	C	.	.	H	α-helix	trans	-70.9	-32.5	173.9	-174.4	172.2	169.2	-169.4	-9.2	112.6	A278 L279 G280 D447 V449 S450	A278-R282 PolarHBondContact O-N 2.85Å; L279-R282 WeakPolarHBondContact O-CB 3.25Å; L279-R282 PolarHBondContact O-N 3.11Å; G280-R282 VanDerWaalsContact C-N 3.26Å; G280-R282 PolarHBondContact O-N 2.88Å; R282-D447 IonicContact CZ-OD1 2.92Å; R282-D447 IonicContact CZ-OD2 2.74Å; R282-D447 VanDerWaalsContact NH1-CG 3.26Å; R282-D447 IonicContact NH1-OD1 2.68Å; R282-D447 PolarHBondContact NH1-OD1 2.89Å; R282-D447 IonicContact NH1-OD2 3.78Å; R282-D447 PolarHBondContact NH1-OD2 2.82Å; R282-D447 IonicContact NH2-OD2 3.79Å; R282-V449 HydrophobicContact CG-CG1 4.44Å; R282-S450 PolarHBondContact NH2-OG 2.81Å
283	L	87.3	Confident	91.6	Very high	68 Å²	68	23.4 Å²	23.4	36%	0.356	13%	0.127	S	C	.	.	H	α-helix	trans	-81.6	-35.3	176.1	-71.4	179.4	0	0	0	112.9	L279 G280 P285 Y431 V449	L279-L283 PolarHBondContact O-N 2.9Å; G280-L283 PolarHBondContact O-N 2.87Å; G280-L283 VanDerWaalsContact O-N 3.16Å; L283-P285 VanDerWaalsContact O-CD 3.26Å; L283-P285 WeakPolarHBondContact O-CD 3.21Å; L283-Y431 HydrophobicContact CD1-CD1 4.05Å; L283-Y431 HydrophobicContact CD1-CD2 3.59Å; L283-Y431 HydrophobicContact CD1-CE1 3.66Å; L283-Y431 HydrophobicContact CD1-CE2 3.19Å; L283-Y431 HydrophobicContact CD1-CG 3.99Å; L283-V449 HydrophobicContact CD1-CG2 4.44Å; L283-V449 HydrophobicContact CD2-CG1 3.68Å; L283-V449 HydrophobicContact CD2-CG2 4.41Å; L283-V449 HydrophobicContact CG-CG1 4.26Å; L283-V449 HydrophobicContact CG-CG2 4.24Å
284	V	89.6	Confident	91.1	Very high	17 Å²	17	32 Å²	32	10%	0.103	17%	0.166	C	C	.	.			trans	-114.5	82	179.4	-173.3	0	0	0	0	108.7	G280 L281 D286 L287 A424 F428	G280-V284 PolarHBondContact O-N 2.73Å; L281-V284 CarbonylContact O-C 3.56Å; V284-D286 HydrophobicContact CG1-CB 4.31Å; V284-D286 PolarHBondContact O-N 3.12Å; V284-D286 VanDerWaalsContact O-N 3.16Å; V284-L287 HydrophobicContact CG1-CD1 4.14Å; V284-L287 HydrophobicContact CG1-CG 4.48Å; V284-L287 PolarHBondContact O-N 2.87Å; V284-A424 HydrophobicContact CG1-CB 4.05Å; V284-F428 HydrophobicContact CB-CB 4.28Å; V284-F428 HydrophobicContact CG1-CB 4.42Å; V284-F428 HydrophobicContact CG2-CB 4.1Å
285	P	88.5	Confident	90.7	Very high	70 Å²	70	34.7 Å²	34.7	46%	0.455	19%	0.189	S	C	.	.	G	3₁₀ helix	trans	-64.8	-19.4	-176.1	27.2	-35.6	0	0	0	113	L283 L287 N288	L283-P285 VanDerWaalsContact O-CD 3.26Å; L283-P285 WeakPolarHBondContact O-CD 3.21Å; P285-L287 PolarHBondContact O-N 2.94Å; P285-N288 CarbonylContact O-C 3.57Å; P285-N288 PolarHBondContact O-N 3.32Å
286	D	89.4	Confident	90.2	Very high	57 Å²	57	42.2 Å²	42.2	31%	0.305	22%	0.224	S	C	.	.	G	3₁₀ helix	trans	-56	-34.3	178.2	-63.3	-3.4	0	0	0	112.6	V284 V420 A424	V284-D286 HydrophobicContact CG1-CB 4.31Å; V284-D286 PolarHBondContact O-N 3.12Å; V284-D286 VanDerWaalsContact O-N 3.16Å; D286-V420 HydrophobicContact CB-CG1 4.42Å; D286-A424 HydrophobicContact CB-CB 4.21Å; D286-A424 WeakPolarHBondContact OD2-CB 3.2Å
287	L	92.2	Very high	89.9	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-83	-17.5	177.6	-76.8	162.8	0	0	0	113.3	L281 V284 P285 A289 A381 L413 M415 V420 F428	L281-L287 HydrophobicContact CD2-CB 3.48Å; L281-L287 VanDerWaalsContact CD2-CB 3.48Å; V284-L287 HydrophobicContact CG1-CD1 4.14Å; V284-L287 HydrophobicContact CG1-CG 4.48Å; V284-L287 PolarHBondContact O-N 2.87Å; P285-L287 PolarHBondContact O-N 2.94Å; L287-A289 VanDerWaalsContact C-N 3.3Å; L287-A289 PolarHBondContact O-N 2.81Å; L287-A381 HydrophobicContact CD2-CB 3.57Å; L287-L413 HydrophobicContact CD2-CD2 4.26Å; L287-M415 HydrophobicContact CD2-CE 3.6Å; L287-V420 HydrophobicContact CD2-CG1 4.02Å; L287-V420 HydrophobicContact CD2-CG2 4.1Å; L287-V420 HydrophobicContact CG-CG1 4.13Å; L287-F428 HydrophobicContact CD1-CB 3.22Å; L287-F428 HydrophobicContact CD1-CD1 3.57Å; L287-F428 HydrophobicContact CD1-CD2 3.61Å; L287-F428 HydrophobicContact CD1-CE1 4.29Å; L287-F428 HydrophobicContact CD1-CE2 4.33Å; L287-F428 HydrophobicContact CD1-CG 3.17Å
288	N	92.6	Very high	89.6	Confident	4 Å²	4	46.4 Å²	46.4	2%	0.021	25%	0.253	C	S	.	.	S	Bend	trans	-93.6	59.5	178.6	-163.5	45	0	0	0	110.8	L281 P285 L301 S303 S357	L281-N288 HydrophobicContact CB-CB 4.3Å; L281-N288 HydrophobicContact CD2-CB 4.37Å; P285-N288 CarbonylContact O-C 3.57Å; P285-N288 PolarHBondContact O-N 3.32Å; N288-L301 PolarHBondContact ND2-O 2.85Å; N288-L301 PolarHBondContact O-N 3.19Å; N288-S303 PolarHBondContact ND2-O 3.44Å; N288-S357 WeakPolarHBondContact OD1-CB 3.37Å; N288-S357 PolarHBondContact OD1-OG 2.95Å
289	A	91.8	Very high	89.4	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	154.5	-176.6	0	0	0	0	0	112.2	L287 P298 I299 Y300 V380	L287-A289 VanDerWaalsContact C-N 3.3Å; L287-A289 PolarHBondContact O-N 2.81Å; A289-P298 HydrophobicContact CB-CB 4.26Å; A289-I299 CarbonylContact C-O 3.28Å; A289-I299 VanDerWaalsContact CA-O 3.28Å; A289-I299 WeakPolarHBondContact CA-O 3.42Å; A289-Y300 HydrophobicContact CB-CD1 3.78Å; A289-Y300 HydrophobicContact CB-CE1 4.03Å; A289-V380 HydrophobicContact CB-CG2 4.07Å; A289-V380 WeakPolarHBondContact O-CG2 3.48Å
290	I	92.5	Very high	89.3	Confident	37 Å²	37	56.2 Å²	56.2	19%	0.19	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	134.5	170.6	-68.4	-179.2	0	0	0	107.8	I299 L301 P378	I290-I299 PolarHBondContact N-O 2.85Å; I290-I299 PolarHBondContact O-N 3.03Å; I290-L301 HydrophobicContact CD1-CD1 3.67Å; I290-L301 HydrophobicContact CD1-CD2 4.33Å; I290-L301 HydrophobicContact CD1-CG 4.38Å; I290-L301 HydrophobicContact CG1-CD1 3.75Å; I290-L301 HydrophobicContact CG1-CG 4.35Å; I290-P378 CarbonylContact C-O 3.53Å; I290-P378 WeakPolarHBondContact CA-O 3.41Å; I290-P378 HydrophobicContact CG2-CB 3.62Å; I290-P378 HydrophobicContact CG2-CG 3.71Å
291	Y	91.1	Very high	89.2	Confident	31 Å²	31	58.5 Å²	58.5	12%	0.122	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	115.5	176.2	-171.4	-105.5	0	0	0	110.7	P378 C419	Y291-P378 PolarHBondContact N-O 3.29Å; Y291-C419 WeakPolarHBondContact CD2-SG 3.34Å
292	D	90.1	Very high	88.9	Confident	46 Å²	46	70.5 Å²	70.5	25%	0.246	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	113	172	-178.4	14.2	0	0	0	110.5	Q294 A295 E296 S297 I299	D292-Q294 VanDerWaalsContact C-N 3.26Å; D292-Q294 PolarHBondContact O-N 2.79Å; D292-Q294 PolarHBondContact OD1-N 2.79Å; D292-A295 HydrophobicContact CB-CB 4.32Å; D292-A295 VanDerWaalsContact OD2-CB 3.23Å; D292-A295 WeakPolarHBondContact OD2-CB 3.31Å; D292-A295 PolarHBondContact OD2-N 3.32Å; D292-E296 WeakPolarHBondContact O-CA 3.48Å; D292-E296 PolarHBondContact O-N 2.82Å; D292-S297 PolarHBondContact N-O 2.89Å; D292-S297 VanDerWaalsContact N-O 3.09Å; D292-S297 PolarHBondContact O-N 2.77Å; D292-I299 HydrophobicContact CB-CD1 3.76Å; D292-I299 HydrophobicContact CB-CG1 4.19Å
293	S	85.1	Confident	89	Confident	77 Å²	77	68.8 Å²	68.8	54%	0.538	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-25.1	176.5	63.2	0	0	0	0	113.8
294	Q	86.6	Confident	89.2	Confident	179 Å²	179	65.7 Å²	65.7	84%	0.836	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-42.2	-179	-64.2	-172.2	-1.4	0	0	112.1	D292 E296	D292-Q294 VanDerWaalsContact C-N 3.26Å; D292-Q294 PolarHBondContact O-N 2.79Å; D292-Q294 PolarHBondContact OD1-N 2.79Å; Q294-E296 VanDerWaalsContact C-N 3.34Å
295	A	86.2	Confident	89.5	Confident	58 Å²	58	65.8 Å²	65.8	48%	0.479	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-1.8	177.5	0	0	0	0	0	113.7	D292 S297	D292-A295 HydrophobicContact CB-CB 4.32Å; D292-A295 VanDerWaalsContact OD2-CB 3.23Å; D292-A295 WeakPolarHBondContact OD2-CB 3.31Å; D292-A295 PolarHBondContact OD2-N 3.32Å; A295-S297 WeakPolarHBondContact CB-OG 3.3Å; A295-S297 PolarHBondContact O-N 3.16Å; A295-S297 PolarHBondContact O-OG 3.5Å; A295-S297 VanDerWaalsContact O-OG 3.09Å
296	E	84.5	Confident	89.8	Confident	157 Å²	157	62.5 Å²	62.5	73%	0.734	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.6	32.1	-174.2	-63	-173.3	158.4	0	0	113.7	D292 Q294	D292-E296 WeakPolarHBondContact O-CA 3.48Å; D292-E296 PolarHBondContact O-N 2.82Å; Q294-E296 VanDerWaalsContact C-N 3.34Å
297	S	87.8	Confident	90.1	Very high	48 Å²	48	59.9 Å²	59.9	34%	0.336	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	149.4	-173	50.5	0	0	0	0	112.8	D292 A295	D292-S297 PolarHBondContact N-O 2.89Å; D292-S297 VanDerWaalsContact N-O 3.09Å; D292-S297 PolarHBondContact O-N 2.77Å; A295-S297 WeakPolarHBondContact CB-OG 3.3Å; A295-S297 PolarHBondContact O-N 3.16Å; A295-S297 PolarHBondContact O-OG 3.5Å; A295-S297 VanDerWaalsContact O-OG 3.09Å
298	P	88.3	Confident	90.2	Very high	41 Å²	41	60.3 Å²	60.3	27%	0.266	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	131.4	174.6	29.1	-32.4	0	0	0	111.1	A289 Y300 C419	A289-P298 HydrophobicContact CB-CB 4.26Å; P298-Y300 HydrophobicContact CG-CE2 4.35Å; P298-C419 HydrophobicContact CB-CB 4.31Å
299	I	89.8	Confident	90.2	Very high	84 Å²	84	60.9 Å²	60.9	43%	0.431	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	110.2	171.5	-58.3	177.6	0	0	0	108	A289 I290 D292	A289-I299 CarbonylContact C-O 3.28Å; A289-I299 VanDerWaalsContact CA-O 3.28Å; A289-I299 WeakPolarHBondContact CA-O 3.42Å; I290-I299 PolarHBondContact N-O 2.85Å; I290-I299 PolarHBondContact O-N 3.03Å; D292-I299 HydrophobicContact CB-CD1 3.76Å; D292-I299 HydrophobicContact CB-CG1 4.19Å
300	Y	89.9	Confident	90.2	Very high	121 Å²	121	61.5 Å²	61.5	48%	0.475	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	129.6	177	-59.3	-75.7	0	0	0	111.4	A289 P298	A289-Y300 HydrophobicContact CB-CD1 3.78Å; A289-Y300 HydrophobicContact CB-CE1 4.03Å; P298-Y300 HydrophobicContact CG-CE2 4.35Å
301	L	89.6	Confident	90	Very high	48 Å²	48	63 Å²	63	25%	0.251	33%	0.325	S	S	.	.			trans	-93.8	144.9	-179.6	-62.5	175.4	0	0	0	111.1	N288 I290 S357	N288-L301 PolarHBondContact ND2-O 2.85Å; N288-L301 PolarHBondContact O-N 3.19Å; I290-L301 HydrophobicContact CD1-CD1 3.67Å; I290-L301 HydrophobicContact CD1-CD2 4.33Å; I290-L301 HydrophobicContact CD1-CG 4.38Å; I290-L301 HydrophobicContact CG1-CD1 3.75Å; I290-L301 HydrophobicContact CG1-CG 4.35Å; L301-S357 VanDerWaalsContact CD1-CB 3.42Å
302	R	86.2	Confident	89.8	Confident	253 Å²	253	62.4 Å²	62.4	96%	0.955	32%	0.324	S	S	*	.	S	Bend	trans	-89.5	-35.6	175.4	-66.5	-175.5	-177.9	-173.6	0.9	112.6
303	S	89.5	Confident	89.5	Confident	48 Å²	48	72.5 Å²	72.5	34%	0.336	36%	0.359	S	S	.	.	S	Bend	trans	-81.8	148.4	171.1	54.3	0	0	0	0	109.8	N288 D305	N288-S303 PolarHBondContact ND2-O 3.44Å; S303-D305 WeakPolarHBondContact CB-OD2 3.43Å; S303-D305 PolarHBondContact OG-OD2 2.94Å
304	V	92.4	Very high	89	Confident	4 Å²	4	73.1 Å²	73.1	2%	0.024	36%	0.363	C	S	.	.			trans	-107.2	99.1	173.6	-178.2	0	0	0	0	108	A278 L281 L306 S323 A324 D325	A278-V304 HydrophobicContact CB-CG1 4.23Å; L281-V304 HydrophobicContact CB-CG1 3.98Å; L281-V304 HydrophobicContact CB-CG2 4.29Å; L281-V304 HydrophobicContact CD1-CG1 3.63Å; L281-V304 HydrophobicContact CG-CG1 4.45Å; V304-L306 HydrophobicContact CG1-CD2 4.29Å; V304-L306 HydrophobicContact CG1-CG 4.25Å; V304-S323 CarbonylContact O-C 3.59Å; V304-S323 WeakPolarHBondContact O-CA 3.39Å; V304-S323 PolarHBondContact O-N 3.33Å; V304-A324 PolarHBondContact O-N 3.2Å; V304-D325 HydrophobicContact CB-CB 4.12Å; V304-D325 HydrophobicContact CG2-CB 4.22Å
305	D	94.6	Very high	88.8	Confident	19 Å²	19	66.1 Å²	66.1	10%	0.102	34%	0.339	C	S	.	.			trans	-109	105.7	-176.7	-60.4	-50.2	0	0	0	109.1	S303 I320 L321 H322 S323 G356 S357	S303-D305 WeakPolarHBondContact CB-OD2 3.43Å; S303-D305 PolarHBondContact OG-OD2 2.94Å; D305-I320 HydrophobicContact CB-CG2 4.01Å; D305-L321 CarbonylContact C-O 3.6Å; D305-L321 WeakPolarHBondContact CA-O 3.48Å; D305-H322 VanDerWaalsContact OD1-CA 3.24Å; D305-H322 WeakPolarHBondContact OD1-CA 3.46Å; D305-S323 PolarHBondContact OD1-N 3.26Å; D305-G356 CarbonylContact O-C 3.36Å; D305-S357 PolarHBondContact N-OG 3.34Å; D305-S357 PolarHBondContact O-N 3.47Å; D305-S357 PolarHBondContact O-OG 3.1Å; D305-S357 VanDerWaalsContact O-OG 3.1Å
306	L	95.4	Very high	88.8	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	123.6	-171.4	-70.5	-177.1	0	0	0	111.8	V274 C277 A278 L281 V304 I320 L321 A324 F358 I360	V274-L306 HydrophobicContact CG1-CD1 3.78Å; V274-L306 VanDerWaalsContact O-CD1 3.26Å; V274-L306 WeakPolarHBondContact O-CD1 3.45Å; C277-L306 HydrophobicContact CB-CD1 4.32Å; A278-L306 HydrophobicContact CB-CD1 3.82Å; L281-L306 HydrophobicContact CD1-CD2 3.53Å; V304-L306 HydrophobicContact CG1-CD2 4.29Å; V304-L306 HydrophobicContact CG1-CG 4.25Å; L306-I320 CarbonylContact O-C 3.59Å; L306-I320 WeakPolarHBondContact O-CA 3.39Å; L306-L321 PolarHBondContact N-O 2.91Å; L306-L321 PolarHBondContact O-N 2.89Å; L306-A324 HydrophobicContact CB-CB 4.3Å; L306-A324 HydrophobicContact CD1-CB 3.87Å; L306-A324 HydrophobicContact CG-CB 4.03Å; L306-F358 CarbonylContact C-O 3.54Å; L306-F358 HydrophobicContact CD2-CB 3.74Å; L306-F358 HydrophobicContact CD2-CD1 3.88Å; L306-F358 HydrophobicContact CD2-CG 4.21Å; L306-I360 HydrophobicContact CD1-CD1 4.1Å
307	S	95	Very high	89	Confident	2 Å²	2	59.5 Å²	59.5	1%	0.014	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	132.8	171.6	-51.6	0	0	0	0	110.6	P319 G356 F358 T359 I360 Q379	S307-P319 WeakPolarHBondContact CA-O 3.32Å; S307-G356 WeakPolarHBondContact OG-CA 3.43Å; S307-F358 PolarHBondContact N-O 3.4Å; S307-T359 WeakPolarHBondContact CB-OG1 3.42Å; S307-T359 CarbonylContact O-C 3.56Å; S307-T359 WeakPolarHBondContact O-CA 3.42Å; S307-I360 PolarHBondContact O-N 3.45Å; S307-Q379 PolarHBondContact OG-NE2 2.92Å
308	M	94.3	Very high	89.2	Confident	9 Å²	9	58.8 Å²	58.8	4%	0.044	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	123.8	174.4	-63.5	-179	-58.3	0	0	109.9	V274 V310 T318 P319 L321 L339	V274-M308 HydrophobicContact CG2-CG 4.42Å; V274-M308 HydrophobicContact CG2-SD 4.2Å; M308-V310 PolarHBondContact O-N 3.13Å; M308-T318 WeakPolarHBondContact O-CA 3.33Å; M308-P319 PolarHBondContact N-O 2.96Å; M308-P319 WeakPolarHBondContact O-CD 3.38Å; M308-L321 HydrophobicContact CE-CD1 3.8Å; M308-L321 HydrophobicContact CE-CD2 4.23Å; M308-L321 HydrophobicContact CE-CG 3.78Å; M308-L321 HydrophobicContact CG-CD1 4.15Å; M308-L321 HydrophobicContact SD-CD1 3.48Å; M308-L321 WeakPolarHBondContact SD-CD1 3.37Å; M308-L321 HydrophobicContact SD-CG 4.13Å; M308-L339 HydrophobicContact CE-CD1 4.38Å
309	A	93	Very high	89.5	Confident	17 Å²	17	56.9 Å²	56.9	14%	0.14	28%	0.282	C	S	.	.			trans	-75.4	113.1	176.4	0	0	0	0	0	110.8	L316 T318 T359 I360 F361	A309-L316 HydrophobicContact CB-CD1 3.9Å; A309-L316 HydrophobicContact CB-CD2 4.41Å; A309-L316 HydrophobicContact CB-CG 4.44Å; A309-T318 HydrophobicContact CB-CG2 4.38Å; A309-T359 HydrophobicContact CB-CG2 4.49Å; A309-I360 PolarHBondContact N-O 2.84Å; A309-F361 HydrophobicContact CB-CB 3.88Å; A309-F361 HydrophobicContact CB-CD1 4.32Å; A309-F361 HydrophobicContact CB-CD2 3.58Å; A309-F361 HydrophobicContact CB-CE2 4.18Å; A309-F361 HydrophobicContact CB-CG 3.67Å
310	V	91.6	Very high	89.7	Confident	13 Å²	13	53 Å²	53	8%	0.079	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	125.3	-179.6	-177.1	0	0	0	0	109.8	M308 T312 L317 P319 V340 A343	M308-V310 PolarHBondContact O-N 3.13Å; V310-T312 HydrophobicContact CG1-CG2 4.42Å; V310-L317 PolarHBondContact N-O 3.23Å; V310-L317 PolarHBondContact O-N 3.08Å; V310-P319 HydrophobicContact CG2-CG 3.75Å; V310-V340 HydrophobicContact CG1-CG1 4.22Å; V310-V340 HydrophobicContact CG1-CG2 4.41Å; V310-V340 HydrophobicContact CG2-CG2 3.82Å; V310-A343 HydrophobicContact CB-CB 4.44Å; V310-A343 HydrophobicContact CG1-CB 4.12Å
311	T	88.5	Confident	89.9	Confident	67 Å²	67	47.4 Å²	47.4	41%	0.411	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	124.1	174.1	-56.1	0	0	0	0	110.2
312	T	86.4	Confident	90.1	Very high	19 Å²	19	49.6 Å²	49.6	12%	0.117	25%	0.249	C	C	.	.			trans	-121.5	171.1	175.3	72.8	0	0	0	0	110.4	V310 S314 G315 L317 A343	V310-T312 HydrophobicContact CG1-CG2 4.42Å; T312-S314 PolarHBondContact O-N 3.46Å; T312-S314 PolarHBondContact OG1-N 3.4Å; T312-G315 WeakPolarHBondContact CA-O 3.36Å; T312-G315 PolarHBondContact N-O 2.82Å; T312-G315 PolarHBondContact O-N 3.47Å; T312-G315 PolarHBondContact OG1-N 3.42Å; T312-G315 PolarHBondContact OG1-O 2.95Å; T312-L317 HydrophobicContact CG2-CB 4.41Å; T312-L317 HydrophobicContact CG2-CD1 3.88Å; T312-L317 HydrophobicContact CG2-CG 4.13Å; T312-A343 HydrophobicContact CG2-CB 4.07Å; T312-A343 WeakPolarHBondContact CG2-O 3.17Å
313	R	85	Confident	90.4	Very high	259 Å²	259	39.9 Å²	39.9	98%	0.977	22%	0.22	S	C	*	.	S	Bend	trans	-62.8	-31.8	176	-67	-178.5	179.7	174.5	1.1	112.6
314	S	74.3	Confident	90.5	Very high	89 Å²	89	37.6 Å²	37.6	62%	0.622	20%	0.204	S	C	*	.	S	Bend	trans	-80.2	-20.9	-179.1	-54.9	0	0	0	0	112.7	T312	T312-S314 PolarHBondContact O-N 3.46Å; T312-S314 PolarHBondContact OG1-N 3.4Å
315	G	82.6	Confident	90.3	Very high	32 Å²	32	38.8 Å²	38.8	33%	0.33	21%	0.21	S	C	.	.			trans	145.5	-158.9	-178	0	0	0	0	0	112.6	T312	T312-G315 WeakPolarHBondContact CA-O 3.36Å; T312-G315 PolarHBondContact N-O 2.82Å; T312-G315 PolarHBondContact O-N 3.47Å; T312-G315 PolarHBondContact OG1-N 3.42Å; T312-G315 PolarHBondContact OG1-O 2.95Å
316	L	85.2	Confident	90	Very high	52 Å²	52	41.4 Å²	41.4	27%	0.272	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	122.3	176.2	-172.2	70.8	0	0	0	109.8	F227 A309 F361	F227-L316 HydrophobicContact CZ-CD2 4.45Å; A309-L316 HydrophobicContact CB-CD1 3.9Å; A309-L316 HydrophobicContact CB-CD2 4.41Å; A309-L316 HydrophobicContact CB-CG 4.44Å; L316-F361 HydrophobicContact CD1-CE2 4.23Å; L316-F361 HydrophobicContact CD1-CZ 4.14Å; L316-F361 HydrophobicContact CD2-CE1 4.13Å; L316-F361 HydrophobicContact CD2-CZ 4.27Å
317	L	89	Confident	89.8	Confident	25 Å²	25	43 Å²	43	13%	0.131	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	149.5	172	-61.9	-178.3	0	0	0	109.4	V310 T312 P319 L348 L353	V310-L317 PolarHBondContact N-O 3.23Å; V310-L317 PolarHBondContact O-N 3.08Å; T312-L317 HydrophobicContact CG2-CB 4.41Å; T312-L317 HydrophobicContact CG2-CD1 3.88Å; T312-L317 HydrophobicContact CG2-CG 4.13Å; L317-P319 VanDerWaalsContact C-CD 3.5Å; L317-P319 WeakPolarHBondContact O-CD 3.45Å; L317-L348 HydrophobicContact CB-CD1 4.36Å; L317-L348 HydrophobicContact CD1-CD1 3.99Å; L317-L353 HydrophobicContact CB-CD2 4.46Å
318	T	91.8	Very high	89.7	Confident	33 Å²	33	46.3 Å²	46.3	20%	0.202	26%	0.255	C	S	.	.			trans	-123.9	71.5	-175.7	51.4	0	0	0	0	111.5	M308 A309	M308-T318 WeakPolarHBondContact O-CA 3.33Å; A309-T318 HydrophobicContact CB-CG2 4.38Å
319	P	94.4	Very high	89.5	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.253	C	S	.	.			trans	-59.8	146.2	174.1	25.6	-37.1	0	0	0	112.4	S307 M308 V310 L317 L339 L348 E352	S307-P319 WeakPolarHBondContact CA-O 3.32Å; M308-P319 PolarHBondContact N-O 2.96Å; M308-P319 WeakPolarHBondContact O-CD 3.38Å; V310-P319 HydrophobicContact CG2-CG 3.75Å; L317-P319 VanDerWaalsContact C-CD 3.5Å; L317-P319 WeakPolarHBondContact O-CD 3.45Å; P319-L339 HydrophobicContact CB-CB 3.96Å; P319-L339 HydrophobicContact CB-CD1 4.3Å; P319-L339 HydrophobicContact CB-CD2 4.27Å; P319-L339 HydrophobicContact CB-CG 4.41Å; P319-L339 HydrophobicContact CG-CB 4.33Å; P319-L348 HydrophobicContact CB-CD1 4.37Å; P319-L348 HydrophobicContact CB-CD2 4.35Å; P319-E352 CarbonylContact C-O 3.59Å; P319-E352 WeakPolarHBondContact CA-O 3.42Å
320	I	95	Very high	89.5	Confident	3 Å²	3	46.5 Å²	46.5	2%	0.015	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	129.1	-174.6	-59.5	160.8	0	0	0	111.4	D305 L306 L339 E352 L353 D354 G356	D305-I320 HydrophobicContact CB-CG2 4.01Å; L306-I320 CarbonylContact O-C 3.59Å; L306-I320 WeakPolarHBondContact O-CA 3.39Å; I320-L339 WeakPolarHBondContact O-CD1 3.38Å; I320-E352 PolarHBondContact N-O 2.89Å; I320-L353 VanDerWaalsContact CD1-C 3.43Å; I320-D354 WeakPolarHBondContact CD1-O 3.32Å; I320-G356 VanDerWaalsContact CD1-N 3.28Å
321	L	94.8	Very high	89.5	Confident	3 Å²	3	48.8 Å²	48.8	2%	0.016	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	106.8	164.1	-70.7	173.5	0	0	0	109.2	V274 D305 L306 M308 A324 I332 L335 L339	V274-L321 HydrophobicContact CG1-CD1 3.64Å; V274-L321 HydrophobicContact CG2-CD1 4.45Å; D305-L321 CarbonylContact C-O 3.6Å; D305-L321 WeakPolarHBondContact CA-O 3.48Å; L306-L321 PolarHBondContact N-O 2.91Å; L306-L321 PolarHBondContact O-N 2.89Å; M308-L321 HydrophobicContact CE-CD1 3.8Å; M308-L321 HydrophobicContact CE-CD2 4.23Å; M308-L321 HydrophobicContact CE-CG 3.78Å; M308-L321 HydrophobicContact CG-CD1 4.15Å; M308-L321 HydrophobicContact SD-CD1 3.48Å; M308-L321 WeakPolarHBondContact SD-CD1 3.37Å; M308-L321 HydrophobicContact SD-CG 4.13Å; L321-A324 HydrophobicContact CB-CB 4.44Å; L321-I332 HydrophobicContact CD1-CG2 4.26Å; L321-L335 HydrophobicContact CD2-CB 3.82Å; L321-L339 HydrophobicContact CD2-CD1 3.7Å; L321-L339 HydrophobicContact CG-CD1 4.28Å
322	H	93.4	Very high	89.8	Confident	95 Å²	95	45.6 Å²	45.6	44%	0.44	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	136.2	-179.3	-63.1	85.9	0	0	0	111.4	D305 A324	D305-H322 VanDerWaalsContact OD1-CA 3.24Å; D305-H322 WeakPolarHBondContact OD1-CA 3.46Å; H322-A324 VanDerWaalsContact C-N 3.31Å; H322-A324 PolarHBondContact O-N 3.33Å
323	S	91.4	Very high	90.1	Very high	49 Å²	49	44.7 Å²	44.7	34%	0.343	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.5	46.5	176.7	-55.5	0	0	0	0	113.9	V304 D305 D325 S326	V304-S323 CarbonylContact O-C 3.59Å; V304-S323 WeakPolarHBondContact O-CA 3.39Å; V304-S323 PolarHBondContact O-N 3.33Å; D305-S323 PolarHBondContact OD1-N 3.26Å; S323-D325 PolarHBondContact O-N 3.47Å; S323-D325 VanDerWaalsContact O-N 3.12Å; S323-S326 PolarHBondContact O-N 3.43Å; S323-S326 VanDerWaalsContact O-N 3.12Å; S323-S326 PolarHBondContact O-OG 2.88Å
324	A	92.1	Very high	90.5	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-19.8	-174.7	0	0	0	0	0	113.7	A278 V304 L306 L321 H322 S326	A278-A324 HydrophobicContact CB-CB 3.91Å; V304-A324 PolarHBondContact O-N 3.2Å; L306-A324 HydrophobicContact CB-CB 4.3Å; L306-A324 HydrophobicContact CD1-CB 3.87Å; L306-A324 HydrophobicContact CG-CB 4.03Å; L321-A324 HydrophobicContact CB-CB 4.44Å; H322-A324 VanDerWaalsContact C-N 3.31Å; H322-A324 PolarHBondContact O-N 3.33Å; A324-S326 VanDerWaalsContact C-N 3.35Å
325	D	88.4	Confident	91.5	Very high	28 Å²	28	35.9 Å²	35.9	15%	0.15	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-37.1	176.1	65.2	-45.3	0	0	0	112.2	K275 A278 V304 S323	K275-D325 PolarHBondContact NZ-O 3.06Å; A278-D325 HydrophobicContact CB-CB 4.39Å; V304-D325 HydrophobicContact CB-CB 4.12Å; V304-D325 HydrophobicContact CG2-CB 4.22Å; S323-D325 PolarHBondContact O-N 3.47Å; S323-D325 VanDerWaalsContact O-N 3.12Å
326	S	89.2	Confident	92	Very high	74 Å²	74	34.8 Å²	34.8	52%	0.517	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-20.2	-178.8	70.4	0	0	0	0	114.6	S323 A324	S323-S326 PolarHBondContact O-N 3.43Å; S323-S326 VanDerWaalsContact O-N 3.12Å; S323-S326 PolarHBondContact O-OG 2.88Å; A324-S326 VanDerWaalsContact C-N 3.35Å
327	L	91.3	Very high	92.4	Very high	33 Å²	33	37.2 Å²	37.2	17%	0.173	20%	0.2	C	C	.	.	S	Bend	trans	-79.3	144.8	-173.7	-64.2	175.9	0	0	0	112.5	K275 I332 L335	K275-L327 WeakPolarHBondContact CE-O 3.45Å; K275-L327 PolarHBondContact NZ-O 3.36Å; L327-I332 HydrophobicContact CB-CD1 4.22Å; L327-I332 HydrophobicContact CB-CG1 3.73Å; L327-I332 HydrophobicContact CD1-CG1 4.32Å; L327-L335 HydrophobicContact CD1-CD1 3.75Å; L327-L335 HydrophobicContact CD2-CD1 4.42Å
328	I	91	Very high	92.6	Very high	72 Å²	72	41.5 Å²	41.5	37%	0.369	22%	0.219	S	C	.	.			trans	-79.7	151.4	172.1	-55.8	170.2	0	0	0	108.7	S330 D331 I332	I328-S330 PolarHBondContact O-N 2.95Å; I328-S330 VanDerWaalsContact O-N 3.11Å; I328-D331 PolarHBondContact O-N 2.8Å; I328-I332 PolarHBondContact O-N 3.25Å
329	V	92.1	Very high	92.7	Very high	1 Å²	1	40.7 Å²	40.7	1%	0.006	21%	0.214	C	C	.	.	H	α-helix	trans	-53	-35.3	179.5	-175.8	0	0	0	0	112.4	F267 D271 F272 K275 D331 I332 S333 L443	F267-V329 HydrophobicContact CD1-CG1 3.87Å; F267-V329 HydrophobicContact CE1-CB 4.46Å; F267-V329 HydrophobicContact CE1-CG1 3.99Å; D271-V329 HydrophobicContact CB-CG1 4.07Å; F272-V329 HydrophobicContact CD1-CG1 4.36Å; F272-V329 HydrophobicContact CE1-CG1 4.12Å; F272-V329 HydrophobicContact CE2-CG1 4.27Å; F272-V329 HydrophobicContact CZ-CG1 4.07Å; K275-V329 HydrophobicContact CB-CG2 4.15Å; K275-V329 HydrophobicContact CG-CG2 4Å; V329-D331 VanDerWaalsContact C-N 3.35Å; V329-D331 PolarHBondContact O-N 2.75Å; V329-I332 PolarHBondContact O-N 2.93Å; V329-S333 WeakPolarHBondContact O-CB 3.49Å; V329-S333 PolarHBondContact O-N 2.84Å; V329-L443 WeakPolarHBondContact CG2-O 3.37Å
330	S	91.1	Very high	92.7	Very high	29 Å²	29	42.3 Å²	42.3	20%	0.203	22%	0.223	C	C	.	.	H	α-helix	trans	-63.7	-37.3	175.6	55.6	0	0	0	0	113.6	I328 K334	I328-S330 PolarHBondContact O-N 2.95Å; I328-S330 VanDerWaalsContact O-N 3.11Å; S330-K334 WeakPolarHBondContact O-CG 3.5Å; S330-K334 PolarHBondContact O-N 2.93Å
331	D	92.7	Very high	92.6	Very high	61 Å²	61	46.6 Å²	46.6	33%	0.326	24%	0.244	S	C	.	.	H	α-helix	trans	-78.8	-37.4	179.8	-62.7	-23.4	0	0	0	110.2	I328 V329 S333 K334 L335	I328-D331 PolarHBondContact O-N 2.8Å; V329-D331 VanDerWaalsContact C-N 3.35Å; V329-D331 PolarHBondContact O-N 2.75Å; D331-S333 VanDerWaalsContact C-N 3.31Å; D331-S333 PolarHBondContact O-N 2.94Å; D331-K334 PolarHBondContact O-N 3.18Å; D331-L335 WeakPolarHBondContact O-CB 3.12Å; D331-L335 VanDerWaalsContact O-CG 3.29Å; D331-L335 WeakPolarHBondContact O-CG 3.32Å; D331-L335 PolarHBondContact O-N 3.1Å
332	I	94.5	Very high	92.5	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-56.1	-47.4	171.1	-67.1	171.6	0	0	0	110	D271 V274 K275 L321 L327 I328 V329 K334 L335 S336	D271-I332 HydrophobicContact CB-CG2 4.27Å; V274-I332 HydrophobicContact CB-CG2 4.17Å; V274-I332 HydrophobicContact CG1-CD1 4.39Å; V274-I332 HydrophobicContact CG1-CG2 3.85Å; K275-I332 HydrophobicContact CB-CD1 3.92Å; K275-I332 HydrophobicContact CD-CD1 3.87Å; K275-I332 HydrophobicContact CG-CD1 4.41Å; L321-I332 HydrophobicContact CD1-CG2 4.26Å; L327-I332 HydrophobicContact CB-CD1 4.22Å; L327-I332 HydrophobicContact CB-CG1 3.73Å; L327-I332 HydrophobicContact CD1-CG1 4.32Å; I328-I332 PolarHBondContact O-N 3.25Å; V329-I332 PolarHBondContact O-N 2.93Å; I332-K334 PolarHBondContact O-N 3.37Å; I332-L335 PolarHBondContact O-N 3.4Å; I332-S336 WeakPolarHBondContact O-CB 3.28Å; I332-S336 PolarHBondContact O-N 2.74Å; I332-S336 PolarHBondContact O-OG 2.76Å; I332-S336 VanDerWaalsContact O-OG 3.11Å
333	S	93.1	Very high	92.5	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-61.7	-42	179.8	-163.3	0	0	0	0	112.7	N266 D271 V329 D331 S336 Q337	N266-S333 PolarHBondContact O-OG 2.92Å; D271-S333 VanDerWaalsContact OD2-CB 3.22Å; D271-S333 WeakPolarHBondContact OD2-CB 3.34Å; D271-S333 PolarHBondContact OD2-OG 2.76Å; V329-S333 WeakPolarHBondContact O-CB 3.49Å; V329-S333 PolarHBondContact O-N 2.84Å; D331-S333 VanDerWaalsContact C-N 3.31Å; D331-S333 PolarHBondContact O-N 2.94Å; S333-S336 PolarHBondContact O-OG 2.78Å; S333-S336 VanDerWaalsContact O-OG 3.05Å; S333-Q337 WeakPolarHBondContact O-CB 3.4Å; S333-Q337 WeakPolarHBondContact O-CG 3.37Å; S333-Q337 PolarHBondContact O-N 2.89Å; S333-Q337 VanDerWaalsContact O-N 3.14Å
334	K	94	Very high	92.4	Very high	100 Å²	100	51.3 Å²	51.3	44%	0.435	25%	0.253	S	S	.	.	H	α-helix	trans	-66.8	-47.3	176.7	-70.5	171.5	-174.8	168.8	0	112	S330 D331 I332 Q338	S330-K334 WeakPolarHBondContact O-CG 3.5Å; S330-K334 PolarHBondContact O-N 2.93Å; D331-K334 PolarHBondContact O-N 3.18Å; I332-K334 PolarHBondContact O-N 3.37Å; K334-Q338 VanDerWaalsContact O-CG 3.29Å; K334-Q338 WeakPolarHBondContact O-CG 3.17Å; K334-Q338 PolarHBondContact O-N 2.93Å
335	L	94.1	Very high	92.4	Very high	64 Å²	64	55.7 Å²	55.7	34%	0.335	28%	0.276	S	S	.	.	H	α-helix	trans	-67.3	-40.2	-178.9	-70.3	171	0	0	0	111.3	L321 L327 D331 I332 Q338 L339	L321-L335 HydrophobicContact CD2-CB 3.82Å; L327-L335 HydrophobicContact CD1-CD1 3.75Å; L327-L335 HydrophobicContact CD2-CD1 4.42Å; D331-L335 WeakPolarHBondContact O-CB 3.12Å; D331-L335 VanDerWaalsContact O-CG 3.29Å; D331-L335 WeakPolarHBondContact O-CG 3.32Å; D331-L335 PolarHBondContact O-N 3.1Å; I332-L335 PolarHBondContact O-N 3.4Å; L335-Q338 PolarHBondContact O-N 3.41Å; L335-L339 WeakPolarHBondContact O-CB 3.36Å; L335-L339 WeakPolarHBondContact O-CG 3.14Å; L335-L339 PolarHBondContact O-N 2.98Å
336	S	93.6	Very high	92.3	Very high	8 Å²	8	57.2 Å²	57.2	6%	0.056	30%	0.298	C	S	.	.	H	α-helix	trans	-63.1	-45.3	177.9	73.1	0	0	0	0	111.2	D271 I332 S333 Q338 L339 V340	D271-S336 PolarHBondContact OD1-OG 2.9Å; I332-S336 WeakPolarHBondContact O-CB 3.28Å; I332-S336 PolarHBondContact O-N 2.74Å; I332-S336 PolarHBondContact O-OG 2.76Å; I332-S336 VanDerWaalsContact O-OG 3.11Å; S333-S336 PolarHBondContact O-OG 2.78Å; S333-S336 VanDerWaalsContact O-OG 3.05Å; S336-Q338 PolarHBondContact O-N 2.95Å; S336-L339 PolarHBondContact O-N 3.34Å; S336-V340 WeakPolarHBondContact O-CB 3.49Å; S336-V340 WeakPolarHBondContact O-CG2 3.38Å; S336-V340 PolarHBondContact O-N 3.35Å
337	Q	93.5	Very high	92.3	Very high	103 Å²	103	59 Å²	59	48%	0.481	30%	0.301	S	S	.	.	H	α-helix	trans	-62	-42.6	175.7	-72.4	175	9.2	0	0	112.4	S333 V340 Q341	S333-Q337 WeakPolarHBondContact O-CB 3.4Å; S333-Q337 WeakPolarHBondContact O-CG 3.37Å; S333-Q337 PolarHBondContact O-N 2.89Å; S333-Q337 VanDerWaalsContact O-N 3.14Å; Q337-V340 PolarHBondContact O-N 3.47Å; Q337-Q341 WeakPolarHBondContact O-CB 3.45Å; Q337-Q341 PolarHBondContact O-N 3.47Å
338	Q	94.2	Very high	92.1	Very high	115 Å²	115	58 Å²	58	54%	0.537	30%	0.296	S	S	.	.	H	α-helix	trans	-61.4	-46.3	176.5	-74.7	174.7	-0.4	0	0	112.1	K334 L335 S336 Q341 K342	K334-Q338 VanDerWaalsContact O-CG 3.29Å; K334-Q338 WeakPolarHBondContact O-CG 3.17Å; K334-Q338 PolarHBondContact O-N 2.93Å; L335-Q338 PolarHBondContact O-N 3.41Å; S336-Q338 PolarHBondContact O-N 2.95Å; Q338-Q341 PolarHBondContact O-N 3.31Å; Q338-K342 WeakPolarHBondContact O-CG 3.48Å; Q338-K342 PolarHBondContact O-N 3.16Å
339	L	93.8	Very high	92	Very high	16 Å²	16	59.4 Å²	59.4	8%	0.084	30%	0.301	C	S	.	.	H	α-helix	trans	-67.2	-41.1	178.7	-72	171.9	0	0	0	112.2	M308 P319 I320 L321 L335 S336 Q341 K342 A343 L348	M308-L339 HydrophobicContact CE-CD1 4.38Å; P319-L339 HydrophobicContact CB-CB 3.96Å; P319-L339 HydrophobicContact CB-CD1 4.3Å; P319-L339 HydrophobicContact CB-CD2 4.27Å; P319-L339 HydrophobicContact CB-CG 4.41Å; P319-L339 HydrophobicContact CG-CB 4.33Å; I320-L339 WeakPolarHBondContact O-CD1 3.38Å; L321-L339 HydrophobicContact CD2-CD1 3.7Å; L321-L339 HydrophobicContact CG-CD1 4.28Å; L335-L339 WeakPolarHBondContact O-CB 3.36Å; L335-L339 WeakPolarHBondContact O-CG 3.14Å; L335-L339 PolarHBondContact O-N 2.98Å; S336-L339 PolarHBondContact O-N 3.34Å; L339-Q341 VanDerWaalsContact C-N 3.31Å; L339-Q341 PolarHBondContact O-N 2.94Å; L339-K342 PolarHBondContact O-N 2.95Å; L339-A343 VanDerWaalsContact O-CB 3.3Å; L339-A343 WeakPolarHBondContact O-CB 3.25Å; L339-A343 PolarHBondContact O-N 2.73Å; L339-L348 HydrophobicContact CD2-CD2 4.31Å
340	V	92.8	Very high	91.7	Very high	34 Å²	34	61 Å²	61	21%	0.206	31%	0.311	C	S	.	.	H	α-helix	trans	-61.8	-41.3	175.5	169.4	0	0	0	0	110.9	V310 S336 Q337 A343 R344	V310-V340 HydrophobicContact CG1-CG1 4.22Å; V310-V340 HydrophobicContact CG1-CG2 4.41Å; V310-V340 HydrophobicContact CG2-CG2 3.82Å; S336-V340 WeakPolarHBondContact O-CB 3.49Å; S336-V340 WeakPolarHBondContact O-CG2 3.38Å; S336-V340 PolarHBondContact O-N 3.35Å; Q337-V340 PolarHBondContact O-N 3.47Å; V340-A343 PolarHBondContact O-N 2.97Å; V340-R344 WeakPolarHBondContact O-CG 3.49Å; V340-R344 PolarHBondContact O-N 2.94Å
341	Q	93.4	Very high	91.6	Very high	94 Å²	94	65.5 Å²	65.5	44%	0.439	33%	0.329	S	S	.	.	H	α-helix	trans	-66.6	-48.5	177.7	-172	56.9	38.5	0	0	111.2	Q337 Q338 L339 A343 R344 D345	Q337-Q341 WeakPolarHBondContact O-CB 3.45Å; Q337-Q341 PolarHBondContact O-N 3.47Å; Q338-Q341 PolarHBondContact O-N 3.31Å; L339-Q341 VanDerWaalsContact C-N 3.31Å; L339-Q341 PolarHBondContact O-N 2.94Å; Q341-A343 VanDerWaalsContact C-N 3.27Å; Q341-A343 PolarHBondContact O-N 3.31Å; Q341-R344 PolarHBondContact O-N 2.82Å; Q341-R344 VanDerWaalsContact O-N 3.14Å; Q341-D345 PolarHBondContact NE2-OD1 3.19Å; Q341-D345 PolarHBondContact NE2-OD2 3.01Å; Q341-D345 WeakPolarHBondContact O-CB 3.39Å; Q341-D345 VanDerWaalsContact O-CG 3.28Å; Q341-D345 PolarHBondContact O-N 2.83Å
342	K	93.7	Very high	91.5	Very high	83 Å²	83	63.4 Å²	63.4	36%	0.361	32%	0.317	S	S	.	.	H	α-helix	trans	-56	-40.4	173.6	-75.4	175	167.4	-175.7	0	112.7	Q338 L339 D345 G346 L347 L348 E352	Q338-K342 WeakPolarHBondContact O-CG 3.48Å; Q338-K342 PolarHBondContact O-N 3.16Å; L339-K342 PolarHBondContact O-N 2.95Å; K342-D345 PolarHBondContact O-N 3.3Å; K342-G346 PolarHBondContact O-N 3.21Å; K342-L347 PolarHBondContact O-N 2.95Å; K342-L348 HydrophobicContact CB-CD2 3.73Å; K342-L348 HydrophobicContact CB-CG 4.26Å; K342-L348 HydrophobicContact CD-CD2 4.46Å; K342-E352 IonicContact NZ-OE1 2.67Å; K342-E352 PolarHBondContact NZ-OE1 2.79Å
343	A	91.7	Very high	91.2	Very high	2 Å²	2	64.4 Å²	64.4	2%	0.017	32%	0.323	C	S	.	.	H	α-helix	trans	-61.8	-46	177.1	0	0	0	0	0	111.6	V310 T312 L339 V340 Q341 D345 G346 L348	V310-A343 HydrophobicContact CB-CB 4.44Å; V310-A343 HydrophobicContact CG1-CB 4.12Å; T312-A343 HydrophobicContact CG2-CB 4.07Å; T312-A343 WeakPolarHBondContact CG2-O 3.17Å; L339-A343 VanDerWaalsContact O-CB 3.3Å; L339-A343 WeakPolarHBondContact O-CB 3.25Å; L339-A343 PolarHBondContact O-N 2.73Å; V340-A343 PolarHBondContact O-N 2.97Å; Q341-A343 VanDerWaalsContact C-N 3.27Å; Q341-A343 PolarHBondContact O-N 3.31Å; A343-D345 VanDerWaalsContact C-N 3.34Å; A343-G346 PolarHBondContact O-N 3.14Å; A343-L348 HydrophobicContact CB-CD1 3.6Å; A343-L348 HydrophobicContact CB-CG 4.18Å
344	R	90.5	Very high	90.8	Very high	161 Å²	161	67.1 Å²	67.1	61%	0.608	34%	0.337	S	S	*	.	H	α-helix	trans	-67.8	-35.3	179.1	-72.6	174	177.4	173.1	1	112.6	V340 Q341 G346	V340-R344 WeakPolarHBondContact O-CG 3.49Å; V340-R344 PolarHBondContact O-N 2.94Å; Q341-R344 PolarHBondContact O-N 2.82Å; Q341-R344 VanDerWaalsContact O-N 3.14Å; R344-G346 VanDerWaalsContact C-N 3.29Å
345	D	91.7	Very high	90.3	Very high	91 Å²	91	65 Å²	65	49%	0.487	34%	0.343	S	S	.	.	H	α-helix	trans	-80.1	-10.4	178.2	-63.4	-22.1	0	0	0	112.8	Q341 K342 A343 L347	Q341-D345 PolarHBondContact NE2-OD1 3.19Å; Q341-D345 PolarHBondContact NE2-OD2 3.01Å; Q341-D345 WeakPolarHBondContact O-CB 3.39Å; Q341-D345 VanDerWaalsContact O-CG 3.28Å; Q341-D345 PolarHBondContact O-N 2.83Å; K342-D345 PolarHBondContact O-N 3.3Å; A343-D345 VanDerWaalsContact C-N 3.34Å; D345-L347 HydrophobicContact CB-CD1 4.05Å; D345-L347 HydrophobicContact CB-CG 4.17Å
346	G	86.1	Confident	90	Very high	60 Å²	60	62.2 Å²	62.2	62%	0.619	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.6	22.2	179.8	0	0	0	0	0	114.3	K342 A343 R344	K342-G346 PolarHBondContact O-N 3.21Å; A343-G346 PolarHBondContact O-N 3.14Å; R344-G346 VanDerWaalsContact C-N 3.29Å
347	L	88.9	Confident	89.9	Confident	112 Å²	112	61.9 Å²	61.9	59%	0.586	33%	0.328	S	S	*	.			trans	-102.6	13.1	-174.7	-63.9	173.4	0	0	0	113.5	K342 D345	K342-L347 PolarHBondContact O-N 2.95Å; D345-L347 HydrophobicContact CB-CD1 4.05Å; D345-L347 HydrophobicContact CB-CG 4.17Å
348	L	88.2	Confident	90	Very high	11 Å²	11	57 Å²	57	6%	0.058	31%	0.305	C	S	.	.			trans	-68.1	137.1	178.8	-73.5	176.4	0	0	0	111.4	L317 P319 L339 K342 A343 E352 L353	L317-L348 HydrophobicContact CB-CD1 4.36Å; L317-L348 HydrophobicContact CD1-CD1 3.99Å; P319-L348 HydrophobicContact CB-CD1 4.37Å; P319-L348 HydrophobicContact CB-CD2 4.35Å; L339-L348 HydrophobicContact CD2-CD2 4.31Å; K342-L348 HydrophobicContact CB-CD2 3.73Å; K342-L348 HydrophobicContact CB-CG 4.26Å; K342-L348 HydrophobicContact CD-CD2 4.46Å; A343-L348 HydrophobicContact CB-CD1 3.6Å; A343-L348 HydrophobicContact CB-CG 4.18Å; L348-E352 WeakPolarHBondContact CA-OE2 3.4Å; L348-E352 HydrophobicContact CD2-CB 4.35Å; L348-E352 WeakPolarHBondContact CD2-OE2 3.38Å; L348-L353 HydrophobicContact CD1-CD2 3.91Å
349	Q	88.4	Confident	90.1	Very high	103 Å²	103	51.5 Å²	51.5	48%	0.481	28%	0.279	S	S	.	.			trans	-87.1	152.2	176	-61.7	-62.1	-40.4	0	0	110.7	H351 E352	Q349-H351 VanDerWaalsContact C-N 3.25Å; Q349-H351 WeakPolarHBondContact CB-CE1 3.46Å; Q349-H351 WeakPolarHBondContact CB-ND1 3.26Å; Q349-H351 PolarHBondContact O-N 3.05Å; Q349-E352 HydrophobicContact CB-CG 4.29Å; Q349-E352 PolarHBondContact N-OE2 3.39Å; Q349-E352 WeakPolarHBondContact O-CB 3.24Å; Q349-E352 PolarHBondContact O-N 3.11Å
350	P	86.4	Confident	90.2	Very high	34 Å²	34	50.9 Å²	50.9	22%	0.221	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-56	-36.5	-179.6	-28.3	36	0	0	0	114.2	I70 E352 L353 D354	I70-P350 HydrophobicContact CD1-CG 3.75Å; I70-P350 HydrophobicContact CG1-CG 4.41Å; P350-E352 PolarHBondContact O-N 2.78Å; P350-L353 PolarHBondContact O-N 3.33Å; P350-L353 VanDerWaalsContact O-N 3.12Å; P350-D354 PolarHBondContact O-N 3.06Å
351	H	89.5	Confident	90.3	Very high	124 Å²	124	50.7 Å²	50.7	57%	0.574	27%	0.272	S	S	*	.	G	3₁₀ helix	trans	-69.3	-18.3	177.8	71.9	-90.9	0	0	0	113.6	Q349 L353	Q349-H351 VanDerWaalsContact C-N 3.25Å; Q349-H351 WeakPolarHBondContact CB-CE1 3.46Å; Q349-H351 WeakPolarHBondContact CB-ND1 3.26Å; Q349-H351 PolarHBondContact O-N 3.05Å; H351-L353 VanDerWaalsContact C-N 3.27Å
352	E	90	Very high	90.4	Very high	17 Å²	17	48.3 Å²	48.3	8%	0.079	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-82	-9.7	174.9	-62.9	174.6	136.8	0	0	111.6	P319 I320 K342 L348 Q349 P350	P319-E352 CarbonylContact C-O 3.59Å; P319-E352 WeakPolarHBondContact CA-O 3.42Å; I320-E352 PolarHBondContact N-O 2.89Å; K342-E352 IonicContact NZ-OE1 2.67Å; K342-E352 PolarHBondContact NZ-OE1 2.79Å; L348-E352 WeakPolarHBondContact CA-OE2 3.4Å; L348-E352 HydrophobicContact CD2-CB 4.35Å; L348-E352 WeakPolarHBondContact CD2-OE2 3.38Å; Q349-E352 HydrophobicContact CB-CG 4.29Å; Q349-E352 PolarHBondContact N-OE2 3.39Å; Q349-E352 WeakPolarHBondContact O-CB 3.24Å; Q349-E352 PolarHBondContact O-N 3.11Å; P350-E352 PolarHBondContact O-N 2.78Å
353	L	87	Confident	90.3	Very high	21 Å²	21	45.6 Å²	45.6	11%	0.11	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110	-16.7	-177.6	-67.2	172.9	0	0	0	113.5	K67 L317 I320 L348 P350 H351	K67-L353 HydrophobicContact CB-CD1 4.15Å; L317-L353 HydrophobicContact CB-CD2 4.46Å; I320-L353 VanDerWaalsContact CD1-C 3.43Å; L348-L353 HydrophobicContact CD1-CD2 3.91Å; P350-L353 PolarHBondContact O-N 3.33Å; P350-L353 VanDerWaalsContact O-N 3.12Å; H351-L353 VanDerWaalsContact C-N 3.27Å
354	D	85	Confident	90.1	Very high	57 Å²	57	45.8 Å²	45.8	31%	0.305	25%	0.254	S	S	.	.	S	Bend	trans	-111.8	137.2	-174.3	-73.2	-21.3	0	0	0	112.5	K67 I320 P350	K67-D354 WeakPolarHBondContact CE-OD1 3.42Å; K67-D354 IonicContact NZ-OD1 2.86Å; K67-D354 PolarHBondContact NZ-OD1 3.07Å; K67-D354 IonicContact NZ-OD2 3.54Å; K67-D354 PolarHBondContact NZ-OD2 2.92Å; I320-D354 WeakPolarHBondContact CD1-O 3.32Å; P350-D354 PolarHBondContact O-N 3.06Å
355	G	83.2	Confident	90	Very high	55 Å²	55	44.3 Å²	44.3	57%	0.567	26%	0.257	S	S	*	.			trans	102.2	3.7	171.1	0	0	0	0	0	116.2
356	G	88.9	Confident	90	Very high	6 Å²	6	46 Å²	46	6%	0.062	26%	0.258	C	S	.	.			trans	-64.4	141	175.9	0	0	0	0	0	112.1	D305 S307 I320 Q379	D305-G356 CarbonylContact O-C 3.36Å; S307-G356 WeakPolarHBondContact OG-CA 3.43Å; I320-G356 VanDerWaalsContact CD1-N 3.28Å; G356-Q379 VanDerWaalsContact C-NE2 3.35Å; G356-Q379 VanDerWaalsContact O-CG 3.3Å; G356-Q379 WeakPolarHBondContact O-CG 3.4Å; G356-Q379 PolarHBondContact O-NE2 3.07Å
357	S	91.9	Very high	90.2	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.257	C	S	.	.	S	Bend	trans	-86.7	-34.3	179.8	68.8	0	0	0	0	113.2	N288 L301 D305	N288-S357 WeakPolarHBondContact OD1-CB 3.37Å; N288-S357 PolarHBondContact OD1-OG 2.95Å; L301-S357 VanDerWaalsContact CD1-CB 3.42Å; D305-S357 PolarHBondContact N-OG 3.34Å; D305-S357 PolarHBondContact O-N 3.47Å; D305-S357 PolarHBondContact O-OG 3.1Å; D305-S357 VanDerWaalsContact O-OG 3.1Å
358	F	95.3	Very high	90.4	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	140.6	-175	-174	-88.2	0	0	0	110.5	L281 L306 S307 I360 A381 L383 L413 F428	L281-F358 HydrophobicContact CD1-CB 3.68Å; L281-F358 HydrophobicContact CD1-CD1 4.34Å; L281-F358 HydrophobicContact CD1-CD2 4.35Å; L281-F358 HydrophobicContact CD1-CG 3.91Å; L281-F358 HydrophobicContact CD2-CD2 3.96Å; L281-F358 HydrophobicContact CD2-CE2 4.37Å; L281-F358 HydrophobicContact CD2-CG 4.35Å; L306-F358 CarbonylContact C-O 3.54Å; L306-F358 HydrophobicContact CD2-CB 3.74Å; L306-F358 HydrophobicContact CD2-CD1 3.88Å; L306-F358 HydrophobicContact CD2-CG 4.21Å; S307-F358 PolarHBondContact N-O 3.4Å; F358-I360 HydrophobicContact CD1-CG1 4.18Å; F358-I360 HydrophobicContact CE1-CG1 4.06Å; F358-A381 HydrophobicContact CD2-CB 3.91Å; F358-A381 HydrophobicContact CE2-CB 3.57Å; F358-L383 HydrophobicContact CE1-CB 3.66Å; F358-L383 HydrophobicContact CZ-CB 3.75Å; F358-L413 HydrophobicContact CE2-CD1 3.93Å; F358-L413 HydrophobicContact CZ-CD1 3.81Å; F358-F428 HydrophobicContact CE2-CZ 4.49Å; F358-F428 HydrophobicContact CZ-CE1 4.19Å; F358-F428 HydrophobicContact CZ-CZ 4.08Å
359	T	95.5	Very high	90.6	Very high	1 Å²	1	52.2 Å²	52.2	1%	0.006	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	136.9	179.3	-63.4	0	0	0	0	111.9	S307 A309 N376 Q379 I382 L383	S307-T359 WeakPolarHBondContact CB-OG1 3.42Å; S307-T359 CarbonylContact O-C 3.56Å; S307-T359 WeakPolarHBondContact O-CA 3.42Å; A309-T359 HydrophobicContact CB-CG2 4.49Å; T359-N376 PolarHBondContact OG1-ND2 2.92Å; T359-Q379 PolarHBondContact OG1-NE2 3.49Å; T359-Q379 PolarHBondContact OG1-OE1 3.24Å; T359-I382 HydrophobicContact CG2-CD1 3.6Å; T359-I382 HydrophobicContact CG2-CG1 3.9Å; T359-I382 WeakPolarHBondContact O-CA 3.24Å; T359-I382 WeakPolarHBondContact O-CG1 3.48Å; T359-L383 PolarHBondContact O-N 3.29Å
360	I	96.3	Very high	90.8	Very high	3 Å²	3	52 Å²	52	2%	0.015	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	126.5	168.1	-60.8	168.2	0	0	0	108.3	I273 V274 C277 L306 S307 A309 F358 V385	I273-I360 HydrophobicContact CG2-CG2 4.32Å; V274-I360 HydrophobicContact CB-CD1 4.36Å; V274-I360 HydrophobicContact CG2-CD1 3.88Å; C277-I360 HydrophobicContact CB-CD1 3.94Å; L306-I360 HydrophobicContact CD1-CD1 4.1Å; S307-I360 PolarHBondContact O-N 3.45Å; A309-I360 PolarHBondContact N-O 2.84Å; F358-I360 HydrophobicContact CD1-CG1 4.18Å; F358-I360 HydrophobicContact CE1-CG1 4.06Å; I360-V385 HydrophobicContact CG2-CG2 4.11Å
361	F	95.5	Very high	91.3	Very high	29 Å²	29	51.8 Å²	51.8	13%	0.127	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	115.5	176.7	-166.7	176	0	0	0	109.6	A309 L316 L363 F371 L383 A384 V385	A309-F361 HydrophobicContact CB-CB 3.88Å; A309-F361 HydrophobicContact CB-CD1 4.32Å; A309-F361 HydrophobicContact CB-CD2 3.58Å; A309-F361 HydrophobicContact CB-CE2 4.18Å; A309-F361 HydrophobicContact CB-CG 3.67Å; L316-F361 HydrophobicContact CD1-CE2 4.23Å; L316-F361 HydrophobicContact CD1-CZ 4.14Å; L316-F361 HydrophobicContact CD2-CE1 4.13Å; L316-F361 HydrophobicContact CD2-CZ 4.27Å; F361-L363 HydrophobicContact CD2-CD2 4.24Å; F361-L363 HydrophobicContact CD2-CG 4.14Å; F361-L363 HydrophobicContact CE2-CD1 4.3Å; F361-L363 HydrophobicContact CE2-CD2 3.39Å; F361-L363 HydrophobicContact CE2-CG 3.69Å; F361-L363 HydrophobicContact CZ-CD1 4.17Å; F361-L363 HydrophobicContact CZ-CD2 3.81Å; F361-L363 HydrophobicContact CZ-CG 4.07Å; F361-F371 HydrophobicContact CB-CE2 4.44Å; F361-F371 HydrophobicContact CB-CZ 4.26Å; F361-F371 AromaticContact CD1-CE2 3.9Å; F361-F371 HydrophobicContact CD1-CE2 3.9Å; F361-F371 HydrophobicContact CD1-CZ 4.37Å; F361-F371 HydrophobicContact CD2-CZ 4.37Å; F361-F371 HydrophobicContact CE1-CE2 4.31Å; F361-F371 HydrophobicContact CG-CE2 4.07Å; F361-F371 HydrophobicContact CG-CZ 4.07Å; F361-F371 WeakPolarHBondContact O-CZ 3.05Å; F361-L383 PolarHBondContact N-O 3.3Å; F361-A384 CarbonylContact O-C 3.59Å; F361-A384 WeakPolarHBondContact O-CA 3.4Å; F361-V385 PolarHBondContact O-N 3.39Å
362	N	94.7	Very high	91.6	Very high	44 Å²	44	49.9 Å²	49.9	24%	0.235	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	122.4	178.5	-173.5	-14.7	0	0	0	111	G364 V385	N362-G364 PolarHBondContact OD1-N 3.15Å; N362-V385 HydrophobicContact CB-CB 4.05Å; N362-V385 HydrophobicContact CB-CG1 4.49Å; N362-V385 PolarHBondContact OD1-O 3.05Å
363	L	92	Very high	91.8	Very high	26 Å²	26	50.2 Å²	50.2	14%	0.136	26%	0.261	C	S	.	.			trans	-117.5	12.2	173.9	-67.9	179.7	0	0	0	112.7	F361 I365 Y366 I368 F371 V385	F361-L363 HydrophobicContact CD2-CD2 4.24Å; F361-L363 HydrophobicContact CD2-CG 4.14Å; F361-L363 HydrophobicContact CE2-CD1 4.3Å; F361-L363 HydrophobicContact CE2-CD2 3.39Å; F361-L363 HydrophobicContact CE2-CG 3.69Å; F361-L363 HydrophobicContact CZ-CD1 4.17Å; F361-L363 HydrophobicContact CZ-CD2 3.81Å; F361-L363 HydrophobicContact CZ-CG 4.07Å; L363-I365 PolarHBondContact O-N 2.93Å; L363-Y366 HydrophobicContact CD2-CD2 3.78Å; L363-Y366 HydrophobicContact CD2-CE2 3.98Å; L363-Y366 PolarHBondContact O-N 3.07Å; L363-I368 HydrophobicContact CB-CB 4.18Å; L363-I368 HydrophobicContact CB-CD1 3.98Å; L363-I368 HydrophobicContact CD1-CD1 3.88Å; L363-I368 HydrophobicContact CG-CD1 4.46Å; L363-F371 HydrophobicContact CB-CD1 4.1Å; L363-F371 HydrophobicContact CB-CE1 3.61Å; L363-F371 HydrophobicContact CB-CZ 3.98Å; L363-F371 HydrophobicContact CD1-CD1 4.01Å; L363-F371 HydrophobicContact CD1-CD2 3.78Å; L363-F371 HydrophobicContact CD1-CE1 3.87Å; L363-F371 HydrophobicContact CD1-CE2 3.64Å; L363-F371 HydrophobicContact CD1-CG 3.95Å; L363-F371 HydrophobicContact CD1-CZ 3.68Å; L363-F371 HydrophobicContact CG-CD1 4.38Å; L363-F371 HydrophobicContact CG-CE1 3.81Å; L363-F371 HydrophobicContact CG-CE2 4.08Å; L363-F371 HydrophobicContact CG-CZ 3.63Å; L363-V385 PolarHBondContact N-O 3.46Å; L363-V385 VanDerWaalsContact N-O 3.11Å
364	G	87.6	Confident	92.1	Very high	6 Å²	6	51.4 Å²	51.4	6%	0.062	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-59.1	-27.8	179.2	0	0	0	0	0	113.8	N362 Y366 D367 T387	N362-G364 PolarHBondContact OD1-N 3.15Å; G364-Y366 PolarHBondContact O-N 2.89Å; G364-D367 PolarHBondContact O-N 3.28Å; G364-D367 VanDerWaalsContact O-N 3.14Å; G364-T387 PolarHBondContact O-OG1 3.26Å
365	I	87.9	Confident	92.5	Very high	131 Å²	131	48.7 Å²	48.7	67%	0.672	25%	0.253	S	S	*	.	G	3₁₀ helix	trans	-65.1	-16	175.1	67.2	170	0	0	0	114.1	L363	L363-I365 PolarHBondContact O-N 2.93Å
366	Y	90.6	Very high	92.7	Very high	127 Å²	127	48 Å²	48	50%	0.498	24%	0.236	S	C	.	.	G	3₁₀ helix	trans	-105.1	18.6	178.4	-61.2	-72.9	0	0	0	111.9	L363 G364 I368	L363-Y366 HydrophobicContact CD2-CD2 3.78Å; L363-Y366 HydrophobicContact CD2-CE2 3.98Å; L363-Y366 PolarHBondContact O-N 3.07Å; G364-Y366 PolarHBondContact O-N 2.89Å; Y366-I368 PolarHBondContact O-N 3.41Å; Y366-I368 VanDerWaalsContact O-N 3.12Å
367	D	90.8	Very high	92.7	Very high	114 Å²	114	51.6 Å²	51.6	61%	0.61	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.7	25.7	-177.7	-55.3	-39.8	0	0	0	113.6	G364 R369 L389	G364-D367 PolarHBondContact O-N 3.28Å; G364-D367 VanDerWaalsContact O-N 3.14Å; D367-R369 PolarHBondContact O-N 2.83Å; D367-L389 HydrophobicContact CB-CD1 4.43Å
368	I	93.6	Very high	92.6	Very high	60 Å²	60	54.4 Å²	54.4	31%	0.308	27%	0.269	S	S	.	.			trans	-80.4	109	177.1	-66.6	175.4	0	0	0	108.4	L363 Y366 E370 F371 G386 T387	L363-I368 HydrophobicContact CB-CB 4.18Å; L363-I368 HydrophobicContact CB-CD1 3.98Å; L363-I368 HydrophobicContact CD1-CD1 3.88Å; L363-I368 HydrophobicContact CG-CD1 4.46Å; Y366-I368 PolarHBondContact O-N 3.41Å; Y366-I368 VanDerWaalsContact O-N 3.12Å; I368-E370 WeakPolarHBondContact CG2-O 3.19Å; I368-F371 HydrophobicContact CG2-CB 4Å; I368-F371 HydrophobicContact CG2-CD1 3.92Å; I368-F371 HydrophobicContact CG2-CG 4.33Å; I368-G386 CarbonylContact O-C 3.6Å; I368-G386 VanDerWaalsContact O-CA 3.31Å; I368-G386 WeakPolarHBondContact O-CA 3.26Å; I368-T387 PolarHBondContact O-N 3.5Å
369	R	92.1	Very high	92.6	Very high	139 Å²	139	55 Å²	55	53%	0.525	27%	0.272	S	S	.	.			trans	-62	-48.1	180	-173.5	178.4	-177.2	179	0.6	112.9	D367 G386 T387 E391 T410	D367-R369 PolarHBondContact O-N 2.83Å; R369-G386 WeakPolarHBondContact O-CA 3.28Å; R369-T387 HydrophobicContact CB-CG2 4.42Å; R369-E391 IonicContact CZ-OE1 3.64Å; R369-E391 IonicContact CZ-OE2 3.26Å; R369-E391 IonicContact NE-OE1 3.8Å; R369-E391 PolarHBondContact NE-OE1 3.37Å; R369-E391 IonicContact NH1-OE1 2.85Å; R369-E391 IonicContact NH2-OE1 3.55Å; R369-E391 PolarHBondContact NH2-OE1 3.47Å; R369-E391 IonicContact NH2-OE2 3.93Å; R369-E391 PolarHBondContact NH2-OE2 2.86Å; R369-T410 WeakPolarHBondContact O-CB 3.47Å
370	E	93.9	Very high	92.5	Very high	97 Å²	97	55 Å²	55	45%	0.453	27%	0.272	S	S	.	.			trans	-148.1	146.5	-179.9	63.6	179	175.5	0	0	110.1	R244 I368 T410	R244-E370 VanDerWaalsContact CD-OE2 3.31Å; R244-E370 WeakPolarHBondContact CD-OE2 3.42Å; R244-E370 IonicContact CZ-OE2 2.91Å; R244-E370 IonicContact NE-OE2 3.79Å; R244-E370 IonicContact NH1-OE1 3.45Å; R244-E370 IonicContact NH1-OE2 2.75Å; R244-E370 PolarHBondContact NH1-OE2 3.43Å; I368-E370 WeakPolarHBondContact CG2-O 3.19Å; E370-T410 HydrophobicContact CB-CG2 4.04Å
371	F	95.8	Very high	92.4	Very high	30 Å²	30	54.9 Å²	54.9	13%	0.132	27%	0.271	C	S	.	.			trans	-154.4	157.7	171.1	71	-77.2	0	0	0	110.4	F361 L363 I368 T373 A384 V385 T412	F361-F371 HydrophobicContact CB-CE2 4.44Å; F361-F371 HydrophobicContact CB-CZ 4.26Å; F361-F371 AromaticContact CD1-CE2 3.9Å; F361-F371 HydrophobicContact CD1-CE2 3.9Å; F361-F371 HydrophobicContact CD1-CZ 4.37Å; F361-F371 HydrophobicContact CD2-CZ 4.37Å; F361-F371 HydrophobicContact CE1-CE2 4.31Å; F361-F371 HydrophobicContact CG-CE2 4.07Å; F361-F371 HydrophobicContact CG-CZ 4.07Å; F361-F371 WeakPolarHBondContact O-CZ 3.05Å; L363-F371 HydrophobicContact CB-CD1 4.1Å; L363-F371 HydrophobicContact CB-CE1 3.61Å; L363-F371 HydrophobicContact CB-CZ 3.98Å; L363-F371 HydrophobicContact CD1-CD1 4.01Å; L363-F371 HydrophobicContact CD1-CD2 3.78Å; L363-F371 HydrophobicContact CD1-CE1 3.87Å; L363-F371 HydrophobicContact CD1-CE2 3.64Å; L363-F371 HydrophobicContact CD1-CG 3.95Å; L363-F371 HydrophobicContact CD1-CZ 3.68Å; L363-F371 HydrophobicContact CG-CD1 4.38Å; L363-F371 HydrophobicContact CG-CE1 3.81Å; L363-F371 HydrophobicContact CG-CE2 4.08Å; L363-F371 HydrophobicContact CG-CZ 3.63Å; I368-F371 HydrophobicContact CG2-CB 4Å; I368-F371 HydrophobicContact CG2-CD1 3.92Å; I368-F371 HydrophobicContact CG2-CG 4.33Å; F371-T373 HydrophobicContact CE2-CG2 4.5Å; F371-A384 HydrophobicContact CD1-CB 4.07Å; F371-A384 HydrophobicContact CD2-CB 3.82Å; F371-A384 HydrophobicContact CE1-CB 3.72Å; F371-A384 HydrophobicContact CE2-CB 3.46Å; F371-A384 VanDerWaalsContact CE2-CB 3.46Å; F371-A384 HydrophobicContact CG-CB 4.12Å; F371-A384 HydrophobicContact CZ-CB 3.42Å; F371-A384 VanDerWaalsContact CZ-CB 3.42Å; F371-A384 VanDerWaalsContact O-CB 3.3Å; F371-A384 WeakPolarHBondContact O-CB 3.4Å; F371-V385 WeakPolarHBondContact CE1-O 3.46Å; F371-T412 WeakPolarHBondContact O-CB 3.17Å
372	T	95.7	Very high	92.4	Very high	85 Å²	85	53.6 Å²	53.6	52%	0.521	27%	0.266	S	S	.	.			trans	-109.7	148.6	171.2	50.7	0	0	0	0	108.5	Y242 T412	Y242-T372 HydrophobicContact CD1-CG2 3.87Å; Y242-T372 HydrophobicContact CE1-CG2 4.29Å; Y242-T372 HydrophobicContact CG-CG2 4.2Å; T372-T412 HydrophobicContact CG2-CG2 3.75Å
373	T	93.5	Very high	92.6	Very high	23 Å²	23	51.5 Å²	51.5	14%	0.141	26%	0.255	C	S	.	.			trans	-131	159.4	-179.4	-177.2	0	0	0	0	110.5	F371 I382 A384 S414	F371-T373 HydrophobicContact CE2-CG2 4.5Å; T373-I382 HydrophobicContact CG2-CB 4.19Å; T373-I382 HydrophobicContact CG2-CD1 3.56Å; T373-I382 HydrophobicContact CG2-CG1 3.58Å; T373-I382 HydrophobicContact CG2-CG2 3.54Å; T373-A384 HydrophobicContact CG2-CB 4.1Å; T373-S414 WeakPolarHBondContact O-CB 3.24Å; T373-S414 PolarHBondContact O-OG 3.36Å; T373-S414 VanDerWaalsContact O-OG 3.12Å
374	I	94.2	Very high	92.8	Very high	46 Å²	46	50.3 Å²	50.3	24%	0.236	25%	0.248	C	C	.	.			trans	-83.8	136.6	177.5	-58.6	173.9	0	0	0	107.5	L231 K235	L231-I374 HydrophobicContact CD2-CB 4.2Å; L231-I374 HydrophobicContact CD2-CD1 4.46Å; L231-I374 HydrophobicContact CD2-CG2 4.21Å; K235-I374 HydrophobicContact CB-CD1 4.26Å; K235-I374 HydrophobicContact CB-CG2 4.24Å; K235-I374 HydrophobicContact CD-CD1 4.5Å; K235-I374 HydrophobicContact CD-CG1 4.32Å; K235-I374 HydrophobicContact CG-CD1 4.37Å
375	V	93.3	Very high	93.2	Very high	0 Å²	0	50 Å²	50	0%	0	25%	0.246	C	C	.	.			trans	-65.3	138.7	176.6	177.8	0	0	0	0	109.3	S234 I238 H240 H377 Q379 I382	S234-V375 WeakPolarHBondContact CB-O 3.49Å; S234-V375 PolarHBondContact OG-O 3.46Å; I238-V375 HydrophobicContact CD1-CB 4.15Å; I238-V375 HydrophobicContact CD1-CG1 4.11Å; H240-V375 PolarHBondContact NE2-N 2.92Å; V375-H377 PolarHBondContact O-N 3.48Å; V375-Q379 WeakPolarHBondContact CG1-O 3.37Å; V375-I382 HydrophobicContact CB-CG2 4.34Å; V375-I382 HydrophobicContact CG2-CG2 3.85Å
376	N	88.3	Confident	93.6	Very high	40 Å²	40	43.9 Å²	43.9	21%	0.214	22%	0.215	C	C	.	.			trans	-83.7	97.2	176.5	-69.2	-27.5	0	0	0	109.8	T359 Q379	T359-N376 PolarHBondContact OG1-ND2 2.92Å; N376-Q379 WeakPolarHBondContact O-CA 3.16Å; N376-Q379 WeakPolarHBondContact O-CB 3.29Å; N376-Q379 WeakPolarHBondContact O-CG 3.37Å; N376-Q379 PolarHBondContact O-N 3.31Å
377	H	88.5	Confident	93.7	Very high	82 Å²	82	38.2 Å²	38.2	38%	0.38	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	131.6	174.6	-172.5	72.7	0	0	0	110.2	I238 V375	I238-H377 HydrophobicContact CD1-CB 4.34Å; V375-H377 PolarHBondContact O-N 3.48Å
378	P	90.4	Very high	93.7	Very high	59 Å²	59	36 Å²	36	38%	0.383	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	cis	-96.4	12.1	16	40.8	-39.3	0	0	0	116.2	I290 Y291	I290-P378 CarbonylContact C-O 3.53Å; I290-P378 WeakPolarHBondContact CA-O 3.41Å; I290-P378 HydrophobicContact CG2-CB 3.62Å; I290-P378 HydrophobicContact CG2-CG 3.71Å; Y291-P378 PolarHBondContact N-O 3.29Å
379	Q	93.6	Very high	93.4	Very high	14 Å²	14	37 Å²	37	7%	0.065	19%	0.187	C	C	.	.	B	Isolated β-bridge	trans	-64.8	155.7	174.6	-57.6	174.1	-6.5	0	0	111.1	S307 G356 T359 V375 N376	S307-Q379 PolarHBondContact OG-NE2 2.92Å; G356-Q379 VanDerWaalsContact C-NE2 3.35Å; G356-Q379 VanDerWaalsContact O-CG 3.3Å; G356-Q379 WeakPolarHBondContact O-CG 3.4Å; G356-Q379 PolarHBondContact O-NE2 3.07Å; T359-Q379 PolarHBondContact OG1-NE2 3.49Å; T359-Q379 PolarHBondContact OG1-OE1 3.24Å; V375-Q379 WeakPolarHBondContact CG1-O 3.37Å; N376-Q379 WeakPolarHBondContact O-CA 3.16Å; N376-Q379 WeakPolarHBondContact O-CB 3.29Å; N376-Q379 WeakPolarHBondContact O-CG 3.37Å; N376-Q379 PolarHBondContact O-N 3.31Å
380	V	93.6	Very high	93.1	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	19%	0.188	C	C	.	.	S	Bend	trans	-94.1	-26.5	-177.3	168.1	0	0	0	0	112.7	A289 M415 D416 C419 V420	A289-V380 HydrophobicContact CB-CG2 4.07Å; A289-V380 WeakPolarHBondContact O-CG2 3.48Å; V380-M415 CarbonylContact O-C 3.59Å; V380-M415 WeakPolarHBondContact O-CA 3.16Å; V380-D416 HydrophobicContact CG1-CB 4.26Å; V380-D416 PolarHBondContact O-N 2.93Å; V380-C419 HydrophobicContact CG1-CB 3.69Å; V380-C419 HydrophobicContact CG2-CB 4.07Å; V380-V420 HydrophobicContact CG1-CG2 3.27Å
381	A	95.2	Very high	92.7	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	157	-176.1	0	0	0	0	0	113.8	L287 F358 L413 S414 M415	L287-A381 HydrophobicContact CD2-CB 3.57Å; F358-A381 HydrophobicContact CD2-CB 3.91Å; F358-A381 HydrophobicContact CE2-CB 3.57Å; A381-L413 HydrophobicContact CB-CD1 4.2Å; A381-S414 CarbonylContact C-O 3.6Å; A381-S414 VanDerWaalsContact CA-O 3.27Å; A381-S414 WeakPolarHBondContact CA-O 3.43Å; A381-M415 HydrophobicContact CB-CB 4.17Å
382	I	96	Very high	92.2	Very high	2 Å²	2	34 Å²	34	1%	0.01	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	136.8	177.6	-176.8	164.9	0	0	0	109.8	T359 T373 V375 S414	T359-I382 HydrophobicContact CG2-CD1 3.6Å; T359-I382 HydrophobicContact CG2-CG1 3.9Å; T359-I382 WeakPolarHBondContact O-CA 3.24Å; T359-I382 WeakPolarHBondContact O-CG1 3.48Å; T373-I382 HydrophobicContact CG2-CB 4.19Å; T373-I382 HydrophobicContact CG2-CD1 3.56Å; T373-I382 HydrophobicContact CG2-CG1 3.58Å; T373-I382 HydrophobicContact CG2-CG2 3.54Å; V375-I382 HydrophobicContact CB-CG2 4.34Å; V375-I382 HydrophobicContact CG2-CG2 3.85Å; I382-S414 PolarHBondContact N-O 3.45Å; I382-S414 PolarHBondContact O-N 3.28Å
383	L	97.2	Very high	91.5	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	120.1	177.4	-173.7	67	0	0	0	110.9	I273 C277 F358 T359 F361 V385 L411 L413 L429	I273-L383 HydrophobicContact CG2-CD2 4.32Å; C277-L383 WeakPolarHBondContact SG-CD2 3.41Å; F358-L383 HydrophobicContact CE1-CB 3.66Å; F358-L383 HydrophobicContact CZ-CB 3.75Å; T359-L383 PolarHBondContact O-N 3.29Å; F361-L383 PolarHBondContact N-O 3.3Å; L383-V385 HydrophobicContact CD2-CG2 4.21Å; L383-V385 HydrophobicContact CG-CG2 4.22Å; L383-L411 HydrophobicContact CD1-CB 4.21Å; L383-L413 HydrophobicContact CD1-CB 4.45Å; L383-L413 HydrophobicContact CD1-CD1 4.44Å; L383-L429 HydrophobicContact CD1-CD2 4.06Å
384	A	96.9	Very high	90.9	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.008	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	125.6	168.5	0	0	0	0	0	110.4	F361 F371 T373 T412	F361-A384 CarbonylContact O-C 3.59Å; F361-A384 WeakPolarHBondContact O-CA 3.4Å; F371-A384 HydrophobicContact CD1-CB 4.07Å; F371-A384 HydrophobicContact CD2-CB 3.82Å; F371-A384 HydrophobicContact CE1-CB 3.72Å; F371-A384 HydrophobicContact CE2-CB 3.46Å; F371-A384 VanDerWaalsContact CE2-CB 3.46Å; F371-A384 HydrophobicContact CG-CB 4.12Å; F371-A384 HydrophobicContact CZ-CB 3.42Å; F371-A384 VanDerWaalsContact CZ-CB 3.42Å; F371-A384 VanDerWaalsContact O-CB 3.3Å; F371-A384 WeakPolarHBondContact O-CB 3.4Å; T373-A384 HydrophobicContact CG2-CB 4.1Å; A384-T412 WeakPolarHBondContact CB-O 3.22Å; A384-T412 PolarHBondContact N-O 3.29Å; A384-T412 PolarHBondContact O-N 2.78Å
385	V	96.9	Very high	89.7	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	115.5	-178.3	-179.3	0	0	0	0	109.3	I273 I360 F361 N362 L363 F371 L383 I409 L411	I273-V385 HydrophobicContact CD1-CG1 3.61Å; I273-V385 HydrophobicContact CD1-CG2 4.25Å; I273-V385 HydrophobicContact CG2-CG2 4.13Å; I360-V385 HydrophobicContact CG2-CG2 4.11Å; F361-V385 PolarHBondContact O-N 3.39Å; N362-V385 HydrophobicContact CB-CB 4.05Å; N362-V385 HydrophobicContact CB-CG1 4.49Å; N362-V385 PolarHBondContact OD1-O 3.05Å; L363-V385 PolarHBondContact N-O 3.46Å; L363-V385 VanDerWaalsContact N-O 3.11Å; F371-V385 WeakPolarHBondContact CE1-O 3.46Å; L383-V385 HydrophobicContact CD2-CG2 4.21Å; L383-V385 HydrophobicContact CG-CG2 4.22Å; V385-I409 HydrophobicContact CG1-CD1 3.44Å; V385-I409 VanDerWaalsContact CG1-CD1 3.44Å; V385-I409 HydrophobicContact CG1-CG1 4.11Å; V385-L411 HydrophobicContact CB-CD2 4.36Å; V385-L411 HydrophobicContact CG1-CD2 4.13Å; V385-L411 HydrophobicContact CG2-CD2 3.97Å
386	G	95	Very high	88.5	Confident	3 Å²	3	40.6 Å²	40.6	3%	0.031	24%	0.238	C	C	.	.			trans	-76.2	-172.1	176.3	0	0	0	0	0	114	I368 R369 T410	I368-G386 CarbonylContact O-C 3.6Å; I368-G386 VanDerWaalsContact O-CA 3.31Å; I368-G386 WeakPolarHBondContact O-CA 3.26Å; R369-G386 WeakPolarHBondContact O-CA 3.28Å; G386-T410 PolarHBondContact N-O 2.88Å
387	T	93.3	Very high	87.1	Confident	7 Å²	7	42.4 Å²	42.4	4%	0.043	25%	0.253	C	S	.	.			trans	-72.6	158.9	178.2	-160.9	0	0	0	0	112.9	G364 I368 R369 L389	G364-T387 PolarHBondContact O-OG1 3.26Å; I368-T387 PolarHBondContact O-N 3.5Å; R369-T387 HydrophobicContact CB-CG2 4.42Å; T387-L389 HydrophobicContact CG2-CB 4.07Å; T387-L389 HydrophobicContact CG2-CD1 3.89Å; T387-L389 HydrophobicContact CG2-CG 3.84Å
388	D	90.3	Very high	85.4	Confident	68 Å²	68	43.8 Å²	43.8	36%	0.364	27%	0.271	S	S	.	.			trans	-107.1	34.5	177.4	60.2	-29.3	0	0	0	111.7	I249 I269 T407	I249-D388 HydrophobicContact CD1-CB 3.82Å; I269-D388 HydrophobicContact CD1-CB 4.45Å; I269-D388 VanDerWaalsContact CD1-OD2 3.24Å; I269-D388 WeakPolarHBondContact CD1-OD2 3.44Å; D388-T407 HydrophobicContact CB-CG2 4.22Å; D388-T407 WeakPolarHBondContact O-CG2 3.26Å
389	L	86.9	Confident	84	Confident	81 Å²	81	48.3 Å²	48.3	42%	0.424	30%	0.298	S	S	.	.			trans	-70.9	139.3	179.4	-70.4	172.3	0	0	0	111.2	D367 T387 E391	D367-L389 HydrophobicContact CB-CD1 4.43Å; T387-L389 HydrophobicContact CG2-CB 4.07Å; T387-L389 HydrophobicContact CG2-CD1 3.89Å; T387-L389 HydrophobicContact CG2-CG 3.84Å; L389-E391 PolarHBondContact O-N 2.85Å
390	P	87.2	Confident	82.7	Confident	83 Å²	83	54.6 Å²	54.6	54%	0.539	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	126	175.7	26.8	-33.2	0	0	0	110.5
391	E	86	Confident	81.6	Confident	54 Å²	54	60.7 Å²	60.7	25%	0.252	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	144.6	177	-64.6	-165.3	-178	0	0	110.8	R369 L389 C393 F405 S406	R369-E391 IonicContact CZ-OE1 3.64Å; R369-E391 IonicContact CZ-OE2 3.26Å; R369-E391 IonicContact NE-OE1 3.8Å; R369-E391 PolarHBondContact NE-OE1 3.37Å; R369-E391 IonicContact NH1-OE1 2.85Å; R369-E391 IonicContact NH2-OE1 3.55Å; R369-E391 PolarHBondContact NH2-OE1 3.47Å; R369-E391 IonicContact NH2-OE2 3.93Å; R369-E391 PolarHBondContact NH2-OE2 2.86Å; L389-E391 PolarHBondContact O-N 2.85Å; E391-C393 PolarHBondContact O-N 3.35Å; E391-F405 WeakPolarHBondContact O-CA 3.29Å; E391-S406 PolarHBondContact N-O 3.16Å; E391-S406 PolarHBondContact O-N 2.99Å
392	A	85.2	Confident	80.9	Confident	66 Å²	66	66.7 Å²	66.7	55%	0.545	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	110.9	174.4	0	0	0	0	0	109.6	I403 T404 F405	A392-I403 HydrophobicContact CB-CG2 3.99Å; A392-T404 CarbonylContact C-O 3.59Å; A392-F405 HydrophobicContact CB-CD1 4.23Å; A392-F405 HydrophobicContact CB-CE1 3.98Å
393	C	80.6	Confident	80.3	Confident	25 Å²	25	72.4 Å²	72.4	17%	0.169	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	134.6	177.3	-78	0	0	0	0	110.9	E391 S395 T404 S406	E391-C393 PolarHBondContact O-N 3.35Å; C393-S395 PolarHBondContact O-N 2.94Å; C393-T404 PolarHBondContact N-O 2.88Å; C393-T404 PolarHBondContact O-N 3.12Å; C393-T404 PolarHBondContact O-OG1 3.18Å; C393-S406 PolarHBondContact SG-OG 2.88Å
394	I	80.7	Confident	79.7	Confident	108 Å²	108	75 Å²	75	55%	0.554	43%	0.433	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.6	110.5	170.9	-58.3	171.4	0	0	0	107.3	T396 N401	I394-T396 PolarHBondContact O-N 2.91Å; I394-N401 HydrophobicContact CG2-CB 3.83Å
395	S	68.7	Low	79.3	Confident	34 Å²	34	82.4 Å²	82.4	24%	0.238	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	123.3	171.3	-173.9	0	0	0	0	108.8	C393 S397 E402	C393-S395 PolarHBondContact O-N 2.94Å; S395-S397 PolarHBondContact O-N 2.88Å; S395-S397 PolarHBondContact OG-N 3.44Å; S395-S397 PolarHBondContact OG-OG 3.5Å; S395-E402 PolarHBondContact N-O 3.12Å
396	T	67.3	Low	78.9	Confident	126 Å²	126	82.6 Å²	82.6	77%	0.773	47%	0.467	S	S	*	.			trans	-87.5	16.3	175.3	58.6	0	0	0	0	112.5	I394 C398	I394-T396 PolarHBondContact O-N 2.91Å; T396-C398 PolarHBondContact O-N 3.02Å
397	S	59.5	Low	78.7	Confident	77 Å²	77	83.6 Å²	83.6	54%	0.538	47%	0.472	S	S	.	.	S	Bend	trans	-83.8	111.7	-179.8	63.6	0	0	0	0	111.5	S395	S395-S397 PolarHBondContact O-N 2.88Å; S395-S397 PolarHBondContact OG-N 3.44Å; S395-S397 PolarHBondContact OG-OG 3.5Å
398	C	53.4	Low	78.7	Confident	111 Å²	111	84.5 Å²	84.5	75%	0.75	48%	0.477	S	S	*	.	S	Bend	trans	66.3	87	166.7	-60.3	0	0	0	0	116.2	T396 E400	T396-C398 PolarHBondContact O-N 3.02Å; C398-E400 PolarHBondContact O-N 3.3Å
399	T	61	Low	78.9	Confident	154 Å²	154	81.4 Å²	81.4	95%	0.945	46%	0.46	S	S	*	.	S	Bend	trans	73.5	-24.1	154.1	52	0	0	0	0	120.1
400	E	65	Low	79.3	Confident	147 Å²	147	78 Å²	78	69%	0.687	44%	0.443	S	S	*	.	S	Bend	trans	-134.9	142.1	173.1	-66.8	-173.6	168.3	0	0	110.8	C398 E402	C398-E400 PolarHBondContact O-N 3.3Å; E400-E402 VanDerWaalsContact C-N 3.33Å; E400-E402 PolarHBondContact O-N 3.27Å
401	N	71.4	Confident	79.7	Confident	128 Å²	128	74 Å²	74	68%	0.684	42%	0.417	S	S	*	.			trans	-72.9	85.9	177.4	-79.7	-5.5	0	0	0	109.6	I394	I394-N401 HydrophobicContact CG2-CB 3.83Å
402	E	80.6	Confident	80.3	Confident	125 Å²	125	71.9 Å²	71.9	58%	0.584	41%	0.407	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.1	133	173.4	-68.7	-171.3	166	0	0	110.9	S395 E400 T404	S395-E402 PolarHBondContact N-O 3.12Å; E400-E402 VanDerWaalsContact C-N 3.33Å; E400-E402 PolarHBondContact O-N 3.27Å; E402-T404 PolarHBondContact O-N 2.81Å
403	I	82.9	Confident	80.8	Confident	122 Å²	122	68.7 Å²	68.7	63%	0.626	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.1	109.8	172.1	-58.9	174.7	0	0	0	107.3	A392	A392-I403 HydrophobicContact CB-CG2 3.99Å
404	T	85.2	Confident	81.6	Confident	55 Å²	55	67.5 Å²	67.5	34%	0.337	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	150.6	173.5	55.4	0	0	0	0	109.7	A392 C393 E402	A392-T404 CarbonylContact C-O 3.59Å; C393-T404 PolarHBondContact N-O 2.88Å; C393-T404 PolarHBondContact O-N 3.12Å; C393-T404 PolarHBondContact O-OG1 3.18Å; E402-T404 PolarHBondContact O-N 2.81Å
405	F	87.5	Confident	82.3	Confident	156 Å²	156	62.4 Å²	62.4	68%	0.684	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.6	127.9	171.3	-67.1	-86.1	0	0	0	108.6	E391 A392	E391-F405 WeakPolarHBondContact O-CA 3.29Å; A392-F405 HydrophobicContact CB-CD1 4.23Å; A392-F405 HydrophobicContact CB-CE1 3.98Å
406	S	88.7	Confident	83.5	Confident	5 Å²	5	60.8 Å²	60.8	4%	0.035	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	147.4	172.5	64.5	0	0	0	0	110.9	R248 D250 E391 C393 D408	R248-S406 PolarHBondContact NE-OG 3.25Å; D250-S406 WeakPolarHBondContact OD2-CB 3.36Å; E391-S406 PolarHBondContact N-O 3.16Å; E391-S406 PolarHBondContact O-N 2.99Å; C393-S406 PolarHBondContact SG-OG 2.88Å; S406-D408 PolarHBondContact OG-OD1 3.39Å; S406-D408 PolarHBondContact OG-OD2 3.27Å
407	T	92.3	Very high	84.7	Confident	23 Å²	23	57.4 Å²	57.4	14%	0.141	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	105.2	176.6	-40.3	0	0	0	0	108.4	I249 D250 D388	I249-T407 HydrophobicContact CD1-CG2 3.91Å; I249-T407 HydrophobicContact CG1-CG2 3.81Å; I249-T407 VanDerWaalsContact CG1-O 3.28Å; I249-T407 WeakPolarHBondContact CG1-O 3.49Å; I249-T407 PolarHBondContact N-O 2.85Å; D250-T407 WeakPolarHBondContact OD1-CB 3.32Å; D250-T407 PolarHBondContact OD1-N 3.36Å; D250-T407 PolarHBondContact OD1-OG1 3.42Å; D388-T407 HydrophobicContact CB-CG2 4.22Å; D388-T407 WeakPolarHBondContact O-CG2 3.26Å
408	D	92.4	Very high	86.2	Confident	26 Å²	26	58.8 Å²	58.8	14%	0.139	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	132.4	-178.7	-65.1	-16.1	0	0	0	109.8	A247 R248 S406	A247-D408 WeakPolarHBondContact O-CA 3.39Å; R248-D408 WeakPolarHBondContact CA-OD1 3.34Å; R248-D408 WeakPolarHBondContact CB-OD1 3.45Å; R248-D408 WeakPolarHBondContact CG-OD1 3.37Å; R248-D408 IonicContact NE-OD1 3.06Å; R248-D408 PolarHBondContact NE-OD1 2.79Å; S406-D408 PolarHBondContact OG-OD1 3.39Å; S406-D408 PolarHBondContact OG-OD2 3.27Å
409	I	94.2	Very high	87.9	Confident	4 Å²	4	54.2 Å²	54.2	2%	0.021	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	136.2	173.7	-162.2	170.2	0	0	0	109.9	T246 A247 I249 I273 V385 L411	T246-I409 WeakPolarHBondContact CA-O 3.46Å; A247-I409 HydrophobicContact CB-CG2 4.01Å; A247-I409 PolarHBondContact N-O 2.98Å; A247-I409 PolarHBondContact O-N 3.21Å; I249-I409 HydrophobicContact CD1-CB 4.41Å; I249-I409 HydrophobicContact CG2-CB 4.29Å; I249-I409 HydrophobicContact CG2-CG2 3.62Å; I273-I409 HydrophobicContact CD1-CD1 3.91Å; V385-I409 HydrophobicContact CG1-CD1 3.44Å; V385-I409 VanDerWaalsContact CG1-CD1 3.44Å; V385-I409 HydrophobicContact CG1-CG1 4.11Å; I409-L411 HydrophobicContact CG1-CD2 4.49Å; I409-L411 HydrophobicContact CG2-CD2 4.49Å; I409-L411 HydrophobicContact CG2-CG 4.46Å
410	T	95.2	Very high	89.3	Confident	9 Å²	9	47.1 Å²	47.1	6%	0.055	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	123.3	174.9	-57.6	0	0	0	0	110.2	R244 R369 E370 G386	R244-T410 HydrophobicContact CG-CG2 3.67Å; R369-T410 WeakPolarHBondContact O-CB 3.47Å; E370-T410 HydrophobicContact CB-CG2 4.04Å; G386-T410 PolarHBondContact N-O 2.88Å
411	L	96.9	Very high	90.6	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	121.2	177.9	-60.9	-177.4	0	0	0	109.2	R244 A245 L383 V385 I409 L429 V432 L436	R244-L411 CarbonylContact C-O 3.5Å; R244-L411 WeakPolarHBondContact CA-O 3.49Å; A245-L411 PolarHBondContact N-O 2.96Å; A245-L411 PolarHBondContact O-N 3.27Å; L383-L411 HydrophobicContact CD1-CB 4.21Å; V385-L411 HydrophobicContact CB-CD2 4.36Å; V385-L411 HydrophobicContact CG1-CD2 4.13Å; V385-L411 HydrophobicContact CG2-CD2 3.97Å; I409-L411 HydrophobicContact CG1-CD2 4.49Å; I409-L411 HydrophobicContact CG2-CD2 4.49Å; I409-L411 HydrophobicContact CG2-CG 4.46Å; L411-L429 HydrophobicContact CB-CD2 4.26Å; L411-V432 HydrophobicContact CD1-CG1 3.97Å; L411-L436 HydrophobicContact CD1-CD1 4.09Å
412	T	97.4	Very high	91.5	Very high	8 Å²	8	42.9 Å²	42.9	5%	0.049	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	110.9	179.1	-56.3	0	0	0	0	109.9	I243 F371 T372 A384	I243-T412 CarbonylContact O-C 3.6Å; I243-T412 WeakPolarHBondContact O-CA 3.26Å; F371-T412 WeakPolarHBondContact O-CB 3.17Å; T372-T412 HydrophobicContact CG2-CG2 3.75Å; A384-T412 WeakPolarHBondContact CB-O 3.22Å; A384-T412 PolarHBondContact N-O 3.29Å; A384-T412 PolarHBondContact O-N 2.78Å
413	L	97.2	Very high	92.1	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	126.2	176.9	-174.6	66.2	0	0	0	109.4	Y242 I243 L287 F358 A381 L383 M415 A425 F428 L429	Y242-L413 WeakPolarHBondContact CA-O 3.38Å; I243-L413 PolarHBondContact N-O 3.29Å; I243-L413 PolarHBondContact O-N 3.44Å; L287-L413 HydrophobicContact CD2-CD2 4.26Å; F358-L413 HydrophobicContact CE2-CD1 3.93Å; F358-L413 HydrophobicContact CZ-CD1 3.81Å; A381-L413 HydrophobicContact CB-CD1 4.2Å; L383-L413 HydrophobicContact CD1-CB 4.45Å; L383-L413 HydrophobicContact CD1-CD1 4.44Å; L413-M415 HydrophobicContact CD2-CE 3.72Å; L413-M415 HydrophobicContact CG-CE 4.37Å; L413-A425 HydrophobicContact CD2-CB 4.15Å; L413-F428 HydrophobicContact CD1-CE1 4.28Å; L413-F428 HydrophobicContact CD2-CD1 4.07Å; L413-L429 HydrophobicContact CB-CD1 3.82Å; L413-L429 HydrophobicContact CB-CD2 4.13Å; L413-L429 HydrophobicContact CB-CG 4.11Å; L413-L429 HydrophobicContact CD2-CD1 4.32Å; L413-L429 HydrophobicContact CD2-CG 4.14Å
414	S	96.6	Very high	92.5	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	132.3	169.1	-45.7	0	0	0	0	108.7	E241 Y242 T373 A381 I382	E241-S414 WeakPolarHBondContact O-CA 3.49Å; Y242-S414 WeakPolarHBondContact CD1-OG 3.25Å; T373-S414 WeakPolarHBondContact O-CB 3.24Å; T373-S414 PolarHBondContact O-OG 3.36Å; T373-S414 VanDerWaalsContact O-OG 3.12Å; A381-S414 CarbonylContact C-O 3.6Å; A381-S414 VanDerWaalsContact CA-O 3.27Å; A381-S414 WeakPolarHBondContact CA-O 3.43Å; I382-S414 PolarHBondContact N-O 3.45Å; I382-S414 PolarHBondContact O-N 3.28Å
415	M	95	Very high	92.9	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.005	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	161	-173.1	60.6	166.6	37.1	0	0	114.3	H240 E241 L287 V380 A381 L413 V420 A425	H240-M415 WeakPolarHBondContact CA-O 3.16Å; E241-M415 HydrophobicContact CB-CG 4.07Å; E241-M415 PolarHBondContact N-O 2.74Å; E241-M415 PolarHBondContact O-N 3.01Å; L287-M415 HydrophobicContact CD2-CE 3.6Å; V380-M415 CarbonylContact O-C 3.59Å; V380-M415 WeakPolarHBondContact O-CA 3.16Å; A381-M415 HydrophobicContact CB-CB 4.17Å; L413-M415 HydrophobicContact CD2-CE 3.72Å; L413-M415 HydrophobicContact CG-CE 4.37Å; M415-V420 HydrophobicContact CE-CB 3.67Å; M415-V420 HydrophobicContact CE-CG1 3.32Å; M415-V420 HydrophobicContact CE-CG2 4.31Å; M415-V420 HydrophobicContact SD-CB 3.85Å; M415-V420 HydrophobicContact SD-CG1 3.94Å; M415-A425 HydrophobicContact CE-CB 3.13Å; M415-A425 HydrophobicContact SD-CB 3.62Å
416	D	94.4	Very high	93.2	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	107.7	168.6	-170	-17.1	0	0	0	111	I238 V380 R418 C419 V420	I238-D416 HydrophobicContact CG2-CB 3.61Å; V380-D416 HydrophobicContact CG1-CB 4.26Å; V380-D416 PolarHBondContact O-N 2.93Å; D416-R418 PolarHBondContact O-N 3.41Å; D416-R418 VanDerWaalsContact O-N 3.12Å; D416-R418 VanDerWaalsContact OD1-CB 3.25Å; D416-R418 WeakPolarHBondContact OD1-CB 3.36Å; D416-R418 WeakPolarHBondContact OD1-CG 3.49Å; D416-R418 IonicContact OD1-CZ 2.73Å; D416-R418 PolarHBondContact OD1-N 2.99Å; D416-R418 IonicContact OD1-NE 3.66Å; D416-R418 PolarHBondContact OD1-NE 3.29Å; D416-R418 IonicContact OD1-NH2 3.53Å; D416-R418 IonicContact OD2-CZ 2.95Å; D416-R418 IonicContact OD2-NE 2.89Å; D416-R418 PolarHBondContact OD2-NE 2.96Å; D416-R418 VanDerWaalsContact OD2-NE 3.17Å; D416-R418 IonicContact OD2-NH2 2.64Å; D416-R418 PolarHBondContact OD2-NH2 3.44Å; D416-C419 PolarHBondContact O-N 2.9Å; D416-V420 PolarHBondContact O-N 3.46Å; D416-V420 VanDerWaalsContact O-N 3.11Å
417	S	92.6	Very high	93.4	Very high	54 Å²	54	28.7 Å²	28.7	38%	0.378	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-8.8	-179	60.5	0	0	0	0	114.1	P239	P239-S417 WeakPolarHBondContact CG-OG 3.01Å; P239-S417 PolarHBondContact O-N 3.12Å; P239-S417 PolarHBondContact O-OG 2.87Å; P239-S417 VanDerWaalsContact O-OG 3.05Å
418	R	90.4	Very high	93.5	Very high	106 Å²	106	27.6 Å²	27.6	40%	0.4	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-30	170.7	-60.3	172.4	-65.4	-179.4	0.6	112.2	S237 P239 D416	S237-R418 PolarHBondContact O-NH1 2.78Å; P239-R418 HydrophobicContact CG-CG 3.59Å; D416-R418 PolarHBondContact O-N 3.41Å; D416-R418 VanDerWaalsContact O-N 3.12Å; D416-R418 VanDerWaalsContact OD1-CB 3.25Å; D416-R418 WeakPolarHBondContact OD1-CB 3.36Å; D416-R418 WeakPolarHBondContact OD1-CG 3.49Å; D416-R418 IonicContact OD1-CZ 2.73Å; D416-R418 PolarHBondContact OD1-N 2.99Å; D416-R418 IonicContact OD1-NE 3.66Å; D416-R418 PolarHBondContact OD1-NE 3.29Å; D416-R418 IonicContact OD1-NH2 3.53Å; D416-R418 IonicContact OD2-CZ 2.95Å; D416-R418 IonicContact OD2-NE 2.89Å; D416-R418 PolarHBondContact OD2-NE 2.96Å; D416-R418 VanDerWaalsContact OD2-NE 3.17Å; D416-R418 IonicContact OD2-NH2 2.64Å; D416-R418 PolarHBondContact OD2-NH2 3.44Å
419	C	88.9	Confident	93.6	Very high	16 Å²	16	26.5 Å²	26.5	11%	0.108	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.2	-38.2	-172.7	-60	0	0	0	0	112.2	Y291 P298 V380 D416	Y291-C419 WeakPolarHBondContact CD2-SG 3.34Å; P298-C419 HydrophobicContact CB-CB 4.31Å; V380-C419 HydrophobicContact CG1-CB 3.69Å; V380-C419 HydrophobicContact CG2-CB 4.07Å; D416-C419 PolarHBondContact O-N 2.9Å
420	V	91	Very high	93.5	Very high	4 Å²	4	30.3 Å²	30.3	2%	0.024	17%	0.167	C	C	.	.	S	Bend	trans	-116.6	132.8	-171.4	-168.1	0	0	0	0	110.2	D286 L287 V380 M415 D416 A424	D286-V420 HydrophobicContact CB-CG1 4.42Å; L287-V420 HydrophobicContact CD2-CG1 4.02Å; L287-V420 HydrophobicContact CD2-CG2 4.1Å; L287-V420 HydrophobicContact CG-CG1 4.13Å; V380-V420 HydrophobicContact CG1-CG2 3.27Å; M415-V420 HydrophobicContact CE-CB 3.67Å; M415-V420 HydrophobicContact CE-CG1 3.32Å; M415-V420 HydrophobicContact CE-CG2 4.31Å; M415-V420 HydrophobicContact SD-CB 3.85Å; M415-V420 HydrophobicContact SD-CG1 3.94Å; D416-V420 PolarHBondContact O-N 3.46Å; D416-V420 VanDerWaalsContact O-N 3.11Å; V420-A424 HydrophobicContact CG1-CB 4.01Å
421	S	91.1	Very high	93.3	Very high	63 Å²	63	30.8 Å²	30.8	44%	0.441	17%	0.168	S	C	.	.			trans	-78.8	148.8	172.5	69.3	0	0	0	0	111.5	V423 A424 A425	S421-V423 PolarHBondContact O-N 3.47Å; S421-V423 VanDerWaalsContact O-N 3.13Å; S421-A424 PolarHBondContact O-N 3.43Å; S421-A424 VanDerWaalsContact O-N 3.08Å; S421-A424 WeakPolarHBondContact OG-CB 3.46Å; S421-A424 PolarHBondContact OG-N 2.97Å; S421-A425 PolarHBondContact O-N 2.91Å
422	E	91.3	Very high	93.2	Very high	124 Å²	124	30.8 Å²	30.8	58%	0.579	17%	0.168	S	C	*	.	H	α-helix	trans	-54.6	-34.4	176.1	-43.1	-172.5	171.5	0	0	111.9	E241 A425 C426	E241-E422 VanDerWaalsContact OE1-CG 3.25Å; E241-E422 WeakPolarHBondContact OE1-CG 3.4Å; E422-A425 VanDerWaalsContact O-CB 3.32Å; E422-A425 WeakPolarHBondContact O-CB 3.25Å; E422-A425 PolarHBondContact O-N 3.11Å; E422-C426 WeakPolarHBondContact O-CB 3.33Å; E422-C426 PolarHBondContact O-N 2.99Å; E422-C426 PolarHBondContact O-SG 2.88Å
423	V	92.5	Very high	93	Very high	66 Å²	66	31.3 Å²	31.3	40%	0.4	17%	0.172	S	C	.	.	H	α-helix	trans	-68.9	-44.1	179.4	-178	0	0	0	0	111.4	S421 A425 C426 S427 I479	S421-V423 PolarHBondContact O-N 3.47Å; S421-V423 VanDerWaalsContact O-N 3.13Å; V423-A425 VanDerWaalsContact C-N 3.31Å; V423-A425 PolarHBondContact O-N 3.44Å; V423-C426 PolarHBondContact O-N 3Å; V423-S427 WeakPolarHBondContact O-CB 3.45Å; V423-S427 PolarHBondContact O-N 2.9Å; V423-S427 PolarHBondContact O-OG 2.51Å; V423-I479 HydrophobicContact CG2-CD1 4.06Å
424	A	91.3	Very high	92.7	Very high	10 Å²	10	32.1 Å²	32.1	8%	0.083	18%	0.177	C	C	.	.	H	α-helix	trans	-63.1	-41.4	175.6	0	0	0	0	0	110.8	V284 D286 V420 S421 S427 F428	V284-A424 HydrophobicContact CG1-CB 4.05Å; D286-A424 HydrophobicContact CB-CB 4.21Å; D286-A424 WeakPolarHBondContact OD2-CB 3.2Å; V420-A424 HydrophobicContact CG1-CB 4.01Å; S421-A424 PolarHBondContact O-N 3.43Å; S421-A424 VanDerWaalsContact O-N 3.08Å; S421-A424 WeakPolarHBondContact OG-CB 3.46Å; S421-A424 PolarHBondContact OG-N 2.97Å; A424-S427 PolarHBondContact O-N 2.85Å; A424-F428 PolarHBondContact O-N 3.37Å
425	A	93.8	Very high	92.5	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-58	-50.2	175	0	0	0	0	0	112.8	I243 L413 M415 S421 E422 V423 S427 F428 L429	I243-A425 HydrophobicContact CD1-CB 3.33Å; L413-A425 HydrophobicContact CD2-CB 4.15Å; M415-A425 HydrophobicContact CE-CB 3.13Å; M415-A425 HydrophobicContact SD-CB 3.62Å; S421-A425 PolarHBondContact O-N 2.91Å; E422-A425 VanDerWaalsContact O-CB 3.32Å; E422-A425 WeakPolarHBondContact O-CB 3.25Å; E422-A425 PolarHBondContact O-N 3.11Å; V423-A425 VanDerWaalsContact C-N 3.31Å; V423-A425 PolarHBondContact O-N 3.44Å; A425-S427 VanDerWaalsContact C-N 3.32Å; A425-S427 PolarHBondContact O-N 3.06Å; A425-F428 PolarHBondContact O-N 2.91Å; A425-L429 PolarHBondContact O-N 3.07Å
426	C	93.9	Very high	92.4	Very high	64 Å²	64	32.2 Å²	32.2	43%	0.432	18%	0.178	S	C	.	.	H	α-helix	trans	-63.4	-39.9	178.5	-71.3	0	0	0	0	111.5	E422 V423 L429 K430	E422-C426 WeakPolarHBondContact O-CB 3.33Å; E422-C426 PolarHBondContact O-N 2.99Å; E422-C426 PolarHBondContact O-SG 2.88Å; V423-C426 PolarHBondContact O-N 3Å; C426-L429 PolarHBondContact O-N 2.72Å; C426-K430 VanDerWaalsContact O-CB 3.24Å; C426-K430 WeakPolarHBondContact O-CB 3.42Å; C426-K430 PolarHBondContact O-N 3.41Å
427	S	92.5	Very high	92.2	Very high	24 Å²	24	32.5 Å²	32.5	17%	0.168	18%	0.181	C	C	.	.	H	α-helix	trans	-62.9	-44.1	177.7	-59.5	0	0	0	0	111.5	V423 A424 A425 Y431	V423-S427 WeakPolarHBondContact O-CB 3.45Å; V423-S427 PolarHBondContact O-N 2.9Å; V423-S427 PolarHBondContact O-OG 2.51Å; A424-S427 PolarHBondContact O-N 2.85Å; A425-S427 VanDerWaalsContact C-N 3.32Å; A425-S427 PolarHBondContact O-N 3.06Å; S427-Y431 WeakPolarHBondContact O-CB 3.42Å; S427-Y431 PolarHBondContact O-N 3.36Å
428	F	94.5	Very high	91.9	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-61.9	-51.8	174.9	169.4	-97.3	0	0	0	112.3	C277 L281 V284 L287 F358 L413 A424 A425 K430 Y431 V432	C277-F428 HydrophobicContact CB-CZ 4.44Å; L281-F428 HydrophobicContact CD2-CE2 4Å; L281-F428 HydrophobicContact CG-CE2 4Å; V284-F428 HydrophobicContact CB-CB 4.28Å; V284-F428 HydrophobicContact CG1-CB 4.42Å; V284-F428 HydrophobicContact CG2-CB 4.1Å; L287-F428 HydrophobicContact CD1-CB 3.22Å; L287-F428 HydrophobicContact CD1-CD1 3.57Å; L287-F428 HydrophobicContact CD1-CD2 3.61Å; L287-F428 HydrophobicContact CD1-CE1 4.29Å; L287-F428 HydrophobicContact CD1-CE2 4.33Å; L287-F428 HydrophobicContact CD1-CG 3.17Å; F358-F428 HydrophobicContact CE2-CZ 4.49Å; F358-F428 HydrophobicContact CZ-CE1 4.19Å; F358-F428 HydrophobicContact CZ-CZ 4.08Å; L413-F428 HydrophobicContact CD1-CE1 4.28Å; L413-F428 HydrophobicContact CD2-CD1 4.07Å; A424-F428 PolarHBondContact O-N 3.37Å; A425-F428 PolarHBondContact O-N 2.91Å; F428-K430 VanDerWaalsContact C-N 3.29Å; F428-K430 PolarHBondContact O-N 2.62Å; F428-Y431 PolarHBondContact O-N 3.46Å; F428-V432 HydrophobicContact CD1-CG2 4.43Å; F428-V432 HydrophobicContact CD2-CG2 4.25Å; F428-V432 HydrophobicContact CE1-CG2 4.07Å; F428-V432 HydrophobicContact CE2-CG2 3.86Å; F428-V432 HydrophobicContact CZ-CG2 3.78Å; F428-V432 WeakPolarHBondContact O-CG2 3.19Å; F428-V432 PolarHBondContact O-N 3.05Å
429	L	95	Very high	91.8	Very high	3 Å²	3	30.6 Å²	30.6	2%	0.016	17%	0.171	C	C	.	.	H	α-helix	trans	-60.7	-41.5	-180	-83.4	176.5	0	0	0	111.5	I243 A245 L383 L411 L413 A425 C426 Y431 V432 C433	I243-L429 HydrophobicContact CB-CD1 3.98Å; I243-L429 HydrophobicContact CG2-CD1 3.52Å; A245-L429 HydrophobicContact CB-CB 4.21Å; A245-L429 HydrophobicContact CB-CD1 4.27Å; L383-L429 HydrophobicContact CD1-CD2 4.06Å; L411-L429 HydrophobicContact CB-CD2 4.26Å; L413-L429 HydrophobicContact CB-CD1 3.82Å; L413-L429 HydrophobicContact CB-CD2 4.13Å; L413-L429 HydrophobicContact CB-CG 4.11Å; L413-L429 HydrophobicContact CD2-CD1 4.32Å; L413-L429 HydrophobicContact CD2-CG 4.14Å; A425-L429 PolarHBondContact O-N 3.07Å; C426-L429 PolarHBondContact O-N 2.72Å; L429-Y431 PolarHBondContact O-N 3.13Å; L429-V432 PolarHBondContact O-N 3.04Å; L429-C433 WeakPolarHBondContact O-CB 3.29Å; L429-C433 PolarHBondContact O-N 3.35Å; L429-C433 PolarHBondContact O-SG 2.71Å
430	K	92.5	Very high	91.7	Very high	84 Å²	84	30.1 Å²	30.1	37%	0.365	17%	0.168	S	C	.	.	H	α-helix	trans	-61.8	-44.1	176.5	-179.8	154.6	172.4	177.8	0	111.8	C426 F428 C433 S434 K473 V474	C426-K430 VanDerWaalsContact O-CB 3.24Å; C426-K430 WeakPolarHBondContact O-CB 3.42Å; C426-K430 PolarHBondContact O-N 3.41Å; F428-K430 VanDerWaalsContact C-N 3.29Å; F428-K430 PolarHBondContact O-N 2.62Å; K430-C433 PolarHBondContact O-N 3.04Å; K430-S434 WeakPolarHBondContact O-CB 3.11Å; K430-S434 PolarHBondContact O-N 3.04Å; K430-S434 PolarHBondContact O-OG 3.03Å; K430-K473 PolarHBondContact NZ-O 3.33Å; K430-V474 HydrophobicContact CD-CG2 3.23Å; K430-V474 HydrophobicContact CG-CG2 4.14Å
431	Y	91.4	Very high	91.5	Very high	19 Å²	19	35 Å²	35	8%	0.075	19%	0.19	C	C	.	.	H	α-helix	trans	-61	-47.7	176	-179.9	-101.2	0	0	0	112.2	L279 G280 L283 S427 F428 L429 C433 S434 L435	L279-Y431 HydrophobicContact CB-CE1 4.08Å; G280-Y431 VanDerWaalsContact CA-CD1 3.47Å; L283-Y431 HydrophobicContact CD1-CD1 4.05Å; L283-Y431 HydrophobicContact CD1-CD2 3.59Å; L283-Y431 HydrophobicContact CD1-CE1 3.66Å; L283-Y431 HydrophobicContact CD1-CE2 3.19Å; L283-Y431 HydrophobicContact CD1-CG 3.99Å; S427-Y431 WeakPolarHBondContact O-CB 3.42Å; S427-Y431 PolarHBondContact O-N 3.36Å; F428-Y431 PolarHBondContact O-N 3.46Å; L429-Y431 PolarHBondContact O-N 3.13Å; Y431-C433 PolarHBondContact O-N 3.02Å; Y431-S434 PolarHBondContact O-N 3.03Å; Y431-L435 HydrophobicContact CD1-CD1 3.84Å; Y431-L435 HydrophobicContact CD1-CG 4.35Å; Y431-L435 HydrophobicContact CE1-CD1 3.16Å; Y431-L435 HydrophobicContact CE1-CG 3.91Å; Y431-L435 HydrophobicContact CE2-CD1 4.3Å; Y431-L435 HydrophobicContact CE2-CD2 4.48Å; Y431-L435 HydrophobicContact CE2-CG 4.24Å; Y431-L435 VanDerWaalsContact CZ-CD1 3.43Å; Y431-L435 PolarHBondContact O-N 3.25Å
432	V	93.5	Very high	91.2	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-61.2	-44.3	177.6	173.4	0	0	0	0	111	A276 L411 F428 L429 S434 L435 L436	A276-V432 HydrophobicContact CB-CG1 4.23Å; L411-V432 HydrophobicContact CD1-CG1 3.97Å; F428-V432 HydrophobicContact CD1-CG2 4.43Å; F428-V432 HydrophobicContact CD2-CG2 4.25Å; F428-V432 HydrophobicContact CE1-CG2 4.07Å; F428-V432 HydrophobicContact CE2-CG2 3.86Å; F428-V432 HydrophobicContact CZ-CG2 3.78Å; F428-V432 WeakPolarHBondContact O-CG2 3.19Å; F428-V432 PolarHBondContact O-N 3.05Å; L429-V432 PolarHBondContact O-N 3.04Å; V432-S434 PolarHBondContact O-N 2.87Å; V432-L435 PolarHBondContact O-N 2.93Å; V432-L436 HydrophobicContact CG1-CD1 3.8Å; V432-L436 HydrophobicContact CG1-CG 4.42Å; V432-L436 WeakPolarHBondContact O-CB 3.46Å; V432-L436 VanDerWaalsContact O-CG 3.32Å; V432-L436 WeakPolarHBondContact O-CG 3.32Å; V432-L436 PolarHBondContact O-N 3.16Å
433	C	94	Very high	91	Very high	19 Å²	19	27.8 Å²	27.8	13%	0.128	15%	0.151	C	C	.	.	H	α-helix	trans	-62.4	-42.2	177.1	-67.3	0	0	0	0	112	A247 L429 K430 Y431 L436 G437	A247-C433 HydrophobicContact CB-CB 3.9Å; L429-C433 WeakPolarHBondContact O-CB 3.29Å; L429-C433 PolarHBondContact O-N 3.35Å; L429-C433 PolarHBondContact O-SG 2.71Å; K430-C433 PolarHBondContact O-N 3.04Å; Y431-C433 PolarHBondContact O-N 3.02Å; C433-L436 PolarHBondContact O-N 3.02Å; C433-G437 PolarHBondContact O-N 3.48Å
434	S	91.6	Very high	90.5	Very high	17 Å²	17	27.5 Å²	27.5	12%	0.119	15%	0.146	C	C	.	.	H	α-helix	trans	-67.6	-36.8	177.4	-73.5	0	0	0	0	112.9	K430 Y431 V432 D438 Y439	K430-S434 WeakPolarHBondContact O-CB 3.11Å; K430-S434 PolarHBondContact O-N 3.04Å; K430-S434 PolarHBondContact O-OG 3.03Å; Y431-S434 PolarHBondContact O-N 3.03Å; V432-S434 PolarHBondContact O-N 2.87Å; S434-D438 WeakPolarHBondContact O-CB 3.27Å; S434-D438 PolarHBondContact O-N 3.14Å; S434-Y439 PolarHBondContact O-N 3.38Å
435	L	91.5	Very high	89.8	Confident	2 Å²	2	30.6 Å²	30.6	1%	0.01	16%	0.162	C	C	.	.	H	α-helix	trans	-66.3	-41.8	173.8	-77.2	-177.6	0	0	0	112.3	A276 L279 Y431 V432 Y439 P440 L442 L443	A276-L435 HydrophobicContact CB-CB 4.22Å; A276-L435 HydrophobicContact CB-CD1 4.15Å; L279-L435 HydrophobicContact CB-CD1 4.29Å; L279-L435 HydrophobicContact CD1-CD1 4.27Å; Y431-L435 HydrophobicContact CD1-CD1 3.84Å; Y431-L435 HydrophobicContact CD1-CG 4.35Å; Y431-L435 HydrophobicContact CE1-CD1 3.16Å; Y431-L435 HydrophobicContact CE1-CG 3.91Å; Y431-L435 HydrophobicContact CE2-CD1 4.3Å; Y431-L435 HydrophobicContact CE2-CD2 4.48Å; Y431-L435 HydrophobicContact CE2-CG 4.24Å; Y431-L435 VanDerWaalsContact CZ-CD1 3.43Å; Y431-L435 PolarHBondContact O-N 3.25Å; V432-L435 PolarHBondContact O-N 2.93Å; L435-Y439 CarbonylContact O-C 3.48Å; L435-Y439 VanDerWaalsContact O-C 3.28Å; L435-P440 VanDerWaalsContact O-CA 3.25Å; L435-P440 WeakPolarHBondContact O-CA 3.26Å; L435-L442 HydrophobicContact CD2-CB 4.35Å; L435-L442 HydrophobicContact CD2-CD1 4.48Å; L435-L443 HydrophobicContact CB-CD2 4.17Å; L435-L443 HydrophobicContact CD1-CD2 3.93Å; L435-L443 HydrophobicContact CD2-CD2 4.45Å; L435-L443 HydrophobicContact CG-CD2 4.44Å
436	L	93	Very high	88.6	Confident	1 Å²	1	34.3 Å²	34.3	1%	0.005	19%	0.188	C	C	.	.	H	α-helix	trans	-74.6	-36.9	-178.4	-68.6	173	0	0	0	112.6	L252 F272 I273 A276 L411 V432 C433 L443	L252-L436 HydrophobicContact CD2-CD2 4.05Å; F272-L436 HydrophobicContact CB-CD2 4.18Å; I273-L436 HydrophobicContact CG1-CD1 4.07Å; I273-L436 HydrophobicContact CG1-CD2 4.13Å; A276-L436 HydrophobicContact CB-CD2 3.97Å; A276-L436 HydrophobicContact CB-CG 4.05Å; L411-L436 HydrophobicContact CD1-CD1 4.09Å; V432-L436 HydrophobicContact CG1-CD1 3.8Å; V432-L436 HydrophobicContact CG1-CG 4.42Å; V432-L436 WeakPolarHBondContact O-CB 3.46Å; V432-L436 VanDerWaalsContact O-CG 3.32Å; V432-L436 WeakPolarHBondContact O-CG 3.32Å; V432-L436 PolarHBondContact O-N 3.16Å; C433-L436 PolarHBondContact O-N 3.02Å; L436-L443 HydrophobicContact CD2-CD1 4.26Å
437	G	90.1	Very high	87.2	Confident	7 Å²	7	33.1 Å²	33.1	7%	0.072	18%	0.177	C	C	.	.	H	α-helix	trans	-96.7	-59.9	-175.9	0	0	0	0	0	114.3	R248 R251 C433	R248-G437 WeakPolarHBondContact O-CA 3.25Å; R251-G437 WeakPolarHBondContact CD-O 3.47Å; C433-G437 PolarHBondContact O-N 3.48Å
438	D	87	Confident	85.7	Confident	72 Å²	72	32.4 Å²	32.4	39%	0.385	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-41.5	-169.4	-62.5	-43.9	0	0	0	112.1	R251 S434 P440	R251-D438 PolarHBondContact NH1-O 3.22Å; S434-D438 WeakPolarHBondContact O-CB 3.27Å; S434-D438 PolarHBondContact O-N 3.14Å; D438-P440 VanDerWaalsContact C-CD 3.48Å
439	Y	87.7	Confident	84	Confident	47 Å²	47	32.4 Å²	32.4	18%	0.184	17%	0.172	C	C	.	.			trans	-131.1	54	-169.1	-52.2	-81.3	0	0	0	114.7	S434 L435 H441 L442 F466 L469	S434-Y439 PolarHBondContact O-N 3.38Å; L435-Y439 CarbonylContact O-C 3.48Å; L435-Y439 VanDerWaalsContact O-C 3.28Å; Y439-H441 AromaticContact CD1-CE1 3.86Å; Y439-H441 PolarHBondContact O-N 3.15Å; Y439-H441 VanDerWaalsContact O-N 3.16Å; Y439-L442 HydrophobicContact CG-CD1 4.21Å; Y439-L442 PolarHBondContact O-N 3.27Å; Y439-L442 VanDerWaalsContact O-N 3.14Å; Y439-F466 HydrophobicContact CD1-CD2 4.17Å; Y439-F466 HydrophobicContact CD1-CE2 4.21Å; Y439-F466 AromaticContact CD2-CD2 3.99Å; Y439-F466 HydrophobicContact CD2-CD2 3.99Å; Y439-F466 AromaticContact CD2-CE2 3.47Å; Y439-F466 HydrophobicContact CD2-CE2 3.47Å; Y439-F466 VanDerWaalsContact CD2-CE2 3.47Å; Y439-F466 AromaticContact CE1-CD2 3.96Å; Y439-F466 HydrophobicContact CE1-CD2 3.96Å; Y439-F466 HydrophobicContact CE1-CE2 4.37Å; Y439-F466 AromaticContact CE2-CD2 3.75Å; Y439-F466 HydrophobicContact CE2-CD2 3.75Å; Y439-F466 AromaticContact CE2-CE2 3.64Å; Y439-F466 HydrophobicContact CE2-CE2 3.64Å; Y439-F466 HydrophobicContact CG-CD2 4.19Å; Y439-F466 AromaticContact CG-CE2 3.77Å; Y439-F466 HydrophobicContact CG-CE2 3.77Å; Y439-F466 AromaticContact CZ-CD2 3.74Å; Y439-L469 HydrophobicContact CE2-CD2 4.39Å; Y439-L469 WeakPolarHBondContact OH-CD2 3.5Å
440	P	87.3	Confident	82.2	Confident	7 Å²	7	33.5 Å²	33.5	5%	0.045	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-63.9	-24.6	-177.2	26.9	-35.8	0	0	0	113.5	R251 L252 L255 L435 D438 L442 L443	R251-P440 HydrophobicContact CB-CG 3.93Å; L252-P440 HydrophobicContact CB-CB 4.23Å; L252-P440 HydrophobicContact CD1-CB 3.88Å; L255-P440 HydrophobicContact CD2-CB 3.88Å; L255-P440 HydrophobicContact CD2-CG 4.42Å; L435-P440 VanDerWaalsContact O-CA 3.25Å; L435-P440 WeakPolarHBondContact O-CA 3.26Å; D438-P440 VanDerWaalsContact C-CD 3.48Å; P440-L442 PolarHBondContact O-N 3.3Å; P440-L443 WeakPolarHBondContact O-CB 3.3Å; P440-L443 PolarHBondContact O-N 3.44Å; P440-L443 VanDerWaalsContact O-N 3.15Å
441	H	86.3	Confident	80.4	Confident	106 Å²	106	34.4 Å²	34.4	49%	0.491	19%	0.188	S	C	.	.	G	3₁₀ helix	trans	-62.8	-28.9	177	62.2	-90.4	0	0	0	113.3	Y439 L443 L444	Y439-H441 AromaticContact CD1-CE1 3.86Å; Y439-H441 PolarHBondContact O-N 3.15Å; Y439-H441 VanDerWaalsContact O-N 3.16Å; H441-L443 PolarHBondContact O-N 3.25Å; H441-L444 WeakPolarHBondContact O-CB 3.46Å; H441-L444 PolarHBondContact O-N 3.14Å
442	L	85.3	Confident	78.6	Confident	35 Å²	35	35.1 Å²	35.1	18%	0.183	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-67	-21.2	178.2	-64.3	178.3	0	0	0	112.3	L435 Y439 P440 L444 D445 P448 F466	L435-L442 HydrophobicContact CD2-CB 4.35Å; L435-L442 HydrophobicContact CD2-CD1 4.48Å; Y439-L442 HydrophobicContact CG-CD1 4.21Å; Y439-L442 PolarHBondContact O-N 3.27Å; Y439-L442 VanDerWaalsContact O-N 3.14Å; P440-L442 PolarHBondContact O-N 3.3Å; L442-L444 PolarHBondContact O-N 2.96Å; L442-D445 PolarHBondContact O-N 3.15Å; L442-P448 HydrophobicContact CB-CB 4.42Å; L442-P448 WeakPolarHBondContact O-CG 3.49Å; L442-F466 HydrophobicContact CD1-CD2 4.37Å; L442-F466 HydrophobicContact CD1-CE2 3.64Å; L442-F466 HydrophobicContact CD1-CZ 3.83Å
443	L	85.9	Confident	76.7	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-70.7	-19	178	-63.6	173.3	0	0	0	112.7	F272 K275 A276 L279 V329 L435 L436 P440 H441	F272-L443 HydrophobicContact CB-CD1 4.06Å; F272-L443 HydrophobicContact CD1-CB 4.14Å; F272-L443 HydrophobicContact CD1-CD1 3.8Å; F272-L443 HydrophobicContact CG-CD1 4.43Å; K275-L443 HydrophobicContact CB-CD2 4.46Å; K275-L443 HydrophobicContact CG-CB 4.5Å; K275-L443 HydrophobicContact CG-CD2 4.12Å; A276-L443 HydrophobicContact CB-CD1 4.49Å; A276-L443 HydrophobicContact CB-CD2 3.96Å; L279-L443 HydrophobicContact CD1-CD2 4.04Å; V329-L443 WeakPolarHBondContact CG2-O 3.37Å; L435-L443 HydrophobicContact CB-CD2 4.17Å; L435-L443 HydrophobicContact CD1-CD2 3.93Å; L435-L443 HydrophobicContact CD2-CD2 4.45Å; L435-L443 HydrophobicContact CG-CD2 4.44Å; L436-L443 HydrophobicContact CD2-CD1 4.26Å; P440-L443 WeakPolarHBondContact O-CB 3.3Å; P440-L443 PolarHBondContact O-N 3.44Å; P440-L443 VanDerWaalsContact O-N 3.15Å; H441-L443 PolarHBondContact O-N 3.25Å
444	L	83.2	Confident	74.5	Confident	60 Å²	60	45 Å²	45	31%	0.314	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	-78.7	-24	179.2	-61.8	179.5	0	0	0	112.9	L255 L259 F272 H441 L442	L255-L444 HydrophobicContact CD1-CD1 4.16Å; L255-L444 HydrophobicContact CD2-CD1 4.27Å; L255-L444 HydrophobicContact CD2-CG 4.48Å; L259-L444 HydrophobicContact CD1-CD1 4.34Å; L259-L444 HydrophobicContact CD1-CD2 3.83Å; L259-L444 HydrophobicContact CD2-CD1 4.16Å; L259-L444 HydrophobicContact CD2-CD2 4.45Å; F272-L444 HydrophobicContact CE1-CD2 4.21Å; H441-L444 WeakPolarHBondContact O-CB 3.46Å; H441-L444 PolarHBondContact O-N 3.14Å; L442-L444 PolarHBondContact O-N 2.96Å
445	D	76.7	Confident	71.8	Confident	76 Å²	76	52.2 Å²	52.2	41%	0.406	26%	0.262	S	S	.	.	S	Bend	trans	-71.3	142.8	177.2	-75	-21.4	0	0	0	110.6	L442 D447 P448	L442-D445 PolarHBondContact O-N 3.15Å; D445-D447 PolarHBondContact O-N 3.34Å; D445-P448 WeakPolarHBondContact O-CD 3.17Å
446	S	67.2	Low	69.4	Low	77 Å²	77	57.2 Å²	57.2	54%	0.538	29%	0.289	S	S	.	.	S	Bend	trans	-60.9	-33.7	-178.9	57.4	0	0	0	0	112.2
447	D	64.2	Low	67	Low	40 Å²	40	64 Å²	64	21%	0.214	33%	0.325	C	S	.	.			trans	-155.5	76.1	-179.4	-162.7	-12.6	0	0	0	113	R282 D445 V449 S450 L451	R282-D447 IonicContact CZ-OD1 2.92Å; R282-D447 IonicContact CZ-OD2 2.74Å; R282-D447 VanDerWaalsContact NH1-CG 3.26Å; R282-D447 IonicContact NH1-OD1 2.68Å; R282-D447 PolarHBondContact NH1-OD1 2.89Å; R282-D447 IonicContact NH1-OD2 3.78Å; R282-D447 PolarHBondContact NH1-OD2 2.82Å; R282-D447 IonicContact NH2-OD2 3.79Å; D445-D447 PolarHBondContact O-N 3.34Å; D447-V449 PolarHBondContact O-N 3.46Å; D447-V449 PolarHBondContact OD1-N 3.35Å; D447-S450 PolarHBondContact O-N 3.29Å; D447-S450 PolarHBondContact OD1-N 3.43Å; D447-S450 PolarHBondContact OD1-OG 3.45Å; D447-S450 WeakPolarHBondContact OD2-CB 3.44Å; D447-S450 PolarHBondContact OD2-OG 2.49Å; D447-L451 PolarHBondContact O-N 3.33Å
448	P	61.4	Low	64.6	Low	8 Å²	8	69 Å²	69	5%	0.052	35%	0.354	C	S	.	.	H	α-helix	trans	-61.6	-29.7	175.7	27.2	-36.2	0	0	0	111.7	L279 L442 D445 L451 L452	L279-P448 HydrophobicContact CD1-CG 3.54Å; L279-P448 HydrophobicContact CD2-CG 4.22Å; L442-P448 HydrophobicContact CB-CB 4.42Å; L442-P448 WeakPolarHBondContact O-CG 3.49Å; D445-P448 WeakPolarHBondContact O-CD 3.17Å; P448-L451 PolarHBondContact O-N 3.38Å; P448-L452 WeakPolarHBondContact O-CG 3.4Å; P448-L452 PolarHBondContact O-N 2.85Å; P448-L452 VanDerWaalsContact O-N 3.15Å
449	V	59.2	Low	62.1	Low	1 Å²	1	69.3 Å²	69.3	1%	0.006	36%	0.362	C	S	.	.	H	α-helix	trans	-70.8	-42.1	-177.8	174	0	0	0	0	111.8	L279 R282 L283 D447 L451 L452 L453	L279-V449 HydrophobicContact CB-CG2 4.18Å; L279-V449 HydrophobicContact CD2-CG2 3.95Å; R282-V449 HydrophobicContact CG-CG1 4.44Å; L283-V449 HydrophobicContact CD1-CG2 4.44Å; L283-V449 HydrophobicContact CD2-CG1 3.68Å; L283-V449 HydrophobicContact CD2-CG2 4.41Å; L283-V449 HydrophobicContact CG-CG1 4.26Å; L283-V449 HydrophobicContact CG-CG2 4.24Å; D447-V449 PolarHBondContact O-N 3.46Å; D447-V449 PolarHBondContact OD1-N 3.35Å; V449-L451 VanDerWaalsContact C-N 3.26Å; V449-L451 PolarHBondContact O-N 2.9Å; V449-L452 WeakPolarHBondContact O-CB 3.42Å; V449-L452 PolarHBondContact O-N 3.25Å; V449-L453 HydrophobicContact CG1-CD1 4.01Å; V449-L453 HydrophobicContact CG1-CG 4.36Å; V449-L453 WeakPolarHBondContact O-CG 3.13Å; V449-L453 PolarHBondContact O-N 2.93Å
450	S	57.6	Low	59.4	Low	26 Å²	26	72.4 Å²	72.4	18%	0.182	39%	0.391	C	S	.	.	H	α-helix	trans	-64.5	-31.5	174.3	-76.1	0	0	0	0	112.7	R282 D447 K454	R282-S450 PolarHBondContact NH2-OG 2.81Å; D447-S450 PolarHBondContact O-N 3.29Å; D447-S450 PolarHBondContact OD1-N 3.43Å; D447-S450 PolarHBondContact OD1-OG 3.45Å; D447-S450 WeakPolarHBondContact OD2-CB 3.44Å; D447-S450 PolarHBondContact OD2-OG 2.49Å; S450-K454 VanDerWaalsContact O-CB 3.29Å; S450-K454 WeakPolarHBondContact O-CB 3.48Å; S450-K454 VanDerWaalsContact O-CG 3.25Å; S450-K454 WeakPolarHBondContact O-CG 3.36Å; S450-K454 PolarHBondContact O-N 3.48Å
451	L	55.6	Low	56.7	Low	102 Å²	102	80.4 Å²	80.4	53%	0.534	43%	0.427	S	S	.	.	H	α-helix	trans	-66.3	-40.6	174.1	-68.6	177.4	0	0	0	111.1	D447 P448 V449 R455	D447-L451 PolarHBondContact O-N 3.33Å; P448-L451 PolarHBondContact O-N 3.38Å; V449-L451 VanDerWaalsContact C-N 3.26Å; V449-L451 PolarHBondContact O-N 2.9Å; L451-R455 WeakPolarHBondContact O-CB 3.36Å; L451-R455 PolarHBondContact O-N 3.4Å
452	L	52.8	Low	54.1	Low	34 Å²	34	86.6 Å²	86.6	18%	0.178	45%	0.446	C	S	.	.	H	α-helix	trans	-62.8	-49.2	173.2	-66.9	168.8	0	0	0	111.7	P448 V449 K454 R455 N456 F466	P448-L452 WeakPolarHBondContact O-CG 3.4Å; P448-L452 PolarHBondContact O-N 2.85Å; P448-L452 VanDerWaalsContact O-N 3.15Å; V449-L452 WeakPolarHBondContact O-CB 3.42Å; V449-L452 PolarHBondContact O-N 3.25Å; L452-K454 VanDerWaalsContact C-N 3.34Å; L452-K454 PolarHBondContact O-N 3.12Å; L452-R455 PolarHBondContact O-N 3.38Å; L452-N456 PolarHBondContact O-N 3.2Å; L452-N456 VanDerWaalsContact O-N 3.12Å; L452-F466 HydrophobicContact CD1-CE1 3.98Å; L452-F466 HydrophobicContact CD2-CD1 3.9Å; L452-F466 HydrophobicContact CD2-CE1 3.98Å
453	L	54	Low	51.8	Low	86 Å²	86	91.3 Å²	91.3	45%	0.45	47%	0.472	S	S	.	.	H	α-helix	trans	-65.2	-34.5	-179.7	-69	173.4	0	0	0	113	V449	V449-L453 HydrophobicContact CG1-CD1 4.01Å; V449-L453 HydrophobicContact CG1-CG 4.36Å; V449-L453 WeakPolarHBondContact O-CG 3.13Å; V449-L453 PolarHBondContact O-N 2.93Å
454	K	46.6	Very low	49.8	Very low	140 Å²	140	94.6 Å²	94.6	61%	0.609	49%	0.49	S	S	*	.	H	α-helix	trans	-72.8	-37.6	175.3	-76.2	175.2	-178.9	175.5	0	112.1	S450 L452 N456 N457 T458	S450-K454 VanDerWaalsContact O-CB 3.29Å; S450-K454 WeakPolarHBondContact O-CB 3.48Å; S450-K454 VanDerWaalsContact O-CG 3.25Å; S450-K454 WeakPolarHBondContact O-CG 3.36Å; S450-K454 PolarHBondContact O-N 3.48Å; L452-K454 VanDerWaalsContact C-N 3.34Å; L452-K454 PolarHBondContact O-N 3.12Å; K454-N456 VanDerWaalsContact C-N 3.31Å; K454-N456 PolarHBondContact O-N 3.24Å; K454-N457 PolarHBondContact O-N 3.23Å; K454-T458 PolarHBondContact O-N 3.18Å; K454-T458 PolarHBondContact O-OG1 3.27Å
455	R	36.3	Very low	47.9	Very low	169 Å²	169	100.1 Å²	100.1	64%	0.638	51%	0.514	S	S	*	.	H	α-helix	trans	-59.9	-42.3	174.9	-105.6	177.7	162.5	157.1	-6	111.7	L451 L452 N457 T458	L451-R455 WeakPolarHBondContact O-CB 3.36Å; L451-R455 PolarHBondContact O-N 3.4Å; L452-R455 PolarHBondContact O-N 3.38Å; R455-N457 PolarHBondContact O-N 3.37Å; R455-N457 VanDerWaalsContact O-N 3.12Å; R455-T458 PolarHBondContact O-N 2.98Å
456	N	41.2	Very low	46.3	Very low	107 Å²	107	98.4 Å²	98.4	57%	0.572	50%	0.503	S	S	*	.	H	α-helix	trans	-61	-22.9	177.9	-71.7	-8.6	0	0	0	113.9	L452 K454	L452-N456 PolarHBondContact O-N 3.2Å; L452-N456 VanDerWaalsContact O-N 3.12Å; K454-N456 VanDerWaalsContact C-N 3.31Å; K454-N456 PolarHBondContact O-N 3.24Å
457	N	41.8	Very low	45.1	Very low	143 Å²	143	96.3 Å²	96.3	77%	0.765	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.3	-6.5	-179.4	-75.8	-30.4	0	0	0	114.7	K454 R455	K454-N457 PolarHBondContact O-N 3.23Å; R455-N457 PolarHBondContact O-N 3.37Å; R455-N457 VanDerWaalsContact O-N 3.12Å
458	T	39.5	Very low	44	Very low	112 Å²	112	98.2 Å²	98.2	69%	0.687	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.9	-4.6	-165.8	47	0	0	0	0	118.8	K454 R455	K454-T458 PolarHBondContact O-N 3.18Å; K454-T458 PolarHBondContact O-OG1 3.27Å; R455-T458 PolarHBondContact O-N 2.98Å
459	S	34.4	Very low	43.1	Very low	80 Å²	80	101.3 Å²	101.3	56%	0.559	51%	0.511	S	S	*	.			trans	-155.7	114.8	179.2	53.9	0	0	0	0	115.8
460	S	31.4	Very low	42.4	Very low	112 Å²	112	103.3 Å²	103.3	78%	0.783	52%	0.522	S	S	*	.	S	Bend	trans	-56.9	142.7	141.9	40.9	0	0	0	0	110.7
461	Q	31.2	Very low	41.6	Very low	174 Å²	174	107.3 Å²	107.3	81%	0.813	54%	0.54	S	S	*	.	S	Bend	trans	67.9	78.1	172.2	-60.3	-173.2	-29.3	0	0	116.3
462	R	29.9	Very low	40.6	Very low	236 Å²	236	106.4 Å²	106.4	89%	0.891	54%	0.543	S	S	*	.			trans	-177.8	78	132.2	-100.1	-175	-63.2	167.9	1.6	108.2
463	D	38.3	Very low	39.8	Very low	135 Å²	135	111.7 Å²	111.7	72%	0.722	56%	0.564	S	S	*	*			trans	-47.9	146.9	162.1	-45.5	-12.1	0	0	0	109.2
464	D	44.1	Very low	38.8	Very low	69 Å²	69	109.3 Å²	109.3	37%	0.369	55%	0.553	S	S	.	*			cis	162.1	99.2	-9.8	-92.4	-33.1	0	0	0	102.1	N468	D464-N468 HydrophobicContact CB-CB 3.59Å; D464-N468 WeakPolarHBondContact CB-ND2 3.29Å; D464-N468 WeakPolarHBondContact O-CB 3.25Å; D464-N468 PolarHBondContact O-ND2 3.19Å; D464-N468 PolarHBondContact OD2-OD1 3.43Å
465	E	43.2	Very low	38	Very low	176 Å²	176	107.2 Å²	107.2	82%	0.822	55%	0.549	S	S	*	.	S	Bend	trans	-115.6	-31.2	174	-153	176.5	-160.5	0	0	111.5	L469	E465-L469 WeakPolarHBondContact O-CB 3.46Å
466	F	42.1	Very low	37.8	Very low	39 Å²	39	105.6 Å²	105.6	17%	0.171	56%	0.557	C	S	.	*	S	Bend	trans	-93.8	-44.8	173.3	-170.2	-98.2	0	0	0	111.6	Y439 L442 L452 L469 I470	Y439-F466 HydrophobicContact CD1-CD2 4.17Å; Y439-F466 HydrophobicContact CD1-CE2 4.21Å; Y439-F466 AromaticContact CD2-CD2 3.99Å; Y439-F466 HydrophobicContact CD2-CD2 3.99Å; Y439-F466 AromaticContact CD2-CE2 3.47Å; Y439-F466 HydrophobicContact CD2-CE2 3.47Å; Y439-F466 VanDerWaalsContact CD2-CE2 3.47Å; Y439-F466 AromaticContact CE1-CD2 3.96Å; Y439-F466 HydrophobicContact CE1-CD2 3.96Å; Y439-F466 HydrophobicContact CE1-CE2 4.37Å; Y439-F466 AromaticContact CE2-CD2 3.75Å; Y439-F466 HydrophobicContact CE2-CD2 3.75Å; Y439-F466 AromaticContact CE2-CE2 3.64Å; Y439-F466 HydrophobicContact CE2-CE2 3.64Å; Y439-F466 HydrophobicContact CG-CD2 4.19Å; Y439-F466 AromaticContact CG-CE2 3.77Å; Y439-F466 HydrophobicContact CG-CE2 3.77Å; Y439-F466 AromaticContact CZ-CD2 3.74Å; L442-F466 HydrophobicContact CD1-CD2 4.37Å; L442-F466 HydrophobicContact CD1-CE2 3.64Å; L442-F466 HydrophobicContact CD1-CZ 3.83Å; L452-F466 HydrophobicContact CD1-CE1 3.98Å; L452-F466 HydrophobicContact CD2-CD1 3.9Å; L452-F466 HydrophobicContact CD2-CE1 3.98Å; F466-L469 PolarHBondContact O-N 3.18Å; F466-L469 VanDerWaalsContact O-N 3.14Å; F466-I470 HydrophobicContact CD1-CG1 4.21Å; F466-I470 HydrophobicContact CE1-CD1 4.35Å; F466-I470 HydrophobicContact CE1-CG1 4.02Å; F466-I470 HydrophobicContact CE2-CD1 4.42Å; F466-I470 HydrophobicContact CE2-CG1 4.42Å; F466-I470 HydrophobicContact CG-CG1 4.5Å; F466-I470 HydrophobicContact CZ-CD1 4.06Å; F466-I470 HydrophobicContact CZ-CG1 4.14Å; F466-I470 WeakPolarHBondContact O-CB 3.24Å; F466-I470 WeakPolarHBondContact O-CG1 2.97Å; F466-I470 PolarHBondContact O-N 3.01Å
467	D	42.2	Very low	37.3	Very low	34 Å²	34	107.4 Å²	107.4	18%	0.182	57%	0.567	C	S	.	*	H	α-helix	trans	-72.6	-37.1	179.7	-67	-39.5	0	0	0	112.1	L469 L471	D467-L469 VanDerWaalsContact C-N 3.25Å; D467-L469 PolarHBondContact O-N 3.12Å; D467-L471 HydrophobicContact CB-CD1 4.3Å; D467-L471 VanDerWaalsContact O-CB 3.24Å; D467-L471 WeakPolarHBondContact O-CB 3.44Å; D467-L471 PolarHBondContact O-N 3.19Å
468	N	40.8	Very low	36.8	Very low	80 Å²	80	107.8 Å²	107.8	43%	0.428	57%	0.568	S	S	.	*	H	α-helix	trans	-64.2	-27	167.7	-94.2	-21.1	0	0	0	112.8	D464 S472	D464-N468 HydrophobicContact CB-CB 3.59Å; D464-N468 WeakPolarHBondContact CB-ND2 3.29Å; D464-N468 WeakPolarHBondContact O-CB 3.25Å; D464-N468 PolarHBondContact O-ND2 3.19Å; D464-N468 PolarHBondContact OD2-OD1 3.43Å; N468-S472 WeakPolarHBondContact O-CB 3.41Å; N468-S472 PolarHBondContact O-N 3.48Å; N468-S472 PolarHBondContact O-OG 2.78Å
469	L	43	Very low	36.6	Very low	72 Å²	72	109 Å²	109	38%	0.377	57%	0.569	S	S	.	*	H	α-helix	trans	-85.4	-33.6	-178.1	-159.5	75.2	0	0	0	112.2	Y439 E465 F466 D467	Y439-L469 HydrophobicContact CE2-CD2 4.39Å; Y439-L469 WeakPolarHBondContact OH-CD2 3.5Å; E465-L469 WeakPolarHBondContact O-CB 3.46Å; F466-L469 PolarHBondContact O-N 3.18Å; F466-L469 VanDerWaalsContact O-N 3.14Å; D467-L469 VanDerWaalsContact C-N 3.25Å; D467-L469 PolarHBondContact O-N 3.12Å
470	I	44.4	Very low	36.4	Very low	44 Å²	44	114.1 Å²	114.1	23%	0.226	58%	0.584	C	S	.	*	H	α-helix	trans	-85.2	-38.6	-178.1	-62.6	-92.5	0	0	0	111.1	F466	F466-I470 HydrophobicContact CD1-CG1 4.21Å; F466-I470 HydrophobicContact CE1-CD1 4.35Å; F466-I470 HydrophobicContact CE1-CG1 4.02Å; F466-I470 HydrophobicContact CE2-CD1 4.42Å; F466-I470 HydrophobicContact CE2-CG1 4.42Å; F466-I470 HydrophobicContact CG-CG1 4.5Å; F466-I470 HydrophobicContact CZ-CD1 4.06Å; F466-I470 HydrophobicContact CZ-CG1 4.14Å; F466-I470 WeakPolarHBondContact O-CB 3.24Å; F466-I470 WeakPolarHBondContact O-CG1 2.97Å; F466-I470 PolarHBondContact O-N 3.01Å
471	L	40.4	Very low	36.5	Very low	109 Å²	109	113.9 Å²	113.9	57%	0.571	58%	0.578	S	S	*	*	H	α-helix	trans	-95	-19.6	-176.5	-65.2	162.4	0	0	0	114.6	D467 N475	D467-L471 HydrophobicContact CB-CD1 4.3Å; D467-L471 VanDerWaalsContact O-CB 3.24Å; D467-L471 WeakPolarHBondContact O-CB 3.44Å; D467-L471 PolarHBondContact O-N 3.19Å; L471-N475 VanDerWaalsContact O-O 3.14Å
472	S	34.9	Very low	36.4	Very low	83 Å²	83	113.6 Å²	113.6	58%	0.58	58%	0.581	S	S	*	*	S	Bend	trans	-89.5	-9.9	175.6	81.4	0	0	0	0	114.4	N468	N468-S472 WeakPolarHBondContact O-CB 3.41Å; N468-S472 PolarHBondContact O-N 3.48Å; N468-S472 PolarHBondContact O-OG 2.78Å
473	K	35.4	Very low	36.5	Very low	146 Å²	146	112.1 Å²	112.1	64%	0.635	60%	0.598	S	S	*	*	S	Bend	trans	-124.8	8.6	-177.9	-72.6	-177.8	177.3	176.4	0	114.2	K430	K430-K473 PolarHBondContact NZ-O 3.33Å
474	V	33.6	Very low	36.4	Very low	35 Å²	35	111 Å²	111	21%	0.212	59%	0.592	C	S	.	*	S	Bend	trans	-150.5	116.4	173.3	-165.6	0	0	0	0	107.1	K430	K430-V474 HydrophobicContact CD-CG2 3.23Å; K430-V474 HydrophobicContact CG-CG2 4.14Å
475	N	29.8	Very low	36	Very low	97 Å²	97	113.2 Å²	113.2	52%	0.519	60%	0.603	S	S	.	*	S	Bend	trans	67.2	113.4	-168.4	-58.2	-31.7	0	0	0	111.5	L471	L471-N475 VanDerWaalsContact O-O 3.14Å
476	T	31.6	Very low	35.6	Very low	134 Å²	134	109.7 Å²	109.7	82%	0.822	59%	0.591	S	S	*	*	S	Bend		-174.8	44.4	65.8	-34.1	0	0	0	0	111.6
477	D	30.4	Very low	35.3	Very low	146 Å²	146	113.9 Å²	113.9	78%	0.781	62%	0.616	S	S	*	*	S	Bend	trans	-134.4	2	-178	-92.2	-27.2	0	0	0	116.6
478	I	33.1	Very low	34.8	Very low	150 Å²	150	118.9 Å²	118.9	77%	0.769	64%	0.643	S	S	*	*	S	Bend	trans	-109.8	-4.8	-175.6	-64.1	175.9	0	0	0	113.7
479	I	33.6	Very low	34.4	Very low	139 Å²	139	121.5 Å²	121.5	71%	0.713	66%	0.657	S	S	*	*	S	Bend	trans	-97.4	3.3	178.7	-62.4	-179.9	0	0	0	112.9	V423	V423-I479 HydrophobicContact CG2-CD1 4.06Å
480	Q	31.2	Very low	33.8	Very low	186 Å²	186	125 Å²	125	87%	0.869	68%	0.677	S	S	*	*	S	Bend	trans	-116.3	13.9	176.4	-99.8	-178.2	-14.7	0	0	115.3
481	T	33.5	Very low	33	Very low	108 Å²	108	131.2 Å²	131.2	66%	0.663	71%	0.712	S	S	*	*	S	Bend	trans	-125.1	15	-177.4	-14.5	0	0	0	0	115
482	L	27.9	Very low	32.4	Very low	167 Å²	167	133.1 Å²	133.1	87%	0.874	72%	0.724	S	S	*	*			trans	-138.3	37.1	176.4	-81	167.4	0	0	0	113.5
483	V	33.5	Very low	32.1	Very low	206 Å²	206	137.6 Å²	137.6	100%	1.248	74%	0.737	S	S	*	*			trans	-125.8	0	148.4	175.1	0	0	0	0	105.6

Retrieved 483 of 483 residues in 163.9 ms (Link to these results)

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