A0A077ZIM7_TRITR Loading...

Papilin

AlphaFold DB , UniProt , Accession A0A077ZIM7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 697 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	31.7	Very low	37.3	Very low	238 Å²	238	166.1 Å²	166.1	100%	1.172	88%	0.878	S	S	*	*				0	138.9	0	-86.2	-177.4	173.5	0	0	108.9
2	K	36.6	Very low	37	Very low	191 Å²	191	167 Å²	167	83%	0.83	88%	0.882	S	S	*	*			trans	73	108	165.4	-64.8	-174.9	178.6	-178.5	0	118.9
3	T	39.1	Very low	36.9	Very low	120 Å²	120	162.8 Å²	162.8	74%	0.736	88%	0.875	S	S	*	*			trans	47.5	118.5	131	56.7	0	0	0	0	119.9
4	I	40.2	Very low	37	Very low	161 Å²	161	162 Å²	162	83%	0.826	88%	0.878	S	S	*	*				166.7	109.7	116.2	-78.5	150.9	0	0	0	107.3
5	S	40.2	Very low	37	Very low	122 Å²	122	159.5 Å²	159.5	85%	0.853	87%	0.87	S	S	*	*			trans	-161.4	79	161.7	-81.6	0	0	0	0	108.6
6	V	40.2	Very low	36.7	Very low	139 Å²	139	160.7 Å²	160.7	84%	0.842	87%	0.868	S	S	*	*			trans	-139.7	75.4	172.2	-174.7	0	0	0	0	108.1
7	I	40.7	Very low	36.4	Very low	163 Å²	163	159 Å²	159	84%	0.836	86%	0.864	S	S	*	*			trans	-150.7	82.2	154.4	-53.3	-178.3	0	0	0	107.3
8	L	38.1	Very low	36.1	Very low	168 Å²	168	160 Å²	160	88%	0.88	86%	0.862	S	S	*	*			trans	-169.8	56.8	161.8	-115.4	138.8	0	0	0	110.4
9	W	33.7	Very low	35.9	Very low	249 Å²	249	157.3 Å²	157.3	94%	0.943	86%	0.864	S	S	*	*			trans	-142.2	113.4	170.2	-88.6	74	0	0	0	108.2
10	L	34.7	Very low	35.7	Very low	180 Å²	180	153 Å²	153	94%	0.942	86%	0.857	S	S	*	*			trans	156	60	148.3	-83.2	168.3	0	0	0	112.2
11	A	35.7	Very low	35.7	Very low	96 Å²	96	154.7 Å²	154.7	79%	0.793	86%	0.855	S	S	*	*			trans	-149.5	52.6	167.3	0	0	0	0	0	112.5
12	L	33	Very low	36.1	Very low	177 Å²	177	154 Å²	154	93%	0.927	84%	0.84	S	S	*	*			trans	-149.4	82.4	167.1	-78.2	177.5	0	0	0	110
13	S	36.2	Very low	36.2	Very low	113 Å²	113	148.8 Å²	148.8	79%	0.79	84%	0.84	S	S	*	*			trans	-170.6	72.7	157.6	62.4	0	0	0	0	112.1
14	V	38.4	Very low	36.5	Very low	151 Å²	151	148.5 Å²	148.5	92%	0.915	83%	0.833	S	S	*	*			trans	-147.2	84.4	150.7	-170.2	0	0	0	0	107.9
15	T	37.2	Very low	38.3	Very low	124 Å²	124	144.2 Å²	144.2	76%	0.761	81%	0.812	S	S	*	*			trans	-87.3	129.2	165.8	45.3	0	0	0	0	109.2
16	E	31.4	Very low	40.4	Very low	179 Å²	179	141.2 Å²	141.2	84%	0.836	79%	0.786	S	S	*	*			trans	54.8	88.1	145.1	-70.2	164	171.3	0	0	118.3
17	T	32.7	Very low	42.8	Very low	132 Å²	132	134.7 Å²	134.7	81%	0.81	75%	0.747	S	S	*	*			trans	-151.1	151.8	130.1	46	0	0	0	0	107.3
18	Q	31	Very low	45.2	Very low	177 Å²	177	130.9 Å²	130.9	83%	0.827	73%	0.728	S	S	*	*	S	Bend	trans	106.9	47.8	173.1	-49	-80.8	-11.3	0	0	116.9
19	A	30.7	Very low	47.7	Very low	109 Å²	109	124.7 Å²	124.7	90%	0.901	70%	0.696	S	S	*	*	S	Bend	trans	-157.8	125.1	142.7	0	0	0	0	0	109.1
20	G	33.7	Very low	50.5	Low	70 Å²	70	117.3 Å²	117.3	72%	0.722	68%	0.68	S	S	*	*			trans	130.1	34.7	-175.6	0	0	0	0	0	113.9	R22	G20-R22 PolarHBondContact O-N 2.75Å
21	K	35	Very low	53.3	Low	189 Å²	189	114 Å²	114	82%	0.822	66%	0.658	S	S	*	*			trans	-67.3	93.9	159.1	-75.7	-175.2	-178.9	176.7	0	106.5	G23	K21-G23 PolarHBondContact O-N 2.86Å
22	R	40.2	Very low	55.9	Low	225 Å²	225	113.4 Å²	113.4	85%	0.849	64%	0.639	S	S	*	*			trans	-32	129.3	146.4	-91.5	175	167.2	162.2	-4.2	106.5	G20 L24	G20-R22 PolarHBondContact O-N 2.75Å; R22-L24 PolarHBondContact O-N 3.37Å
23	G	38.4	Very low	58.7	Low	80 Å²	80	111.3 Å²	111.3	83%	0.825	62%	0.622	S	S	*	*			trans	-54.6	97.8	165.4	0	0	0	0	0	106.5	K21 N25	K21-G23 PolarHBondContact O-N 2.86Å; G23-N25 PolarHBondContact O-N 2.72Å
24	L	46.2	Very low	61.2	Low	114 Å²	114	106.8 Å²	106.8	60%	0.597	59%	0.593	S	S	*	*			trans	-59.6	115.5	-178.9	-83.4	155.7	0	0	0	104.9	R22 L26 L29	R22-L24 PolarHBondContact O-N 3.37Å; L24-L26 PolarHBondContact O-N 2.89Å; L24-L26 VanDerWaalsContact O-N 3.17Å; L24-L29 HydrophobicContact CB-CD2 4.04Å; L24-L29 HydrophobicContact CD1-CD2 4.22Å
25	N	77.2	Confident	63.2	Low	71 Å²	71	109.7 Å²	109.7	38%	0.38	59%	0.588	S	S	.	*			trans	-54.1	128.8	173.1	-177.9	-29.2	0	0	0	106	G23 C27 D28	G23-N25 PolarHBondContact O-N 2.72Å; N25-C27 PolarHBondContact O-N 3.16Å; N25-C27 WeakPolarHBondContact OD1-CB 3.14Å; N25-C27 PolarHBondContact OD1-N 3.07Å; N25-C27 PolarHBondContact OD1-SG 2.01Å; N25-D28 HydrophobicContact CB-CB 4.47Å; N25-D28 WeakPolarHBondContact CB-OD2 3.22Å; N25-D28 WeakPolarHBondContact O-CB 3.47Å; N25-D28 PolarHBondContact O-N 2.01Å
26	L	84.3	Confident	65.6	Low	59 Å²	59	106.4 Å²	106.4	31%	0.309	57%	0.569	S	S	.	*	G	3₁₀ helix	trans	-49.4	-34.3	-178.3	114.9	85.2	0	0	0	110.5	L24 D28 L29 A64 N65 F67 A76	L24-L26 PolarHBondContact O-N 2.89Å; L24-L26 VanDerWaalsContact O-N 3.17Å; L26-D28 VanDerWaalsContact C-N 3.31Å; L26-D28 PolarHBondContact O-N 2.66Å; L26-L29 PolarHBondContact O-N 3.19Å; L26-A64 HydrophobicContact CB-CB 4.16Å; L26-A64 HydrophobicContact CD1-CB 3.77Å; L26-A64 WeakPolarHBondContact CD1-O 2.91Å; L26-N65 VanDerWaalsContact O-CB 3.32Å; L26-N65 WeakPolarHBondContact O-CB 3.39Å; L26-F67 HydrophobicContact CD1-CE1 4.18Å; L26-F67 HydrophobicContact CD1-CE2 4.1Å; L26-F67 HydrophobicContact CD1-CZ 3.54Å; L26-F67 HydrophobicContact CD2-CE1 4.35Å; L26-F67 HydrophobicContact CD2-CZ 4.09Å; L26-F67 HydrophobicContact CG-CZ 4.1Å; L26-A76 HydrophobicContact CD2-CB 4.44Å
27	C	91.2	Very high	68.1	Low	2 Å²	2	106.4 Å²	106.4	1%	0.014	57%	0.574	C	S	.	*	G	3₁₀ helix	trans	-76.3	-14.5	-178.2	-55.1	0	0	0	0	114	N25 Y45 Q47 A76 C77	N25-C27 PolarHBondContact O-N 3.16Å; N25-C27 WeakPolarHBondContact OD1-CB 3.14Å; N25-C27 PolarHBondContact OD1-N 3.07Å; N25-C27 PolarHBondContact OD1-SG 2.01Å; C27-Y45 HydrophobicContact CB-CD1 3.93Å; C27-Y45 HydrophobicContact CB-CG 4.26Å; C27-Q47 PolarHBondContact O-NE2 3.24Å; C27-A76 PolarHBondContact SG-O 3.03Å; C27-C77 HydrophobicContact CB-CB 3.6Å; C27-C77 WeakPolarHBondContact CB-SG 3.5Å; C27-C77 WeakPolarHBondContact SG-CA 3.21Å; C27-C77 WeakPolarHBondContact SG-CB 3.08Å; C27-C77 CovalentContact SG-SG 2.02Å; C27-C77 PolarHBondContact SG-SG 3.27Å
28	D	90.1	Very high	70.1	Confident	84 Å²	84	101.2 Å²	101.2	45%	0.449	55%	0.547	S	S	.	.	G	3₁₀ helix	trans	-84.5	-14.8	175.8	-63.6	-17	0	0	0	112.7	N25 L26 Q47	N25-D28 HydrophobicContact CB-CB 4.47Å; N25-D28 WeakPolarHBondContact CB-OD2 3.22Å; N25-D28 WeakPolarHBondContact O-CB 3.47Å; N25-D28 PolarHBondContact O-N 2.01Å; L26-D28 VanDerWaalsContact C-N 3.31Å; L26-D28 PolarHBondContact O-N 2.66Å; D28-Q47 PolarHBondContact OD1-NE2 3.15Å
29	L	91	Very high	72.6	Confident	38 Å²	38	103 Å²	103	20%	0.199	55%	0.546	C	S	.	.	S	Bend	trans	-69.9	145.2	-177.9	-55.2	171.6	0	0	0	110.4	L24 L26 N63 A64 N65	L24-L29 HydrophobicContact CB-CD2 4.04Å; L24-L29 HydrophobicContact CD1-CD2 4.22Å; L26-L29 PolarHBondContact O-N 3.19Å; L29-N63 HydrophobicContact CD1-CB 4.06Å; L29-A64 HydrophobicContact CD1-CB 3.91Å; L29-N65 HydrophobicContact CB-CB 3.96Å; L29-N65 PolarHBondContact O-ND2 2.79Å
30	P	92.1	Very high	74.9	Confident	93 Å²	93	100.6 Å²	100.6	60%	0.604	51%	0.514	S	S	*	.	P	Polyproline II helix	trans	-67.2	158.2	176.9	29.2	-35.6	0	0	0	111.5	E32 N63	P30-E32 PolarHBondContact O-N 2.79Å; P30-N63 PolarHBondContact O-ND2 2.76Å; P30-N63 PolarHBondContact O-OD1 3.25Å
31	K	92.9	Very high	77.5	Confident	111 Å²	111	102 Å²	102	48%	0.483	51%	0.509	S	S	.	.	P	Polyproline II helix	trans	-61.4	134	166.1	63.9	177.6	163.3	-146	0	110.5	Y44 F55	K31-Y44 HydrophobicContact CB-CD1 3.75Å; K31-Y44 HydrophobicContact CB-CD2 3.66Å; K31-Y44 HydrophobicContact CB-CE1 3.96Å; K31-Y44 HydrophobicContact CB-CE2 3.88Å; K31-Y44 HydrophobicContact CB-CG 3.6Å; K31-Y44 HydrophobicContact CD-CD1 4.17Å; K31-Y44 HydrophobicContact CD-CE1 3.57Å; K31-Y44 HydrophobicContact CD-CE2 4.24Å; K31-Y44 HydrophobicContact CG-CD2 4.48Å; K31-Y44 HydrophobicContact CG-CE1 4.27Å; K31-Y44 HydrophobicContact CG-CE2 4.21Å; K31-Y44 PolarHBondContact NZ-OH 2.84Å; K31-F55 HydrophobicContact CB-CD2 4.33Å; K31-F55 HydrophobicContact CB-CG 4.33Å; K31-F55 HydrophobicContact CD-CB 4.19Å
32	E	91.9	Very high	80.2	Confident	84 Å²	84	95.7 Å²	95.7	39%	0.393	48%	0.48	S	S	.	.			trans	-131	111	-178.7	-172.1	166.8	-162.2	0	0	111.5	P30 G34 F55 D61 N63	P30-E32 PolarHBondContact O-N 2.79Å; E32-G34 VanDerWaalsContact C-N 3.28Å; E32-G34 PolarHBondContact O-N 3.26Å; E32-F55 WeakPolarHBondContact O-CE2 2.99Å; E32-D61 WeakPolarHBondContact CG-O 3.31Å; E32-N63 VanDerWaalsContact CB-ND2 3.29Å; E32-N63 WeakPolarHBondContact CB-ND2 3.34Å; E32-N63 WeakPolarHBondContact OE2-CB 3.38Å; E32-N63 PolarHBondContact OE2-N 3.36Å; E32-N63 PolarHBondContact OE2-ND2 3.43Å
33	K	91.2	Very high	82.7	Confident	132 Å²	132	87.8 Å²	87.8	57%	0.574	45%	0.45	S	S	*	.			trans	-63.1	-36.5	177.7	178.2	179	176.4	-167.9	0	111.2	T56 Y57 S58	K33-T56 WeakPolarHBondContact CG-O 3.36Å; K33-Y57 VanDerWaalsContact O-CD2 3.26Å; K33-Y57 WeakPolarHBondContact O-CD2 3.07Å; K33-S58 WeakPolarHBondContact O-CA 2.99Å; K33-S58 WeakPolarHBondContact O-CB 3.37Å; K33-S58 PolarHBondContact O-N 2.97Å; K33-S58 PolarHBondContact O-OG 2.91Å
34	G	87.8	Confident	85.4	Confident	19 Å²	19	84.5 Å²	84.5	20%	0.196	41%	0.413	C	S	.	.			trans	72.7	177.4	-169.9	0	0	0	0	0	113.9	E32 S58 C60 D61	E32-G34 VanDerWaalsContact C-N 3.28Å; E32-G34 PolarHBondContact O-N 3.26Å; G34-S58 WeakPolarHBondContact CA-OG 3.48Å; G34-S58 PolarHBondContact O-OG 3.06Å; G34-C60 WeakPolarHBondContact CA-O 3.13Å; G34-D61 WeakPolarHBondContact CA-O 3.49Å
35	R	81.7	Confident	87.7	Confident	212 Å²	212	79.9 Å²	79.9	80%	0.8	39%	0.388	S	S	*	.	S	Bend	trans	-100.7	-2.5	-166.7	-68.5	-176.4	-76.5	-154.9	-6.2	115.9	S58 D61	R35-S58 PolarHBondContact N-OG 3.28Å; R35-D61 IonicContact CZ-OD2 3.05Å; R35-D61 IonicContact NE-OD2 3.56Å; R35-D61 PolarHBondContact NE-OD2 3.41Å; R35-D61 IonicContact NH2-OD2 3.84Å; R35-D61 PolarHBondContact NH2-OD2 2.89Å; R35-D61 VanDerWaalsContact NH2-OD2 3.12Å
36	C	87	Confident	88.5	Confident	54 Å²	54	77.2 Å²	77.2	37%	0.365	37%	0.373	S	S	.	.	S	Bend	trans	-74	177	-179.9	-83.4	0	0	0	0	113.1	S58 C60	C36-S58 WeakPolarHBondContact CB-O 3Å; C36-S58 PolarHBondContact N-OG 3.26Å; C36-S58 VanDerWaalsContact N-OG 3.09Å; C36-S58 VanDerWaalsContact O-CB 3.24Å; C36-S58 WeakPolarHBondContact O-CB 3.2Å; C36-C60 HydrophobicContact CB-CB 4.06Å; C36-C60 WeakPolarHBondContact CB-SG 3.15Å; C36-C60 PolarHBondContact N-SG 3.47Å; C36-C60 WeakPolarHBondContact SG-CB 3.36Å; C36-C60 CovalentContact SG-SG 2.02Å; C36-C60 PolarHBondContact SG-SG 2.84Å
37	L	83	Confident	88.5	Confident	179 Å²	179	77.9 Å²	77.9	94%	0.937	38%	0.375	S	S	*	.	S	Bend	trans	-101	1	-178.6	-61.5	178.2	0	0	0	114.1
38	G	75.1	Confident	88.2	Confident	24 Å²	24	83.6 Å²	83.6	25%	0.247	41%	0.412	C	S	.	.			trans	-71.6	163.6	177.1	0	0	0	0	0	112.7	S58	G38-S58 CarbonylContact C-O 3.52Å; G38-S58 WeakPolarHBondContact CA-O 3.31Å; G38-S58 PolarHBondContact N-O 2.79Å; G38-S58 VanDerWaalsContact O-CA 3.31Å; G38-S58 WeakPolarHBondContact O-CA 3.3Å
39	R	83.9	Confident	88.2	Confident	215 Å²	215	84.3 Å²	84.3	81%	0.811	41%	0.411	S	S	*	.			trans	-133.8	86.8	176.8	-165.2	-177.2	-177.7	176.8	-0.9	109.7	T56	R39-T56 HydrophobicContact CB-CG2 4.39Å; R39-T56 HydrophobicContact CG-CG2 3.47Å; R39-T56 VanDerWaalsContact CG-CG2 3.47Å
40	Y	80	Confident	88.1	Confident	58 Å²	58	90.9 Å²	90.9	23%	0.227	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	128.5	-176.3	-53.3	-78.8	0	0	0	110.6	R42 T56 Y57 G59 N121	Y40-R42 PolarHBondContact O-N 3.23Å; Y40-T56 CarbonylContact O-C 3.57Å; Y40-T56 WeakPolarHBondContact O-CA 3.3Å; Y40-Y57 HydrophobicContact CD2-CD1 4.38Å; Y40-Y57 WeakPolarHBondContact CD2-O 3.37Å; Y40-Y57 PolarHBondContact N-O 3.46Å; Y40-Y57 PolarHBondContact O-N 3.07Å; Y40-G59 VanDerWaalsContact CE2-CA 3.44Å; Y40-N121 WeakPolarHBondContact CD1-ND2 3.35Å; Y40-N121 VanDerWaalsContact CE1-ND2 3.28Å; Y40-N121 WeakPolarHBondContact CE1-ND2 3.39Å
41	T	87.4	Confident	88	Confident	100 Å²	100	91.1 Å²	91.1	61%	0.613	43%	0.425	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.4	119.8	170.5	-58.5	0	0	0	0	109	R54	T41-R54 HydrophobicContact CG2-CB 4.43Å
42	R	92.4	Very high	88	Confident	55 Å²	55	86.1 Å²	86.1	21%	0.208	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	173.4	177.6	-65.1	-65.8	-177.9	83.7	-1.3	109.8	Y40 R54 F55 Y57 N66 F67	Y40-R42 PolarHBondContact O-N 3.23Å; R42-R54 CarbonylContact O-C 3.57Å; R42-R54 WeakPolarHBondContact O-CA 2.97Å; R42-F55 HydrophobicContact CB-CD1 3.91Å; R42-F55 HydrophobicContact CB-CE1 3.41Å; R42-F55 VanDerWaalsContact CB-CE1 3.41Å; R42-F55 HydrophobicContact CB-CZ 3.8Å; R42-F55 PolarHBondContact N-O 3.49Å; R42-F55 PolarHBondContact O-N 2.69Å; R42-Y57 VanDerWaalsContact CG-CB 3.47Å; R42-Y57 HydrophobicContact CG-CD1 4.21Å; R42-Y57 HydrophobicContact CG-CG 4.18Å; R42-N66 VanDerWaalsContact CB-OD1 3.3Å; R42-N66 WeakPolarHBondContact CB-OD1 3.27Å; R42-N66 WeakPolarHBondContact CD-OD1 3.41Å; R42-N66 WeakPolarHBondContact CG-OD1 3.35Å; R42-N66 PolarHBondContact NH1-OD1 2.74Å; R42-F67 CarbonylContact C-O 3.43Å; R42-F67 WeakPolarHBondContact CA-O 2.99Å
43	W	91.7	Very high	88.2	Confident	59 Å²	59	84.2 Å²	84.2	22%	0.223	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	144.9	-179.7	-66.1	80.2	0	0	0	110.1	C52 E53 R54 N66 F67 K70 C73	W43-C52 HydrophobicContact CE3-CB 4.37Å; W43-C52 WeakPolarHBondContact CZ3-O 3.09Å; W43-E53 CarbonylContact C-O 3.56Å; W43-E53 VanDerWaalsContact CA-O 3.24Å; W43-E53 WeakPolarHBondContact CA-O 3.36Å; W43-E53 VanDerWaalsContact CE3-C 3.43Å; W43-R54 HydrophobicContact CD2-CB 4.16Å; W43-R54 HydrophobicContact CE3-CB 4.27Å; W43-R54 HydrophobicContact CH2-CB 4.24Å; W43-R54 HydrophobicContact CZ2-CB 4.13Å; W43-R54 HydrophobicContact CZ3-CB 4.3Å; W43-N66 CarbonylContact O-C 3.52Å; W43-F67 HydrophobicContact CB-CB 4.22Å; W43-F67 PolarHBondContact N-O 3.28Å; W43-F67 WeakPolarHBondContact O-CD2 3.34Å; W43-F67 PolarHBondContact O-N 2.94Å; W43-K70 VanDerWaalsContact CD1-N 3.28Å; W43-K70 VanDerWaalsContact CD2-CA 3.49Å; W43-K70 HydrophobicContact CD2-CB 3.56Å; W43-K70 HydrophobicContact CD2-CG 4.11Å; W43-K70 HydrophobicContact CE3-CB 3.6Å; W43-K70 HydrophobicContact CE3-CD 4.16Å; W43-K70 HydrophobicContact CE3-CG 3.6Å; W43-K70 HydrophobicContact CG-CB 4.24Å; W43-K70 HydrophobicContact CH2-CB 3.8Å; W43-K70 HydrophobicContact CH2-CD 3.69Å; W43-K70 HydrophobicContact CH2-CG 3.94Å; W43-K70 HydrophobicContact CZ2-CB 3.74Å; W43-K70 HydrophobicContact CZ2-CD 4.45Å; W43-K70 HydrophobicContact CZ2-CG 4.41Å; W43-K70 HydrophobicContact CZ3-CB 3.73Å; W43-K70 HydrophobicContact CZ3-CD 3.52Å; W43-K70 HydrophobicContact CZ3-CG 3.52Å; W43-C73 HydrophobicContact CB-CB 4.12Å
44	Y	95.4	Very high	88.3	Confident	12 Å²	12	87 Å²	87	5%	0.047	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	152.5	174.6	80	-76.5	0	0	0	109.2	K31 D46 C52 E53 F55 N65	K31-Y44 HydrophobicContact CB-CD1 3.75Å; K31-Y44 HydrophobicContact CB-CD2 3.66Å; K31-Y44 HydrophobicContact CB-CE1 3.96Å; K31-Y44 HydrophobicContact CB-CE2 3.88Å; K31-Y44 HydrophobicContact CB-CG 3.6Å; K31-Y44 HydrophobicContact CD-CD1 4.17Å; K31-Y44 HydrophobicContact CD-CE1 3.57Å; K31-Y44 HydrophobicContact CD-CE2 4.24Å; K31-Y44 HydrophobicContact CG-CD2 4.48Å; K31-Y44 HydrophobicContact CG-CE1 4.27Å; K31-Y44 HydrophobicContact CG-CE2 4.21Å; K31-Y44 PolarHBondContact NZ-OH 2.84Å; Y44-D46 HydrophobicContact CE2-CB 3.78Å; Y44-D46 PolarHBondContact OH-OD2 2.79Å; Y44-C52 CarbonylContact O-C 3.36Å; Y44-C52 VanDerWaalsContact O-CA 3.28Å; Y44-C52 WeakPolarHBondContact O-CA 3.26Å; Y44-E53 HydrophobicContact CD1-CB 4.29Å; Y44-E53 VanDerWaalsContact CD1-O 3.24Å; Y44-E53 WeakPolarHBondContact CD1-O 3.01Å; Y44-E53 HydrophobicContact CE1-CB 3.68Å; Y44-E53 PolarHBondContact N-O 2.58Å; Y44-E53 PolarHBondContact O-N 3.26Å; Y44-F55 HydrophobicContact CD1-CB 4.06Å; Y44-F55 AromaticContact CD1-CD1 3.76Å; Y44-F55 HydrophobicContact CD1-CD1 3.76Å; Y44-F55 HydrophobicContact CD1-CG 4.15Å; Y44-F55 HydrophobicContact CE1-CB 4.3Å; Y44-F55 HydrophobicContact CG-CD1 4.31Å; Y44-N65 VanDerWaalsContact CA-OD1 3.29Å; Y44-N65 WeakPolarHBondContact CA-OD1 2.82Å; Y44-N65 WeakPolarHBondContact CB-O 3.42Å
45	Y	94.3	Very high	88.6	Confident	16 Å²	16	87 Å²	87	6%	0.063	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	118.3	172.9	-170.7	-106.8	0	0	0	110.2	C27 Q47 R50 N65 C73 C77 I78	C27-Y45 HydrophobicContact CB-CD1 3.93Å; C27-Y45 HydrophobicContact CB-CG 4.26Å; Y45-Q47 HydrophobicContact CD1-CG 4.04Å; Y45-Q47 VanDerWaalsContact CE1-CD 3.43Å; Y45-Q47 HydrophobicContact CE1-CG 4.15Å; Y45-Q47 VanDerWaalsContact CE1-NE2 3.32Å; Y45-R50 WeakPolarHBondContact OH-CA 3.3Å; Y45-R50 WeakPolarHBondContact OH-CB 3.3Å; Y45-N65 PolarHBondContact N-ND2 3.31Å; Y45-N65 PolarHBondContact N-OD1 2.74Å; Y45-N65 PolarHBondContact O-ND2 3.28Å; Y45-C73 PolarHBondContact N-SG 3.47Å; Y45-C73 VanDerWaalsContact N-SG 3.37Å; Y45-C77 VanDerWaalsContact CB-SG 3.57Å; Y45-C77 HydrophobicContact CD1-CB 4.07Å; Y45-C77 HydrophobicContact CD2-CB 3.39Å; Y45-C77 HydrophobicContact CE2-CB 3.97Å; Y45-C77 HydrophobicContact CG-CB 3.44Å; Y45-C77 VanDerWaalsContact CG-CB 3.44Å; Y45-I78 HydrophobicContact CD2-CG1 4.39Å; Y45-I78 HydrophobicContact CE2-CD1 4.43Å; Y45-I78 HydrophobicContact CE2-CG1 3.76Å
46	D	93.5	Very high	89	Confident	15 Å²	15	79.5 Å²	79.5	8%	0.08	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	98.7	175.6	-171.5	-47.2	0	0	0	108.1	Y44 P48 K49 R50 K51 E53	Y44-D46 HydrophobicContact CE2-CB 3.78Å; Y44-D46 PolarHBondContact OH-OD2 2.79Å; D46-P48 VanDerWaalsContact OD1-CD 3.28Å; D46-P48 WeakPolarHBondContact OD1-CD 3.35Å; D46-K49 HydrophobicContact CB-CB 4.18Å; D46-K49 CarbonylContact O-C 3.59Å; D46-K49 PolarHBondContact O-N 3.32Å; D46-K49 VanDerWaalsContact O-N 3.13Å; D46-K49 WeakPolarHBondContact OD1-CG 3.31Å; D46-K49 PolarHBondContact OD1-N 3.41Å; D46-K49 VanDerWaalsContact OD1-N 3.17Å; D46-K49 WeakPolarHBondContact OD2-CE 3.26Å; D46-K49 IonicContact OD2-NZ 3.42Å; D46-K49 PolarHBondContact OD2-NZ 3.41Å; D46-R50 WeakPolarHBondContact O-CA 3.5Å; D46-R50 PolarHBondContact O-N 3.4Å; D46-K51 WeakPolarHBondContact CB-O 3.4Å; D46-K51 PolarHBondContact N-O 3.26Å; D46-K51 PolarHBondContact O-N 3.07Å; D46-E53 HydrophobicContact CB-CG 4.36Å
47	Q	86.2	Confident	89	Confident	73 Å²	73	78 Å²	78	34%	0.341	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52	-52.5	-178.4	-80.2	-67.5	-11	0	0	113.2	C27 D28 Y45 K49 R50	C27-Q47 PolarHBondContact O-NE2 3.24Å; D28-Q47 PolarHBondContact OD1-NE2 3.15Å; Y45-Q47 HydrophobicContact CD1-CG 4.04Å; Y45-Q47 VanDerWaalsContact CE1-CD 3.43Å; Y45-Q47 HydrophobicContact CE1-CG 4.15Å; Y45-Q47 VanDerWaalsContact CE1-NE2 3.32Å; Q47-K49 PolarHBondContact O-N 2.84Å; Q47-R50 VanDerWaalsContact O-CG 3.3Å; Q47-R50 WeakPolarHBondContact O-CG 3.5Å; Q47-R50 PolarHBondContact O-N 3.44Å
48	P	84.3	Confident	89	Confident	122 Å²	122	69.5 Å²	69.5	79%	0.792	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-37.5	176.2	-27	32.7	0	0	0	114.2	D46	D46-P48 VanDerWaalsContact OD1-CD 3.28Å; D46-P48 WeakPolarHBondContact OD1-CD 3.35Å
49	K	89.3	Confident	89.3	Confident	100 Å²	100	70 Å²	70	44%	0.435	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-3.6	180	-60.2	-179.8	-164.5	135.8	0	113.6	D46 Q47 K51 E53	D46-K49 HydrophobicContact CB-CB 4.18Å; D46-K49 CarbonylContact O-C 3.59Å; D46-K49 PolarHBondContact O-N 3.32Å; D46-K49 VanDerWaalsContact O-N 3.13Å; D46-K49 WeakPolarHBondContact OD1-CG 3.31Å; D46-K49 PolarHBondContact OD1-N 3.41Å; D46-K49 VanDerWaalsContact OD1-N 3.17Å; D46-K49 WeakPolarHBondContact OD2-CE 3.26Å; D46-K49 IonicContact OD2-NZ 3.42Å; D46-K49 PolarHBondContact OD2-NZ 3.41Å; Q47-K49 PolarHBondContact O-N 2.84Å; K49-K51 HydrophobicContact CB-CD 3.97Å; K49-K51 HydrophobicContact CB-CG 3.81Å; K49-K51 VanDerWaalsContact CD-CE 3.47Å; K49-K51 PolarHBondContact O-N 2.71Å; K49-K51 VanDerWaalsContact O-N 3.16Å; K49-E53 WeakPolarHBondContact CD-OE1 3.47Å; K49-E53 WeakPolarHBondContact CE-OE1 3.41Å; K49-E53 IonicContact NZ-OE1 2.74Å; K49-E53 PolarHBondContact NZ-OE1 3.23Å; K49-E53 IonicContact NZ-OE2 3.67Å; K49-E53 PolarHBondContact NZ-OE2 3.13Å
50	R	88.5	Confident	89.3	Confident	176 Å²	176	61.6 Å²	61.6	66%	0.664	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	44.4	41.7	-173.9	-57.7	-174.5	80.7	161.8	1.3	113.6	Y45 D46 Q47	Y45-R50 WeakPolarHBondContact OH-CA 3.3Å; Y45-R50 WeakPolarHBondContact OH-CB 3.3Å; D46-R50 WeakPolarHBondContact O-CA 3.5Å; D46-R50 PolarHBondContact O-N 3.4Å; Q47-R50 VanDerWaalsContact O-CG 3.3Å; Q47-R50 WeakPolarHBondContact O-CG 3.5Å; Q47-R50 PolarHBondContact O-N 3.44Å
51	K	91.1	Very high	89.5	Confident	97 Å²	97	62.4 Å²	62.4	42%	0.422	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	156.7	-175.1	75.4	-170.9	-174.1	-173.1	0	112.8	D46 K49 E53	D46-K51 WeakPolarHBondContact CB-O 3.4Å; D46-K51 PolarHBondContact N-O 3.26Å; D46-K51 PolarHBondContact O-N 3.07Å; K49-K51 HydrophobicContact CB-CD 3.97Å; K49-K51 HydrophobicContact CB-CG 3.81Å; K49-K51 VanDerWaalsContact CD-CE 3.47Å; K49-K51 PolarHBondContact O-N 2.71Å; K49-K51 VanDerWaalsContact O-N 3.16Å; K51-E53 WeakPolarHBondContact CE-OE1 3.46Å; K51-E53 HydrophobicContact CG-CG 4.16Å; K51-E53 IonicContact NZ-OE1 2.7Å; K51-E53 PolarHBondContact NZ-OE1 3.39Å
52	C	92.4	Very high	89.3	Confident	7 Å²	7	59 Å²	59	5%	0.047	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	123.1	174.1	-67.8	0	0	0	0	112.3	W43 Y44 K70 C73 E74	W43-C52 HydrophobicContact CE3-CB 4.37Å; W43-C52 WeakPolarHBondContact CZ3-O 3.09Å; Y44-C52 CarbonylContact O-C 3.36Å; Y44-C52 VanDerWaalsContact O-CA 3.28Å; Y44-C52 WeakPolarHBondContact O-CA 3.26Å; C52-K70 HydrophobicContact CB-CG 4.27Å; C52-C73 HydrophobicContact CB-CB 3.61Å; C52-C73 WeakPolarHBondContact CB-SG 3.45Å; C52-C73 WeakPolarHBondContact SG-CB 3.28Å; C52-C73 PolarHBondContact SG-O 2.75Å; C52-C73 CovalentContact SG-SG 2.02Å; C52-C73 PolarHBondContact SG-SG 3.43Å; C52-E74 HydrophobicContact CB-CG 3.96Å; C52-E74 PolarHBondContact SG-N 2.83Å
53	E	95.7	Very high	89.2	Confident	43 Å²	43	58 Å²	58	20%	0.201	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	147.8	177.6	-68.5	-162.5	164.3	0	0	111.8	W43 Y44 D46 K49 K51	W43-E53 CarbonylContact C-O 3.56Å; W43-E53 VanDerWaalsContact CA-O 3.24Å; W43-E53 WeakPolarHBondContact CA-O 3.36Å; W43-E53 VanDerWaalsContact CE3-C 3.43Å; Y44-E53 HydrophobicContact CD1-CB 4.29Å; Y44-E53 VanDerWaalsContact CD1-O 3.24Å; Y44-E53 WeakPolarHBondContact CD1-O 3.01Å; Y44-E53 HydrophobicContact CE1-CB 3.68Å; Y44-E53 PolarHBondContact N-O 2.58Å; Y44-E53 PolarHBondContact O-N 3.26Å; D46-E53 HydrophobicContact CB-CG 4.36Å; K49-E53 WeakPolarHBondContact CD-OE1 3.47Å; K49-E53 WeakPolarHBondContact CE-OE1 3.41Å; K49-E53 IonicContact NZ-OE1 2.74Å; K49-E53 PolarHBondContact NZ-OE1 3.23Å; K49-E53 IonicContact NZ-OE2 3.67Å; K49-E53 PolarHBondContact NZ-OE2 3.13Å; K51-E53 WeakPolarHBondContact CE-OE1 3.46Å; K51-E53 HydrophobicContact CG-CG 4.16Å; K51-E53 IonicContact NZ-OE1 2.7Å; K51-E53 PolarHBondContact NZ-OE1 3.39Å
54	R	94.4	Very high	89.1	Confident	190 Å²	190	57.9 Å²	57.9	72%	0.717	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.3	143.7	173.9	63.4	179.2	151	159.3	-5.3	111.2	T41 R42 W43	T41-R54 HydrophobicContact CG2-CB 4.43Å; R42-R54 CarbonylContact O-C 3.57Å; R42-R54 WeakPolarHBondContact O-CA 2.97Å; W43-R54 HydrophobicContact CD2-CB 4.16Å; W43-R54 HydrophobicContact CE3-CB 4.27Å; W43-R54 HydrophobicContact CH2-CB 4.24Å; W43-R54 HydrophobicContact CZ2-CB 4.13Å; W43-R54 HydrophobicContact CZ3-CB 4.3Å
55	F	93.8	Very high	89	Confident	20 Å²	20	57.3 Å²	57.3	9%	0.088	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	165.9	169.5	79.2	-72.7	0	0	0	110.9	K31 E32 R42 Y44 Y57 N66	K31-F55 HydrophobicContact CB-CD2 4.33Å; K31-F55 HydrophobicContact CB-CG 4.33Å; K31-F55 HydrophobicContact CD-CB 4.19Å; E32-F55 WeakPolarHBondContact O-CE2 2.99Å; R42-F55 HydrophobicContact CB-CD1 3.91Å; R42-F55 HydrophobicContact CB-CE1 3.41Å; R42-F55 VanDerWaalsContact CB-CE1 3.41Å; R42-F55 HydrophobicContact CB-CZ 3.8Å; R42-F55 PolarHBondContact N-O 3.49Å; R42-F55 PolarHBondContact O-N 2.69Å; Y44-F55 HydrophobicContact CD1-CB 4.06Å; Y44-F55 AromaticContact CD1-CD1 3.76Å; Y44-F55 HydrophobicContact CD1-CD1 3.76Å; Y44-F55 HydrophobicContact CD1-CG 4.15Å; Y44-F55 HydrophobicContact CE1-CB 4.3Å; Y44-F55 HydrophobicContact CG-CD1 4.31Å; F55-Y57 HydrophobicContact CE2-CD2 4.47Å; F55-N66 HydrophobicContact CE1-CB 4.42Å; F55-N66 HydrophobicContact CZ-CB 3.98Å
56	T	89.4	Confident	88.9	Confident	54 Å²	54	57.7 Å²	57.7	33%	0.331	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	115.9	175.1	-62.7	0	0	0	0	109.3	K33 R39 Y40	K33-T56 WeakPolarHBondContact CG-O 3.36Å; R39-T56 HydrophobicContact CB-CG2 4.39Å; R39-T56 HydrophobicContact CG-CG2 3.47Å; R39-T56 VanDerWaalsContact CG-CG2 3.47Å; Y40-T56 CarbonylContact O-C 3.57Å; Y40-T56 WeakPolarHBondContact O-CA 3.3Å
57	Y	88.1	Confident	88.5	Confident	23 Å²	23	58 Å²	58	9%	0.09	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	142.6	172.6	178	-124.8	0	0	0	110.7	K33 Y40 R42 F55 G59 C60 N66	K33-Y57 VanDerWaalsContact O-CD2 3.26Å; K33-Y57 WeakPolarHBondContact O-CD2 3.07Å; Y40-Y57 HydrophobicContact CD2-CD1 4.38Å; Y40-Y57 WeakPolarHBondContact CD2-O 3.37Å; Y40-Y57 PolarHBondContact N-O 3.46Å; Y40-Y57 PolarHBondContact O-N 3.07Å; R42-Y57 VanDerWaalsContact CG-CB 3.47Å; R42-Y57 HydrophobicContact CG-CD1 4.21Å; R42-Y57 HydrophobicContact CG-CG 4.18Å; F55-Y57 HydrophobicContact CE2-CD2 4.47Å; Y57-G59 WeakPolarHBondContact CE1-O 3.21Å; Y57-G59 VanDerWaalsContact OH-C 3.28Å; Y57-G59 PolarHBondContact OH-O 2.89Å; Y57-C60 VanDerWaalsContact CE2-O 3.25Å; Y57-C60 WeakPolarHBondContact CE2-O 3.18Å; Y57-C60 WeakPolarHBondContact OH-CA 3.32Å; Y57-C60 PolarHBondContact OH-N 3.34Å; Y57-C60 PolarHBondContact OH-O 2.87Å; Y57-N66 WeakPolarHBondContact CD2-ND2 3.3Å; Y57-N66 WeakPolarHBondContact CE2-ND2 3.47Å
58	S	83.2	Confident	88.3	Confident	1 Å²	1	56.8 Å²	56.8	1%	0.007	30%	0.299	C	S	.	.			trans	-83.2	-15.4	-176	69.4	0	0	0	0	114.6	K33 G34 R35 C36 G38 C60	K33-S58 WeakPolarHBondContact O-CA 2.99Å; K33-S58 WeakPolarHBondContact O-CB 3.37Å; K33-S58 PolarHBondContact O-N 2.97Å; K33-S58 PolarHBondContact O-OG 2.91Å; G34-S58 WeakPolarHBondContact CA-OG 3.48Å; G34-S58 PolarHBondContact O-OG 3.06Å; R35-S58 PolarHBondContact N-OG 3.28Å; C36-S58 WeakPolarHBondContact CB-O 3Å; C36-S58 PolarHBondContact N-OG 3.26Å; C36-S58 VanDerWaalsContact N-OG 3.09Å; C36-S58 VanDerWaalsContact O-CB 3.24Å; C36-S58 WeakPolarHBondContact O-CB 3.2Å; G38-S58 CarbonylContact C-O 3.52Å; G38-S58 WeakPolarHBondContact CA-O 3.31Å; G38-S58 PolarHBondContact N-O 2.79Å; G38-S58 VanDerWaalsContact O-CA 3.31Å; G38-S58 WeakPolarHBondContact O-CA 3.3Å; S58-C60 PolarHBondContact OG-O 2.81Å; S58-C60 VanDerWaalsContact OG-O 3.13Å
59	G	81.6	Confident	88	Confident	35 Å²	35	52.4 Å²	52.4	36%	0.361	27%	0.272	S	S	.	.	S	Bend	trans	110.2	-24.4	-179.5	0	0	0	0	0	114.7	Y40 Y57	Y40-G59 VanDerWaalsContact CE2-CA 3.44Å; Y57-G59 WeakPolarHBondContact CE1-O 3.21Å; Y57-G59 VanDerWaalsContact OH-C 3.28Å; Y57-G59 PolarHBondContact OH-O 2.89Å
60	C	82.5	Confident	87.9	Confident	38 Å²	38	52 Å²	52	26%	0.257	27%	0.27	S	S	.	.	S	Bend	trans	-139.5	174.2	174.6	70.3	0	0	0	0	111.1	G34 C36 Y57 S58 G62	G34-C60 WeakPolarHBondContact CA-O 3.13Å; C36-C60 HydrophobicContact CB-CB 4.06Å; C36-C60 WeakPolarHBondContact CB-SG 3.15Å; C36-C60 PolarHBondContact N-SG 3.47Å; C36-C60 WeakPolarHBondContact SG-CB 3.36Å; C36-C60 CovalentContact SG-SG 2.02Å; C36-C60 PolarHBondContact SG-SG 2.84Å; Y57-C60 VanDerWaalsContact CE2-O 3.25Å; Y57-C60 WeakPolarHBondContact CE2-O 3.18Å; Y57-C60 WeakPolarHBondContact OH-CA 3.32Å; Y57-C60 PolarHBondContact OH-N 3.34Å; Y57-C60 PolarHBondContact OH-O 2.87Å; S58-C60 PolarHBondContact OG-O 2.81Å; S58-C60 VanDerWaalsContact OG-O 3.13Å; C60-G62 VanDerWaalsContact C-N 3.27Å; C60-G62 PolarHBondContact O-N 3.42Å
61	D	84.5	Confident	87.2	Confident	74 Å²	74	45.6 Å²	45.6	40%	0.396	25%	0.249	S	C	.	.	S	Bend	trans	53.9	37	174.1	-63.7	-3.5	0	0	0	114.3	E32 G34 R35	E32-D61 WeakPolarHBondContact CG-O 3.31Å; G34-D61 WeakPolarHBondContact CA-O 3.49Å; R35-D61 IonicContact CZ-OD2 3.05Å; R35-D61 IonicContact NE-OD2 3.56Å; R35-D61 PolarHBondContact NE-OD2 3.41Å; R35-D61 IonicContact NH2-OD2 3.84Å; R35-D61 PolarHBondContact NH2-OD2 2.89Å; R35-D61 VanDerWaalsContact NH2-OD2 3.12Å
62	G	82.5	Confident	86.4	Confident	29 Å²	29	43.6 Å²	43.6	30%	0.299	24%	0.239	S	C	.	.			trans	-103	154.8	170.3	0	0	0	0	0	110.9	C60	C60-G62 VanDerWaalsContact C-N 3.27Å; C60-G62 PolarHBondContact O-N 3.42Å
63	N	90.2	Very high	86	Confident	33 Å²	33	43.2 Å²	43.2	18%	0.176	24%	0.236	C	C	.	.			trans	-86	-178.4	170.2	66.9	55.5	0	0	0	112.8	L29 P30 E32 N65 N66	L29-N63 HydrophobicContact CD1-CB 4.06Å; P30-N63 PolarHBondContact O-ND2 2.76Å; P30-N63 PolarHBondContact O-OD1 3.25Å; E32-N63 VanDerWaalsContact CB-ND2 3.29Å; E32-N63 WeakPolarHBondContact CB-ND2 3.34Å; E32-N63 WeakPolarHBondContact OE2-CB 3.38Å; E32-N63 PolarHBondContact OE2-N 3.36Å; E32-N63 PolarHBondContact OE2-ND2 3.43Å; N63-N65 VanDerWaalsContact C-N 3.29Å; N63-N65 PolarHBondContact O-N 2.83Å; N63-N65 WeakPolarHBondContact OD1-CB 3.49Å; N63-N65 PolarHBondContact OD1-N 3.32Å; N63-N66 WeakPolarHBondContact O-CB 3.41Å
64	A	89.9	Confident	85.4	Confident	58 Å²	58	44 Å²	44	48%	0.479	24%	0.24	S	C	.	.	S	Bend	trans	-68.1	-22.2	-173.6	0	0	0	0	0	114	L26 L29 N66	L26-A64 HydrophobicContact CB-CB 4.16Å; L26-A64 HydrophobicContact CD1-CB 3.77Å; L26-A64 WeakPolarHBondContact CD1-O 2.91Å; L29-A64 HydrophobicContact CD1-CB 3.91Å; A64-N66 PolarHBondContact O-N 3.36Å
65	N	94.4	Very high	84.4	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	23%	0.232	C	C	.	.			trans	-75.1	57.2	175.7	-161.2	3.6	0	0	0	111.3	L26 L29 Y44 Y45 N63 F67	L26-N65 VanDerWaalsContact O-CB 3.32Å; L26-N65 WeakPolarHBondContact O-CB 3.39Å; L29-N65 HydrophobicContact CB-CB 3.96Å; L29-N65 PolarHBondContact O-ND2 2.79Å; Y44-N65 VanDerWaalsContact CA-OD1 3.29Å; Y44-N65 WeakPolarHBondContact CA-OD1 2.82Å; Y44-N65 WeakPolarHBondContact CB-O 3.42Å; Y45-N65 PolarHBondContact N-ND2 3.31Å; Y45-N65 PolarHBondContact N-OD1 2.74Å; Y45-N65 PolarHBondContact O-ND2 3.28Å; N63-N65 VanDerWaalsContact C-N 3.29Å; N63-N65 PolarHBondContact O-N 2.83Å; N63-N65 WeakPolarHBondContact OD1-CB 3.49Å; N63-N65 PolarHBondContact OD1-N 3.32Å; N65-F67 WeakPolarHBondContact OD1-CE2 3.18Å
66	N	91.1	Very high	83.7	Confident	24 Å²	24	41.3 Å²	41.3	13%	0.128	25%	0.247	C	C	.	.			trans	-148.4	86	-169.4	-176.7	-16.5	0	0	0	108.9	R42 W43 F55 Y57 N63 A64	R42-N66 VanDerWaalsContact CB-OD1 3.3Å; R42-N66 WeakPolarHBondContact CB-OD1 3.27Å; R42-N66 WeakPolarHBondContact CD-OD1 3.41Å; R42-N66 WeakPolarHBondContact CG-OD1 3.35Å; R42-N66 PolarHBondContact NH1-OD1 2.74Å; W43-N66 CarbonylContact O-C 3.52Å; F55-N66 HydrophobicContact CE1-CB 4.42Å; F55-N66 HydrophobicContact CZ-CB 3.98Å; Y57-N66 WeakPolarHBondContact CD2-ND2 3.3Å; Y57-N66 WeakPolarHBondContact CE2-ND2 3.47Å; N63-N66 WeakPolarHBondContact O-CB 3.41Å; A64-N66 PolarHBondContact O-N 3.36Å
67	F	86.3	Confident	83.5	Confident	21 Å²	21	39.3 Å²	39.3	9%	0.092	24%	0.236	C	C	.	.	B	Isolated β-bridge	trans	-97.6	144.6	-177.3	-57.2	-85.5	0	0	0	111.2	L26 R42 W43 N65 S69 R72 C73 A76 C77	L26-F67 HydrophobicContact CD1-CE1 4.18Å; L26-F67 HydrophobicContact CD1-CE2 4.1Å; L26-F67 HydrophobicContact CD1-CZ 3.54Å; L26-F67 HydrophobicContact CD2-CE1 4.35Å; L26-F67 HydrophobicContact CD2-CZ 4.09Å; L26-F67 HydrophobicContact CG-CZ 4.1Å; R42-F67 CarbonylContact C-O 3.43Å; R42-F67 WeakPolarHBondContact CA-O 2.99Å; W43-F67 HydrophobicContact CB-CB 4.22Å; W43-F67 PolarHBondContact N-O 3.28Å; W43-F67 WeakPolarHBondContact O-CD2 3.34Å; W43-F67 PolarHBondContact O-N 2.94Å; N65-F67 WeakPolarHBondContact OD1-CE2 3.18Å; F67-S69 VanDerWaalsContact C-N 3.32Å; F67-S69 PolarHBondContact O-N 3.42Å; F67-R72 HydrophobicContact CB-CB 4.4Å; F67-R72 HydrophobicContact CD1-CB 4.28Å; F67-C73 HydrophobicContact CB-CB 3.77Å; F67-C73 HydrophobicContact CD1-CB 4.36Å; F67-C73 HydrophobicContact CD2-CB 3.31Å; F67-C73 HydrophobicContact CE2-CB 3.87Å; F67-C73 VanDerWaalsContact CG-CA 3.47Å; F67-C73 HydrophobicContact CG-CB 3.56Å; F67-A76 HydrophobicContact CD1-CB 4.41Å; F67-A76 HydrophobicContact CE1-CB 3.37Å; F67-A76 HydrophobicContact CZ-CB 3.55Å; F67-C77 VanDerWaalsContact CZ-SG 3.58Å
68	P	80.6	Confident	83.2	Confident	47 Å²	47	40.7 Å²	40.7	31%	0.305	24%	0.244	S	C	.	.	S	Bend	trans	-77	-18.6	-179.6	30.4	-34.9	0	0	0	113.2	H95	P68-H95 WeakPolarHBondContact CB-CE1 3.1Å; P68-H95 WeakPolarHBondContact CB-NE2 3.37Å; P68-H95 WeakPolarHBondContact CG-NE2 3.39Å
69	S	79.3	Confident	82.3	Confident	31 Å²	31	48.6 Å²	48.6	22%	0.217	28%	0.281	C	S	.	.	S	Bend	trans	-142.4	157.5	176.6	75.6	0	0	0	0	111.2	F67 L71 R72 C73	F67-S69 VanDerWaalsContact C-N 3.32Å; F67-S69 PolarHBondContact O-N 3.42Å; S69-L71 VanDerWaalsContact C-N 3.31Å; S69-L71 PolarHBondContact O-N 2.92Å; S69-R72 PolarHBondContact O-N 2.87Å; S69-R72 PolarHBondContact OG-N 2.98Å; S69-C73 PolarHBondContact O-N 3.33Å
70	K	86.1	Confident	81.2	Confident	92 Å²	92	54 Å²	54	40%	0.4	30%	0.302	S	S	.	.	H	α-helix	trans	-56.6	-47.1	176.2	-173	177.9	167	-175.9	0	111.3	W43 C52 R72 C73 E74	W43-K70 VanDerWaalsContact CD1-N 3.28Å; W43-K70 VanDerWaalsContact CD2-CA 3.49Å; W43-K70 HydrophobicContact CD2-CB 3.56Å; W43-K70 HydrophobicContact CD2-CG 4.11Å; W43-K70 HydrophobicContact CE3-CB 3.6Å; W43-K70 HydrophobicContact CE3-CD 4.16Å; W43-K70 HydrophobicContact CE3-CG 3.6Å; W43-K70 HydrophobicContact CG-CB 4.24Å; W43-K70 HydrophobicContact CH2-CB 3.8Å; W43-K70 HydrophobicContact CH2-CD 3.69Å; W43-K70 HydrophobicContact CH2-CG 3.94Å; W43-K70 HydrophobicContact CZ2-CB 3.74Å; W43-K70 HydrophobicContact CZ2-CD 4.45Å; W43-K70 HydrophobicContact CZ2-CG 4.41Å; W43-K70 HydrophobicContact CZ3-CB 3.73Å; W43-K70 HydrophobicContact CZ3-CD 3.52Å; W43-K70 HydrophobicContact CZ3-CG 3.52Å; C52-K70 HydrophobicContact CB-CG 4.27Å; K70-R72 VanDerWaalsContact C-N 3.31Å; K70-R72 PolarHBondContact O-N 2.81Å; K70-C73 WeakPolarHBondContact O-CB 3.36Å; K70-C73 PolarHBondContact O-N 3.17Å; K70-C73 VanDerWaalsContact O-N 3.14Å; K70-E74 VanDerWaalsContact CE-CD 3.43Å; K70-E74 WeakPolarHBondContact CE-OE1 3.5Å; K70-E74 HydrophobicContact CG-CG 4.31Å; K70-E74 IonicContact NZ-OE1 3.92Å; K70-E74 PolarHBondContact NZ-OE1 3.25Å; K70-E74 WeakPolarHBondContact O-CG 3.35Å; K70-E74 PolarHBondContact O-N 3.25Å
71	L	73.7	Confident	79.7	Confident	41 Å²	41	57.9 Å²	57.9	22%	0.215	32%	0.316	C	S	.	.	H	α-helix	trans	-57.2	-42.3	-178.7	179.8	66.7	0	0	0	112.3	S69 C73 E74 N75 P90	S69-L71 VanDerWaalsContact C-N 3.31Å; S69-L71 PolarHBondContact O-N 2.92Å; L71-C73 VanDerWaalsContact C-N 3.35Å; L71-E74 PolarHBondContact O-N 3.41Å; L71-N75 WeakPolarHBondContact O-CB 3.41Å; L71-N75 PolarHBondContact O-N 3.02Å; L71-P90 HydrophobicContact CD1-CG 4.35Å; L71-P90 HydrophobicContact CD2-CG 3.45Å; L71-P90 VanDerWaalsContact CD2-CG 3.45Å
72	R	74.3	Confident	78.2	Confident	54 Å²	54	59.5 Å²	59.5	20%	0.204	33%	0.331	C	S	.	.	H	α-helix	trans	-67.9	-36.3	178.7	-72.5	-162.9	-169.4	164.4	10.8	112.9	F67 S69 K70 A76 D92 H95 G153	F67-R72 HydrophobicContact CB-CB 4.4Å; F67-R72 HydrophobicContact CD1-CB 4.28Å; S69-R72 PolarHBondContact O-N 2.87Å; S69-R72 PolarHBondContact OG-N 2.98Å; K70-R72 VanDerWaalsContact C-N 3.31Å; K70-R72 PolarHBondContact O-N 2.81Å; R72-A76 VanDerWaalsContact O-CB 3.22Å; R72-A76 WeakPolarHBondContact O-CB 3.14Å; R72-A76 PolarHBondContact O-N 3.4Å; R72-A76 VanDerWaalsContact O-N 3.12Å; R72-D92 IonicContact NE-OD2 2.64Å; R72-D92 IonicContact NH2-OD2 2.72Å; R72-H95 PolarHBondContact NH1-CD2 2.87Å; R72-H95 PolarHBondContact NH1-NE2 3.01Å; R72-G153 VanDerWaalsContact NH2-N 3.12Å
73	C	84.9	Confident	77.2	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-63.4	-45.5	171.8	175.4	0	0	0	0	111	W43 Y45 C52 F67 S69 K70 L71 A76 C77	W43-C73 HydrophobicContact CB-CB 4.12Å; Y45-C73 PolarHBondContact N-SG 3.47Å; Y45-C73 VanDerWaalsContact N-SG 3.37Å; C52-C73 HydrophobicContact CB-CB 3.61Å; C52-C73 WeakPolarHBondContact CB-SG 3.45Å; C52-C73 WeakPolarHBondContact SG-CB 3.28Å; C52-C73 PolarHBondContact SG-O 2.75Å; C52-C73 CovalentContact SG-SG 2.02Å; C52-C73 PolarHBondContact SG-SG 3.43Å; F67-C73 HydrophobicContact CB-CB 3.77Å; F67-C73 HydrophobicContact CD1-CB 4.36Å; F67-C73 HydrophobicContact CD2-CB 3.31Å; F67-C73 HydrophobicContact CE2-CB 3.87Å; F67-C73 VanDerWaalsContact CG-CA 3.47Å; F67-C73 HydrophobicContact CG-CB 3.56Å; S69-C73 PolarHBondContact O-N 3.33Å; K70-C73 WeakPolarHBondContact O-CB 3.36Å; K70-C73 PolarHBondContact O-N 3.17Å; K70-C73 VanDerWaalsContact O-N 3.14Å; L71-C73 VanDerWaalsContact C-N 3.35Å; C73-A76 PolarHBondContact O-N 2.8Å; C73-C77 VanDerWaalsContact O-CB 3.28Å; C73-C77 WeakPolarHBondContact O-CB 3.03Å; C73-C77 PolarHBondContact O-N 2.03Å
74	E	83.7	Confident	76.3	Confident	59 Å²	59	67.6 Å²	67.6	28%	0.276	37%	0.367	S	S	.	.	H	α-helix	trans	-64.4	-47.7	-178.2	-68.9	-179.8	145.5	0	0	111.2	C52 K70 L71 A76 C77 I78	C52-E74 HydrophobicContact CB-CG 3.96Å; C52-E74 PolarHBondContact SG-N 2.83Å; K70-E74 VanDerWaalsContact CE-CD 3.43Å; K70-E74 WeakPolarHBondContact CE-OE1 3.5Å; K70-E74 HydrophobicContact CG-CG 4.31Å; K70-E74 IonicContact NZ-OE1 3.92Å; K70-E74 PolarHBondContact NZ-OE1 3.25Å; K70-E74 WeakPolarHBondContact O-CG 3.35Å; K70-E74 PolarHBondContact O-N 3.25Å; L71-E74 PolarHBondContact O-N 3.41Å; E74-A76 VanDerWaalsContact C-N 3.25Å; E74-A76 PolarHBondContact O-N 3.36Å; E74-C77 PolarHBondContact O-N 2.03Å; E74-I78 HydrophobicContact CB-CD1 3.9Å; E74-I78 HydrophobicContact CB-CG1 4.48Å; E74-I78 HydrophobicContact CG-CD1 3.71Å; E74-I78 VanDerWaalsContact O-CB 3.3Å; E74-I78 WeakPolarHBondContact O-CB 3.14Å; E74-I78 PolarHBondContact O-N 3.17Å
75	N	73.3	Confident	75.9	Confident	104 Å²	104	66.4 Å²	66.4	56%	0.556	35%	0.352	S	S	*	.	H	α-helix	trans	-62.2	-31.7	177.1	-71.5	-0.6	0	0	0	113.2	L71	L71-N75 WeakPolarHBondContact O-CB 3.41Å; L71-N75 PolarHBondContact O-N 3.02Å
76	A	78.8	Confident	75.5	Confident	49 Å²	49	67 Å²	67	41%	0.405	36%	0.355	S	S	.	.	H	α-helix	trans	-81.3	-27.8	179.8	0	0	0	0	0	113.3	L26 C27 F67 R72 C73 E74	L26-A76 HydrophobicContact CD2-CB 4.44Å; C27-A76 PolarHBondContact SG-O 3.03Å; F67-A76 HydrophobicContact CD1-CB 4.41Å; F67-A76 HydrophobicContact CE1-CB 3.37Å; F67-A76 HydrophobicContact CZ-CB 3.55Å; R72-A76 VanDerWaalsContact O-CB 3.22Å; R72-A76 WeakPolarHBondContact O-CB 3.14Å; R72-A76 PolarHBondContact O-N 3.4Å; R72-A76 VanDerWaalsContact O-N 3.12Å; C73-A76 PolarHBondContact O-N 2.8Å; E74-A76 VanDerWaalsContact C-N 3.25Å; E74-A76 PolarHBondContact O-N 3.36Å
77	C	84.8	Confident	75.5	Confident	13 Å²	13	65.9 Å²	65.9	9%	0.088	35%	0.35	C	S	.	.	H	α-helix	trans	-124.4	-8.9	-165.6	-60.9	0	0	0	0	115.8	C27 Y45 F67 C73 E74	C27-C77 HydrophobicContact CB-CB 3.6Å; C27-C77 WeakPolarHBondContact CB-SG 3.5Å; C27-C77 WeakPolarHBondContact SG-CA 3.21Å; C27-C77 WeakPolarHBondContact SG-CB 3.08Å; C27-C77 CovalentContact SG-SG 2.02Å; C27-C77 PolarHBondContact SG-SG 3.27Å; Y45-C77 VanDerWaalsContact CB-SG 3.57Å; Y45-C77 HydrophobicContact CD1-CB 4.07Å; Y45-C77 HydrophobicContact CD2-CB 3.39Å; Y45-C77 HydrophobicContact CE2-CB 3.97Å; Y45-C77 HydrophobicContact CG-CB 3.44Å; Y45-C77 VanDerWaalsContact CG-CB 3.44Å; F67-C77 VanDerWaalsContact CZ-SG 3.58Å; C73-C77 VanDerWaalsContact O-CB 3.28Å; C73-C77 WeakPolarHBondContact O-CB 3.03Å; C73-C77 PolarHBondContact O-N 2.03Å; E74-C77 PolarHBondContact O-N 2.03Å
78	I	82	Confident	75.7	Confident	51 Å²	51	67.5 Å²	67.5	26%	0.262	36%	0.359	S	S	.	.			trans	-111.3	95.2	179.6	-56.5	-179.6	0	0	0	108.1	Y45 E74	Y45-I78 HydrophobicContact CD2-CG1 4.39Å; Y45-I78 HydrophobicContact CE2-CD1 4.43Å; Y45-I78 HydrophobicContact CE2-CG1 3.76Å; E74-I78 HydrophobicContact CB-CD1 3.9Å; E74-I78 HydrophobicContact CB-CG1 4.48Å; E74-I78 HydrophobicContact CG-CD1 3.71Å; E74-I78 VanDerWaalsContact O-CB 3.3Å; E74-I78 WeakPolarHBondContact O-CB 3.14Å; E74-I78 PolarHBondContact O-N 3.17Å
79	E	63.8	Low	76.1	Confident	168 Å²	168	66.6 Å²	66.6	79%	0.785	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-26.3	-174.5	-68.3	-179.9	169.3	0	0	114.1	Q81	E79-Q81 VanDerWaalsContact C-N 3.26Å; E79-Q81 PolarHBondContact O-N 3.05Å; E79-Q81 VanDerWaalsContact O-N 3.11Å
80	D	58.6	Low	76.5	Confident	149 Å²	149	68 Å²	68	80%	0.797	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	14	-167.4	-82.5	-23.8	0	0	0	115.6
81	Q	50.5	Low	76.7	Confident	119 Å²	119	69.2 Å²	69.2	56%	0.556	37%	0.365	S	S	*	.	S	Bend	trans	-104.7	125	171.9	-66	-165.2	0.6	0	0	110.7	E79	E79-Q81 VanDerWaalsContact C-N 3.26Å; E79-Q81 PolarHBondContact O-N 3.05Å; E79-Q81 VanDerWaalsContact O-N 3.11Å
82	P	54.2	Low	77.3	Confident	108 Å²	108	68 Å²	68	70%	0.701	36%	0.359	S	S	*	.	P	Polyproline II helix	trans	-55.8	141.4	169.8	21.4	-29.2	0	0	0	109.2	K84	P82-K84 PolarHBondContact O-N 3Å
83	P	61	Low	77.6	Confident	114 Å²	114	68.6 Å²	68.6	74%	0.74	37%	0.37	S	S	*	.	P	Polyproline II helix	trans	-51.9	121	178	-23.7	30.9	0	0	0	109.6
84	K	70.9	Confident	77.3	Confident	117 Å²	117	69.3 Å²	69.3	51%	0.509	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-65.1	141.5	175.1	-70.5	-179.3	-179	174	0	108.7	P82 D88 L89	P82-K84 PolarHBondContact O-N 3Å; K84-D88 HydrophobicContact CB-CB 4.42Å; K84-L89 HydrophobicContact CB-CD2 3.91Å
85	H	82.5	Confident	76.5	Confident	34 Å²	34	69.5 Å²	69.5	16%	0.157	38%	0.378	C	S	.	.	P	Polyproline II helix	trans	-54.1	144.2	171.5	-173.6	-91.2	0	0	0	109.3	C87 D88 L89 R173 D213	H85-C87 PolarHBondContact CE1-SG 3.26Å; H85-C87 WeakPolarHBondContact ND1-CB 3.31Å; H85-C87 PolarHBondContact ND1-N 2.86Å; H85-C87 VanDerWaalsContact ND1-N 3.2Å; H85-C87 PolarHBondContact O-N 3.24Å; H85-C87 VanDerWaalsContact O-N 3.11Å; H85-D88 HydrophobicContact CB-CB 4.39Å; H85-D88 WeakPolarHBondContact CB-OD2 3.22Å; H85-D88 WeakPolarHBondContact O-CA 3.31Å; H85-D88 WeakPolarHBondContact O-CB 2.98Å; H85-D88 PolarHBondContact O-N 2.91Å; H85-L89 PolarHBondContact O-N 3.13Å; H85-R173 PolarHBondContact CD2-O 2.81Å; H85-R173 PolarHBondContact NE2-O 3.35Å; H85-D213 IonicContact NE2-OD2 3.6Å
86	V	85.3	Confident	75.8	Confident	12 Å²	12	65.9 Å²	65.9	7%	0.073	36%	0.36	C	S	.	.	G	3₁₀ helix	trans	-47.7	-46.7	-178.3	171.1	0	0	0	0	111.1	D88 L89 E155 N156 F158	V86-D88 VanDerWaalsContact C-N 3.25Å; V86-D88 PolarHBondContact O-N 2.81Å; V86-L89 WeakPolarHBondContact O-CB 3.49Å; V86-L89 WeakPolarHBondContact O-CG 3.17Å; V86-L89 PolarHBondContact O-N 2.91Å; V86-L89 VanDerWaalsContact O-N 3.12Å; V86-E155 HydrophobicContact CB-CB 4.4Å; V86-E155 VanDerWaalsContact CG1-C 3.47Å; V86-E155 HydrophobicContact CG1-CB 3.71Å; V86-E155 VanDerWaalsContact CG1-O 3.29Å; V86-E155 WeakPolarHBondContact CG1-O 3.42Å; V86-E155 HydrophobicContact CG2-CB 3.92Å; V86-E155 WeakPolarHBondContact CG2-OE2 3.23Å; V86-N156 VanDerWaalsContact O-CB 3.29Å; V86-N156 WeakPolarHBondContact O-CB 3.23Å; V86-F158 HydrophobicContact CG1-CZ 4.03Å
87	C	91.2	Very high	74.5	Confident	1 Å²	1	66.7 Å²	66.7	1%	0.007	36%	0.363	C	S	.	.	G	3₁₀ helix	trans	-70.3	-13.9	179.6	-49.5	0	0	0	0	114.9	H85 Y136 C168	H85-C87 PolarHBondContact CE1-SG 3.26Å; H85-C87 WeakPolarHBondContact ND1-CB 3.31Å; H85-C87 PolarHBondContact ND1-N 2.86Å; H85-C87 VanDerWaalsContact ND1-N 3.2Å; H85-C87 PolarHBondContact O-N 3.24Å; H85-C87 VanDerWaalsContact O-N 3.11Å; C87-Y136 HydrophobicContact CB-CD1 3.73Å; C87-Y136 HydrophobicContact CB-CE1 4.41Å; C87-Y136 HydrophobicContact CB-CG 4.18Å; C87-Y136 VanDerWaalsContact O-CD1 3.31Å; C87-Y136 WeakPolarHBondContact O-CD1 3.48Å; C87-C168 HydrophobicContact CB-CB 3.62Å; C87-C168 WeakPolarHBondContact CB-SG 3.11Å; C87-C168 WeakPolarHBondContact SG-CA 3.47Å; C87-C168 WeakPolarHBondContact SG-CB 3.32Å; C87-C168 CovalentContact SG-SG 2.03Å; C87-C168 PolarHBondContact SG-SG 3.49Å
88	D	90.1	Very high	72.7	Confident	55 Å²	55	69.5 Å²	69.5	29%	0.294	38%	0.381	S	S	.	.	G	3₁₀ helix	trans	-93.9	-5.2	173.9	-64.1	-37	0	0	0	112.5	K84 H85 V86 R173	K84-D88 HydrophobicContact CB-CB 4.42Å; H85-D88 HydrophobicContact CB-CB 4.39Å; H85-D88 WeakPolarHBondContact CB-OD2 3.22Å; H85-D88 WeakPolarHBondContact O-CA 3.31Å; H85-D88 WeakPolarHBondContact O-CB 2.98Å; H85-D88 PolarHBondContact O-N 2.91Å; V86-D88 VanDerWaalsContact C-N 3.25Å; V86-D88 PolarHBondContact O-N 2.81Å; D88-R173 VanDerWaalsContact CG-NH1 3.27Å; D88-R173 IonicContact OD1-CZ 2.95Å; D88-R173 IonicContact OD1-NH1 2.78Å; D88-R173 PolarHBondContact OD1-NH1 2.84Å; D88-R173 IonicContact OD1-NH2 2.85Å; D88-R173 IonicContact OD2-NH1 2.59Å; D88-R173 PolarHBondContact OD2-NH1 2.81Å
89	L	88.5	Confident	70.9	Confident	27 Å²	27	74.8 Å²	74.8	14%	0.141	40%	0.403	C	S	.	.	S	Bend	trans	-69	143.3	171.5	-57.9	171.3	0	0	0	109.6	K84 H85 V86 N154 E155 N156	K84-L89 HydrophobicContact CB-CD2 3.91Å; H85-L89 PolarHBondContact O-N 3.13Å; V86-L89 WeakPolarHBondContact O-CB 3.49Å; V86-L89 WeakPolarHBondContact O-CG 3.17Å; V86-L89 PolarHBondContact O-N 2.91Å; V86-L89 VanDerWaalsContact O-N 3.12Å; L89-N154 HydrophobicContact CD1-CB 4.1Å; L89-E155 HydrophobicContact CD1-CB 4.34Å; L89-N156 HydrophobicContact CB-CB 4.02Å; L89-N156 PolarHBondContact O-ND2 2.78Å
90	P	88.2	Confident	70	Confident	61 Å²	61	71.6 Å²	71.6	40%	0.396	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-67.8	160.3	174.4	31	-35.9	0	0	0	110.5	L71 D92 N154	L71-P90 HydrophobicContact CD1-CG 4.35Å; L71-P90 HydrophobicContact CD2-CG 3.45Å; L71-P90 VanDerWaalsContact CD2-CG 3.45Å; P90-D92 PolarHBondContact O-N 3.42Å; P90-N154 PolarHBondContact O-ND2 2.79Å; P90-N154 PolarHBondContact O-OD1 3.47Å
91	K	89.7	Confident	69.3	Low	117 Å²	117	71.9 Å²	71.9	51%	0.509	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-55.3	129.3	165.5	67	-175.3	-179.2	-177	0	110.3	F135	K91-F135 HydrophobicContact CB-CB 4.24Å; K91-F135 HydrophobicContact CB-CD1 3.74Å; K91-F135 HydrophobicContact CB-CD2 3.62Å; K91-F135 HydrophobicContact CB-CE1 3.97Å; K91-F135 HydrophobicContact CB-CE2 3.85Å; K91-F135 HydrophobicContact CB-CG 3.58Å; K91-F135 HydrophobicContact CB-CZ 4.04Å; K91-F135 HydrophobicContact CD-CD1 4.25Å; K91-F135 HydrophobicContact CD-CE1 3.68Å; K91-F135 HydrophobicContact CD-CE2 4.24Å; K91-F135 HydrophobicContact CD-CZ 3.69Å; K91-F135 HydrophobicContact CG-CE1 4.4Å; K91-F135 HydrophobicContact CG-CE2 4.33Å; K91-F135 HydrophobicContact CG-CZ 4.26Å
92	D	86.3	Confident	69.2	Low	17 Å²	17	70.5 Å²	70.5	9%	0.091	38%	0.375	C	S	.	.			trans	-119	102.1	170.1	-175.1	-0.3	0	0	0	109.2	R72 P90 G94 F146 G153 N154	R72-D92 IonicContact NE-OD2 2.64Å; R72-D92 IonicContact NH2-OD2 2.72Å; P90-D92 PolarHBondContact O-N 3.42Å; D92-G94 PolarHBondContact O-N 2.81Å; D92-G94 PolarHBondContact OD1-N 3.39Å; D92-F146 WeakPolarHBondContact O-CE2 3.41Å; D92-G153 VanDerWaalsContact CG-CA 3.49Å; D92-G153 VanDerWaalsContact OD2-C 3.31Å; D92-G153 WeakPolarHBondContact OD2-CA 3.09Å; D92-N154 HydrophobicContact CB-CB 4.34Å; D92-N154 WeakPolarHBondContact CB-ND2 3.49Å
93	P	82	Confident	68.9	Low	66 Å²	66	70.8 Å²	70.8	43%	0.429	37%	0.365	S	S	.	.			trans	-55.6	-12.5	173.6	-26.8	36.5	0	0	0	114.6	Y148 G149	P93-Y148 WeakPolarHBondContact O-CA 3.32Å; P93-Y148 WeakPolarHBondContact O-CD2 3.35Å; P93-G149 PolarHBondContact O-N 3.16Å
94	G	76.7	Confident	68.8	Low	14 Å²	14	71 Å²	71	14%	0.144	35%	0.352	C	S	.	.			trans	67.8	-151.6	-176.7	0	0	0	0	0	111.7	D92 F151	D92-G94 PolarHBondContact O-N 2.81Å; D92-G94 PolarHBondContact OD1-N 3.39Å; G94-F151 CarbonylContact C-O 3.54Å; G94-F151 WeakPolarHBondContact CA-O 3.22Å
95	H	67	Low	68.4	Low	64 Å²	64	70.3 Å²	70.3	30%	0.296	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	142.8	172.6	-58.2	-30.2	0	0	0	109.6	P68 R72 G149 F151	P68-H95 WeakPolarHBondContact CB-CE1 3.1Å; P68-H95 WeakPolarHBondContact CB-NE2 3.37Å; P68-H95 WeakPolarHBondContact CG-NE2 3.39Å; R72-H95 PolarHBondContact NH1-CD2 2.87Å; R72-H95 PolarHBondContact NH1-NE2 3.01Å; H95-G149 CarbonylContact O-C 3.56Å; H95-G149 VanDerWaalsContact O-O 3.07Å; H95-F151 PolarHBondContact N-O 3.38Å; H95-F151 WeakPolarHBondContact O-CB 3.49Å; H95-F151 PolarHBondContact O-N 2.58Å
96	C	59.8	Low	67.9	Low	27 Å²	27	73.8 Å²	73.8	18%	0.182	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	134	162.9	-64.6	0	0	0	0	108.6	P98 C123 G149	C96-P98 WeakPolarHBondContact O-CD 3.02Å; C96-C123 WeakPolarHBondContact CB-SG 3.1Å; C96-C123 WeakPolarHBondContact SG-CB 3.09Å; C96-C123 CovalentContact SG-SG 2.06Å; C96-C123 PolarHBondContact SG-SG 3.45Å; C96-G149 VanDerWaalsContact CA-O 3.28Å; C96-G149 WeakPolarHBondContact CA-O 3.39Å
97	S	51.9	Low	67.2	Low	66 Å²	66	76.2 Å²	76.2	46%	0.462	37%	0.374	S	S	.	.			trans	-57.3	121.3	168	-176.4	0	0	0	0	108.1	F99	S97-F99 PolarHBondContact O-N 3.16Å
98	P	47.3	Very low	66.4	Low	73 Å²	73	86 Å²	86	47%	0.474	42%	0.42	S	S	.	.			trans	-70.7	97.8	177.4	26.7	-29	0	0	0	108	C96 M100 Q119	C96-P98 WeakPolarHBondContact O-CD 3.02Å; P98-M100 VanDerWaalsContact C-N 3.26Å; P98-M100 PolarHBondContact O-N 2.73Å; P98-Q119 HydrophobicContact CB-CG 4.36Å
99	F	43	Very low	65.8	Low	162 Å²	162	89.7 Å²	89.7	71%	0.711	44%	0.44	S	S	*	.			trans	-65.1	101.8	150.4	-91	-83.4	0	0	0	106.3	S97 K101	S97-F99 PolarHBondContact O-N 3.16Å; F99-K101 PolarHBondContact O-N 2.87Å
100	M	44.5	Very low	65	Low	101 Å²	101	93.5 Å²	93.5	50%	0.498	46%	0.46	S	S	.	.			trans	-59.2	97.8	170.7	-71.8	-94.5	-94.1	0	0	108.1	P98 W117	P98-M100 VanDerWaalsContact C-N 3.26Å; P98-M100 PolarHBondContact O-N 2.73Å; M100-W117 HydrophobicContact CB-CD2 4.48Å; M100-W117 HydrophobicContact CB-CE3 3.56Å; M100-W117 HydrophobicContact CB-CZ3 3.75Å; M100-W117 HydrophobicContact CE-CB 3.8Å; M100-W117 HydrophobicContact CE-CD2 3.88Å; M100-W117 HydrophobicContact CE-CE3 4.19Å; M100-W117 HydrophobicContact CE-CG 3.74Å; M100-W117 HydrophobicContact CG-CE3 4.46Å; M100-W117 HydrophobicContact SD-CB 3.9Å; M100-W117 HydrophobicContact SD-CE3 4.43Å; M100-W117 HydrophobicContact SD-CG 4.38Å
101	K	45.2	Very low	64.1	Low	154 Å²	154	95.7 Å²	95.7	67%	0.67	47%	0.469	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.6	122.2	167.8	-75.6	-172.9	-179.7	176.1	0	108.3	F99 K103 S118	F99-K101 PolarHBondContact O-N 2.87Å; K101-K103 PolarHBondContact O-N 3.12Å; K101-S118 PolarHBondContact O-N 2.8Å
102	K	47.1	Very low	62.8	Low	90 Å²	90	94.7 Å²	94.7	39%	0.391	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	111.5	173.7	-167.7	168.7	178.8	-177.2	0	108.1	Y104 T115 W117	K102-Y104 HydrophobicContact CB-CE2 4.29Å; K102-Y104 HydrophobicContact CD-CE1 4.16Å; K102-Y104 HydrophobicContact CG-CE1 4.28Å; K102-Y104 HydrophobicContact CG-CE2 4.32Å; K102-Y104 WeakPolarHBondContact O-CD2 3.26Å; K102-Y104 WeakPolarHBondContact O-CE2 2.94Å; K102-T115 VanDerWaalsContact CE-CB 3.48Å; K102-T115 VanDerWaalsContact CE-OG1 3.23Å; K102-T115 WeakPolarHBondContact CE-OG1 3.34Å; K102-W117 HydrophobicContact CB-CE3 4.12Å; K102-W117 HydrophobicContact CB-CZ3 3.99Å; K102-W117 HydrophobicContact CD-CH2 4.47Å
103	K	48.5	Very low	62	Low	115 Å²	115	101 Å²	101	50%	0.5	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	126.6	173.3	-171.2	173.1	-177	172.8	0	108.8	K101 T115 S116	K101-K103 PolarHBondContact O-N 3.12Å; K103-T115 CarbonylContact O-C 3.53Å; K103-T115 VanDerWaalsContact O-CA 3.25Å; K103-T115 WeakPolarHBondContact O-CA 3.23Å; K103-S116 PolarHBondContact N-O 2.82Å; K103-S116 PolarHBondContact O-N 3.48Å
104	Y	59.5	Low	60.6	Low	119 Å²	119	98.9 Å²	98.9	47%	0.467	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	122.6	178.4	-59.2	-90.8	0	0	0	108.8	K102 I112 T115	K102-Y104 HydrophobicContact CB-CE2 4.29Å; K102-Y104 HydrophobicContact CD-CE1 4.16Å; K102-Y104 HydrophobicContact CG-CE1 4.28Å; K102-Y104 HydrophobicContact CG-CE2 4.32Å; K102-Y104 WeakPolarHBondContact O-CD2 3.26Å; K102-Y104 WeakPolarHBondContact O-CE2 2.94Å; Y104-I112 HydrophobicContact CD1-CD1 3.8Å; Y104-I112 HydrophobicContact CD1-CG1 4.49Å; Y104-I112 HydrophobicContact CD1-CG2 3.81Å; Y104-I112 HydrophobicContact CG-CD1 4.18Å; Y104-I112 HydrophobicContact CG-CG2 4.45Å; Y104-T115 HydrophobicContact CD1-CG2 3.41Å; Y104-T115 VanDerWaalsContact CD1-CG2 3.41Å; Y104-T115 HydrophobicContact CE1-CG2 3.78Å; Y104-T115 HydrophobicContact CG-CG2 4.32Å
105	Y	61.9	Low	59.1	Low	101 Å²	101	101.4 Å²	101.4	40%	0.396	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	127.9	170.8	-60.3	-82.4	0	0	0	108.5	I112 F113 G114 S116	Y105-I112 CarbonylContact O-C 3.5Å; Y105-I112 VanDerWaalsContact O-CA 3.29Å; Y105-I112 WeakPolarHBondContact O-CA 3.25Å; Y105-F113 PolarHBondContact O-N 3.21Å; Y105-G114 PolarHBondContact N-O 3.18Å; Y105-G114 PolarHBondContact O-N 3.45Å; Y105-S116 WeakPolarHBondContact OH-CB 3.34Å
106	K	71.3	Confident	57.7	Low	107 Å²	107	100.6 Å²	100.6	47%	0.465	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	141.1	-178.5	-58.3	-173.1	179.3	-171.1	0	109.7	N110 D111 I112	K106-N110 WeakPolarHBondContact CD-OD1 3.41Å; K106-N110 PolarHBondContact NZ-OD1 3.03Å; K106-D111 CarbonylContact C-O 3.51Å; K106-D111 WeakPolarHBondContact CA-O 3.2Å; K106-I112 HydrophobicContact CG-CG1 4.08Å
107	D	72.2	Confident	56.7	Low	63 Å²	63	106 Å²	106	34%	0.337	52%	0.516	S	S	.	.			trans	-80.3	-174.5	175.6	67.2	13.3	0	0	0	111.1	N109 N110 D111 F113	D107-N109 PolarHBondContact O-N 3.49Å; D107-N109 WeakPolarHBondContact OD1-CA 3.46Å; D107-N109 WeakPolarHBondContact OD1-CB 3.47Å; D107-N109 PolarHBondContact OD1-N 2.92Å; D107-N110 WeakPolarHBondContact O-CA 3.25Å; D107-N110 PolarHBondContact O-N 2.99Å; D107-N110 PolarHBondContact OD1-N 3.11Å; D107-N110 VanDerWaalsContact OD1-N 3.09Å; D107-D111 PolarHBondContact N-O 2.83Å; D107-D111 PolarHBondContact OD1-N 3.38Å; D107-F113 HydrophobicContact CB-CD1 3.81Å; D107-F113 HydrophobicContact CB-CE1 4.28Å
108	E	74.1	Confident	56.4	Low	206 Å²	206	104.8 Å²	104.8	96%	0.963	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-22	179.1	-63.3	-178.3	169.3	0	0	113.2	N110	E108-N110 VanDerWaalsContact C-N 3.28Å
109	N	76.6	Confident	56.3	Low	133 Å²	133	104.6 Å²	104.6	71%	0.711	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	7.1	173.1	-64.4	-39.3	0	0	0	112.6	D107 D111	D107-N109 PolarHBondContact O-N 3.49Å; D107-N109 WeakPolarHBondContact OD1-CA 3.46Å; D107-N109 WeakPolarHBondContact OD1-CB 3.47Å; D107-N109 PolarHBondContact OD1-N 2.92Å; N109-D111 PolarHBondContact O-N 3.34Å
110	N	71.8	Confident	56.2	Low	107 Å²	107	104.7 Å²	104.7	57%	0.572	50%	0.503	S	S	*	.	S	Bend	trans	67.7	15.3	-178	-150.3	24.3	0	0	0	113.8	K106 D107 E108	K106-N110 WeakPolarHBondContact CD-OD1 3.41Å; K106-N110 PolarHBondContact NZ-OD1 3.03Å; D107-N110 WeakPolarHBondContact O-CA 3.25Å; D107-N110 PolarHBondContact O-N 2.99Å; D107-N110 PolarHBondContact OD1-N 3.11Å; D107-N110 VanDerWaalsContact OD1-N 3.09Å; E108-N110 VanDerWaalsContact C-N 3.28Å
111	D	69.8	Low	56	Low	107 Å²	107	103.9 Å²	103.9	57%	0.572	50%	0.5	S	S	*	.			trans	-83.7	135	177.4	-80	-31.9	0	0	0	110.9	K106 D107 N109 F113	K106-D111 CarbonylContact C-O 3.51Å; K106-D111 WeakPolarHBondContact CA-O 3.2Å; D107-D111 PolarHBondContact N-O 2.83Å; D107-D111 PolarHBondContact OD1-N 3.38Å; N109-D111 PolarHBondContact O-N 3.34Å; D111-F113 PolarHBondContact O-N 3.29Å
112	I	62.7	Low	55.9	Low	96 Å²	96	102.3 Å²	102.3	49%	0.492	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	98.5	-178.3	-61	170.5	0	0	0	109	Y104 Y105 K106 T115	Y104-I112 HydrophobicContact CD1-CD1 3.8Å; Y104-I112 HydrophobicContact CD1-CG1 4.49Å; Y104-I112 HydrophobicContact CD1-CG2 3.81Å; Y104-I112 HydrophobicContact CG-CD1 4.18Å; Y104-I112 HydrophobicContact CG-CG2 4.45Å; Y105-I112 CarbonylContact O-C 3.5Å; Y105-I112 VanDerWaalsContact O-CA 3.29Å; Y105-I112 WeakPolarHBondContact O-CA 3.25Å; K106-I112 HydrophobicContact CG-CG1 4.08Å; I112-T115 HydrophobicContact CG2-CG2 4.01Å
113	F	69.1	Low	55.9	Low	149 Å²	149	101.5 Å²	101.5	65%	0.654	50%	0.504	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.5	-7.9	176.5	76.2	-89	0	0	0	113.5	Y105 D107 D111	Y105-F113 PolarHBondContact O-N 3.21Å; D107-F113 HydrophobicContact CB-CD1 3.81Å; D107-F113 HydrophobicContact CB-CE1 4.28Å; D111-F113 PolarHBondContact O-N 3.29Å
114	G	52.4	Low	55.5	Low	22 Å²	22	102.1 Å²	102.1	23%	0.227	51%	0.512	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.4	155	179.5	0	0	0	0	0	113.1	Y105	Y105-G114 PolarHBondContact N-O 3.18Å; Y105-G114 PolarHBondContact O-N 3.45Å
115	T	46.2	Very low	54.6	Low	68 Å²	68	105.2 Å²	105.2	42%	0.417	53%	0.531	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	132	171.5	69.3	0	0	0	0	109.3	K102 K103 Y104 I112	K102-T115 VanDerWaalsContact CE-CB 3.48Å; K102-T115 VanDerWaalsContact CE-OG1 3.23Å; K102-T115 WeakPolarHBondContact CE-OG1 3.34Å; K103-T115 CarbonylContact O-C 3.53Å; K103-T115 VanDerWaalsContact O-CA 3.25Å; K103-T115 WeakPolarHBondContact O-CA 3.23Å; Y104-T115 HydrophobicContact CD1-CG2 3.41Å; Y104-T115 VanDerWaalsContact CD1-CG2 3.41Å; Y104-T115 HydrophobicContact CE1-CG2 3.78Å; Y104-T115 HydrophobicContact CG-CG2 4.32Å; I112-T115 HydrophobicContact CG2-CG2 4.01Å
116	S	36.7	Very low	53.6	Low	46 Å²	46	104.1 Å²	104.1	32%	0.322	55%	0.55	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-122.7	143.1	171.8	175.6	0	0	0	0	110.1	K103 Y105 S118	K103-S116 PolarHBondContact N-O 2.82Å; K103-S116 PolarHBondContact O-N 3.48Å; Y105-S116 WeakPolarHBondContact OH-CB 3.34Å; S116-S118 PolarHBondContact O-N 3.26Å
117	W	39.2	Very low	52.5	Low	141 Å²	141	101.4 Å²	101.4	53%	0.534	55%	0.545	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	104.9	167	-60.6	105.6	0	0	0	108	M100 K102	M100-W117 HydrophobicContact CB-CD2 4.48Å; M100-W117 HydrophobicContact CB-CE3 3.56Å; M100-W117 HydrophobicContact CB-CZ3 3.75Å; M100-W117 HydrophobicContact CE-CB 3.8Å; M100-W117 HydrophobicContact CE-CD2 3.88Å; M100-W117 HydrophobicContact CE-CE3 4.19Å; M100-W117 HydrophobicContact CE-CG 3.74Å; M100-W117 HydrophobicContact CG-CE3 4.46Å; M100-W117 HydrophobicContact SD-CB 3.9Å; M100-W117 HydrophobicContact SD-CE3 4.43Å; M100-W117 HydrophobicContact SD-CG 4.38Å; K102-W117 HydrophobicContact CB-CE3 4.12Å; K102-W117 HydrophobicContact CB-CZ3 3.99Å; K102-W117 HydrophobicContact CD-CH2 4.47Å
118	S	45.8	Very low	51.5	Low	40 Å²	40	106.4 Å²	106.4	28%	0.28	57%	0.572	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-90.3	116.3	174.5	55.8	0	0	0	0	109.8	K101 S116 E120	K101-S118 PolarHBondContact O-N 2.8Å; S116-S118 PolarHBondContact O-N 3.26Å; S118-E120 PolarHBondContact O-N 2.98Å
119	Q	44.4	Very low	50.8	Low	70 Å²	70	99.5 Å²	99.5	33%	0.327	54%	0.541	S	S	.	.			trans	-80	94	167.2	-141.3	-178.4	28.1	0	0	107.8	P98 N121	P98-Q119 HydrophobicContact CB-CG 4.36Å; Q119-N121 VanDerWaalsContact CG-OD1 3.28Å; Q119-N121 WeakPolarHBondContact CG-OD1 3.34Å; Q119-N121 PolarHBondContact O-N 3.39Å; Q119-N121 PolarHBondContact OE1-ND2 2.82Å; Q119-N121 PolarHBondContact OE1-OD1 3.43Å
120	E	40.5	Very low	50.3	Low	164 Å²	164	94.7 Å²	94.7	77%	0.766	52%	0.52	S	S	*	.			trans	-70.6	87.5	160.8	-83.3	179.3	167.8	0	0	107.3	S118 N122	S118-E120 PolarHBondContact O-N 2.98Å; E120-N122 PolarHBondContact O-N 3.46Å; E120-N122 VanDerWaalsContact O-N 3.16Å
121	N	40.7	Very low	50.8	Low	83 Å²	83	92.8 Å²	92.8	44%	0.444	51%	0.512	S	S	.	.			trans	-74.6	12.8	173.7	-76.3	-36.4	0	0	0	112.9	Y40 Q119	Y40-N121 WeakPolarHBondContact CD1-ND2 3.35Å; Y40-N121 VanDerWaalsContact CE1-ND2 3.28Å; Y40-N121 WeakPolarHBondContact CE1-ND2 3.39Å; Q119-N121 VanDerWaalsContact CG-OD1 3.28Å; Q119-N121 WeakPolarHBondContact CG-OD1 3.34Å; Q119-N121 PolarHBondContact O-N 3.39Å; Q119-N121 PolarHBondContact OE1-ND2 2.82Å; Q119-N121 PolarHBondContact OE1-OD1 3.43Å
122	N	43.6	Very low	51.8	Low	122 Å²	122	93.3 Å²	93.3	65%	0.652	51%	0.509	S	S	*	.			trans	-99.5	97.6	179.6	-67.4	-15.1	0	0	0	108	E120 L124	E120-N122 PolarHBondContact O-N 3.46Å; E120-N122 VanDerWaalsContact O-N 3.16Å; N122-L124 HydrophobicContact CB-CD2 4.49Å; N122-L124 HydrophobicContact CB-CG 4.12Å; N122-L124 PolarHBondContact O-N 2.01Å
123	C	46	Very low	53.2	Low	72 Å²	72	90.3 Å²	90.3	49%	0.486	49%	0.493	S	S	.	.			trans	-66.6	75.6	161	-49.5	0	0	0	0	107.1	C96	C96-C123 WeakPolarHBondContact CB-SG 3.1Å; C96-C123 WeakPolarHBondContact SG-CB 3.09Å; C96-C123 CovalentContact SG-SG 2.06Å; C96-C123 PolarHBondContact SG-SG 3.45Å
124	L	41.5	Very low	54.6	Low	129 Å²	129	85.3 Å²	85.3	68%	0.675	47%	0.47	S	S	*	.			trans	-66.1	147.3	168.1	-66.2	173.3	0	0	0	107.8	N122 G126 S127	N122-L124 HydrophobicContact CB-CD2 4.49Å; N122-L124 HydrophobicContact CB-CG 4.12Å; N122-L124 PolarHBondContact O-N 2.01Å; L124-G126 PolarHBondContact O-N 3.08Å; L124-S127 PolarHBondContact O-N 3.15Å; L124-S127 VanDerWaalsContact O-N 3.13Å
125	E	40.6	Very low	56.6	Low	183 Å²	183	84.9 Å²	84.9	86%	0.855	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-44.3	118.6	166.7	-90.3	179.2	147.8	0	0	109
126	G	41	Very low	59	Low	78 Å²	78	82.9 Å²	82.9	80%	0.804	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	103.3	9.9	-178.6	0	0	0	0	0	116.8	L124 D128	L124-G126 PolarHBondContact O-N 3.08Å; G126-D128 PolarHBondContact O-N 3.45Å
127	S	47.5	Very low	61.9	Low	51 Å²	51	82.5 Å²	82.5	36%	0.357	44%	0.441	S	S	.	.			trans	-70.9	122.5	161.9	-178.2	0	0	0	0	109.9	L124 N129 A130	L124-S127 PolarHBondContact O-N 3.15Å; L124-S127 VanDerWaalsContact O-N 3.13Å; S127-N129 PolarHBondContact O-N 2.9Å; S127-A130 PolarHBondContact O-N 2.97Å; S127-A130 VanDerWaalsContact O-N 3.14Å
128	D	52.2	Low	64.3	Low	168 Å²	168	78.7 Å²	78.7	90%	0.898	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.7	-9.5	-176.9	-70.7	-40.8	0	0	0	115.8	G126	G126-D128 PolarHBondContact O-N 3.45Å
129	N	57.6	Low	66.4	Low	60 Å²	60	81.5 Å²	81.5	32%	0.321	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.3	-4.7	-176.3	-68.5	-15.9	0	0	0	114.9	S127 V131	S127-N129 PolarHBondContact O-N 2.9Å; N129-V131 PolarHBondContact O-N 3.43Å
130	A	66.8	Low	68.7	Low	33 Å²	33	80.4 Å²	80.4	27%	0.273	47%	0.465	S	S	.	.			trans	-80.6	112.9	179.6	0	0	0	0	0	111.1	S127 L147 Y148	S127-A130 PolarHBondContact O-N 2.97Å; S127-A130 VanDerWaalsContact O-N 3.14Å; A130-L147 HydrophobicContact CB-CB 4.37Å; A130-Y148 CarbonylContact C-O 3.56Å; A130-Y148 WeakPolarHBondContact CA-O 3.37Å
131	V	82.9	Confident	71.2	Confident	66 Å²	66	74.5 Å²	74.5	40%	0.4	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	131.1	179.4	-175	0	0	0	0	109.6	N129 K133 Y148	N129-V131 PolarHBondContact O-N 3.43Å; V131-K133 HydrophobicContact CG1-CD 4.45Å; V131-K133 PolarHBondContact O-N 3.48Å; V131-Y148 PolarHBondContact N-O 3.22Å; V131-Y148 PolarHBondContact O-N 2.81Å
132	K	89.4	Confident	73.8	Confident	118 Å²	118	75.7 Å²	75.7	51%	0.513	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	120.3	171.5	-176.3	-177.6	-179.7	-177.6	0	109.4	Y134 P145	K132-Y134 WeakPolarHBondContact CE-OH 3.29Å; K132-Y134 PolarHBondContact NZ-OH 3.35Å; K132-P145 HydrophobicContact CG-CB 4.3Å
133	K	93.8	Very high	76.4	Confident	33 Å²	33	70.2 Å²	70.2	14%	0.143	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	175.3	175.8	-64.9	-74.1	-168.3	164.1	0	109.7	V131 P145 F146 Y148 N157 F158 E159	V131-K133 HydrophobicContact CG1-CD 4.45Å; V131-K133 PolarHBondContact O-N 3.48Å; K133-P145 CarbonylContact O-C 3.29Å; K133-P145 VanDerWaalsContact O-CA 3.23Å; K133-P145 WeakPolarHBondContact O-CA 3.35Å; K133-F146 HydrophobicContact CB-CD1 4.07Å; K133-F146 HydrophobicContact CB-CE1 3.51Å; K133-F146 HydrophobicContact CB-CZ 3.84Å; K133-F146 PolarHBondContact N-O 2.54Å; K133-F146 PolarHBondContact O-N 3.33Å; K133-Y148 HydrophobicContact CG-CD1 4.14Å; K133-Y148 HydrophobicContact CG-CG 4.14Å; K133-N157 WeakPolarHBondContact CB-OD1 3.4Å; K133-N157 WeakPolarHBondContact CD-OD1 3.13Å; K133-N157 WeakPolarHBondContact CG-OD1 2.98Å; K133-F158 WeakPolarHBondContact CA-O 3.37Å; K133-E159 IonicContact NZ-OE2 2.87Å; K133-E159 PolarHBondContact NZ-OE2 3.49Å
134	Y	96.7	Very high	78.9	Confident	45 Å²	45	69.1 Å²	69.1	18%	0.176	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	142	178.4	-67.9	-95.1	0	0	0	110.9	K132 E144 P145 F158 K161	K132-Y134 WeakPolarHBondContact CE-OH 3.29Å; K132-Y134 PolarHBondContact NZ-OH 3.35Å; Y134-E144 WeakPolarHBondContact CA-O 3.16Å; Y134-P145 HydrophobicContact CD1-CB 4.12Å; Y134-P145 HydrophobicContact CE1-CB 3.83Å; Y134-P145 HydrophobicContact CE1-CG 4.43Å; Y134-F158 PolarHBondContact N-O 3.06Å; Y134-F158 WeakPolarHBondContact O-CD2 2.98Å; Y134-F158 PolarHBondContact O-N 2.64Å; Y134-K161 HydrophobicContact CD1-CB 3.69Å; Y134-K161 HydrophobicContact CD1-CG 3.9Å; Y134-K161 HydrophobicContact CD2-CB 4.41Å; Y134-K161 VanDerWaalsContact CD2-N 3.3Å; Y134-K161 HydrophobicContact CE1-CB 3.59Å; Y134-K161 HydrophobicContact CE1-CD 4.3Å; Y134-K161 HydrophobicContact CE1-CG 3.95Å; Y134-K161 HydrophobicContact CE2-CB 4.35Å; Y134-K161 HydrophobicContact CG-CB 4.1Å
135	F	96.3	Very high	81.5	Confident	13 Å²	13	66.5 Å²	66.5	6%	0.057	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	150.1	172.1	79.8	-76.8	0	0	0	109.4	K91 N137 C143 E144 F146 N156 C164	K91-F135 HydrophobicContact CB-CB 4.24Å; K91-F135 HydrophobicContact CB-CD1 3.74Å; K91-F135 HydrophobicContact CB-CD2 3.62Å; K91-F135 HydrophobicContact CB-CE1 3.97Å; K91-F135 HydrophobicContact CB-CE2 3.85Å; K91-F135 HydrophobicContact CB-CG 3.58Å; K91-F135 HydrophobicContact CB-CZ 4.04Å; K91-F135 HydrophobicContact CD-CD1 4.25Å; K91-F135 HydrophobicContact CD-CE1 3.68Å; K91-F135 HydrophobicContact CD-CE2 4.24Å; K91-F135 HydrophobicContact CD-CZ 3.69Å; K91-F135 HydrophobicContact CG-CE1 4.4Å; K91-F135 HydrophobicContact CG-CE2 4.33Å; K91-F135 HydrophobicContact CG-CZ 4.26Å; F135-N137 HydrophobicContact CD2-CB 4.44Å; F135-N137 HydrophobicContact CE2-CB 3.62Å; F135-N137 HydrophobicContact CZ-CB 3.92Å; F135-N137 PolarHBondContact O-N 2.91Å; F135-C143 CarbonylContact O-C 3.54Å; F135-C143 WeakPolarHBondContact O-CA 3.48Å; F135-E144 HydrophobicContact CD1-CB 4.34Å; F135-E144 VanDerWaalsContact CD1-O 3.25Å; F135-E144 WeakPolarHBondContact CD1-O 3.21Å; F135-E144 HydrophobicContact CE1-CB 3.69Å; F135-E144 HydrophobicContact CZ-CB 4.1Å; F135-E144 PolarHBondContact N-O 3.12Å; F135-E144 PolarHBondContact O-N 2.03Å; F135-F146 HydrophobicContact CB-CD1 4.04Å; F135-F146 HydrophobicContact CB-CE1 3.96Å; F135-F146 HydrophobicContact CD1-CB 4.13Å; F135-F146 AromaticContact CD1-CD1 3.74Å; F135-F146 HydrophobicContact CD1-CD1 3.74Å; F135-F146 HydrophobicContact CD1-CG 4.17Å; F135-F146 HydrophobicContact CE1-CB 4.4Å; F135-F146 HydrophobicContact CG-CD1 4.32Å; F135-N156 WeakPolarHBondContact CA-OD1 3.27Å; F135-N156 WeakPolarHBondContact CB-O 3.28Å; F135-C164 VanDerWaalsContact C-SG 3.55Å
136	Y	96.7	Very high	83.9	Confident	25 Å²	25	58.5 Å²	58.5	10%	0.098	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	115.6	171	-176.9	-104.2	0	0	0	109.7	C87 S138 N156 C164 C168 I169	C87-Y136 HydrophobicContact CB-CD1 3.73Å; C87-Y136 HydrophobicContact CB-CE1 4.41Å; C87-Y136 HydrophobicContact CB-CG 4.18Å; C87-Y136 VanDerWaalsContact O-CD1 3.31Å; C87-Y136 WeakPolarHBondContact O-CD1 3.48Å; Y136-S138 PolarHBondContact O-N 2.02Å; Y136-N156 PolarHBondContact N-OD1 3.44Å; Y136-N156 PolarHBondContact O-ND2 3.36Å; Y136-C164 PolarHBondContact N-SG 3.48Å; Y136-C164 VanDerWaalsContact N-SG 3.41Å; Y136-C168 VanDerWaalsContact CB-SG 3.51Å; Y136-C168 HydrophobicContact CD1-CB 4.09Å; Y136-C168 HydrophobicContact CD2-CB 3.54Å; Y136-C168 HydrophobicContact CE2-CB 4.18Å; Y136-C168 HydrophobicContact CG-CB 3.48Å; Y136-C168 VanDerWaalsContact CG-CB 3.48Å; Y136-I169 HydrophobicContact CD2-CG1 4.15Å; Y136-I169 HydrophobicContact CE2-CD1 4.11Å; Y136-I169 HydrophobicContact CE2-CG1 3.64Å
137	N	95.9	Very high	86	Confident	38 Å²	38	59.2 Å²	59.2	20%	0.203	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	97.6	172.2	-176	-22.5	0	0	0	108.3	F135 A139 A140 G141 K142 E144	F135-N137 HydrophobicContact CD2-CB 4.44Å; F135-N137 HydrophobicContact CE2-CB 3.62Å; F135-N137 HydrophobicContact CZ-CB 3.92Å; F135-N137 PolarHBondContact O-N 2.91Å; N137-A139 VanDerWaalsContact C-N 3.25Å; N137-A139 PolarHBondContact O-N 2.82Å; N137-A139 PolarHBondContact OD1-N 3.43Å; N137-A140 HydrophobicContact CB-CB 3.96Å; N137-A140 VanDerWaalsContact CG-CB 3.5Å; N137-A140 CarbonylContact O-C 3.49Å; N137-A140 PolarHBondContact O-N 3.01Å; N137-A140 VanDerWaalsContact O-N 3.08Å; N137-A140 PolarHBondContact OD1-N 3.34Å; N137-G141 PolarHBondContact O-N 3.28Å; N137-K142 WeakPolarHBondContact CB-O 3.37Å; N137-K142 PolarHBondContact N-O 2.84Å; N137-K142 PolarHBondContact O-N 3.24Å; N137-E144 HydrophobicContact CB-CG 4.28Å; N137-E144 PolarHBondContact ND2-OE2 3.48Å
138	S	90.1	Very high	87.8	Confident	62 Å²	62	58.1 Å²	58.1	43%	0.434	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-31.6	-179.1	56	0	0	0	0	113.6	Y136	Y136-S138 PolarHBondContact O-N 2.02Å
139	A	89.3	Confident	88.8	Confident	98 Å²	98	50.4 Å²	50.4	81%	0.81	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-33.8	174.9	0	0	0	0	0	112.6	N137	N137-A139 VanDerWaalsContact C-N 3.25Å; N137-A139 PolarHBondContact O-N 2.82Å; N137-A139 PolarHBondContact OD1-N 3.43Å
140	A	93.5	Very high	89.6	Confident	48 Å²	48	49.6 Å²	49.6	40%	0.397	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-8.9	177.8	0	0	0	0	0	113.7	N137 K142	N137-A140 HydrophobicContact CB-CB 3.96Å; N137-A140 VanDerWaalsContact CG-CB 3.5Å; N137-A140 CarbonylContact O-C 3.49Å; N137-A140 PolarHBondContact O-N 3.01Å; N137-A140 VanDerWaalsContact O-N 3.08Å; N137-A140 PolarHBondContact OD1-N 3.34Å; A140-K142 VanDerWaalsContact C-N 3.25Å; A140-K142 HydrophobicContact CB-CD 4.29Å; A140-K142 HydrophobicContact CB-CG 3.94Å; A140-K142 PolarHBondContact O-N 2.96Å
141	G	92.9	Very high	89.8	Confident	40 Å²	40	54.6 Å²	54.6	41%	0.412	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.8	22.6	-177	0	0	0	0	0	114.7	N137	N137-G141 PolarHBondContact O-N 3.28Å
142	K	96.4	Very high	89.4	Confident	108 Å²	108	53.2 Å²	53.2	47%	0.47	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	155.9	-172.3	70.8	-172.1	-174.8	-177.9	0	112.9	N137 A140 E144	N137-K142 WeakPolarHBondContact CB-O 3.37Å; N137-K142 PolarHBondContact N-O 2.84Å; N137-K142 PolarHBondContact O-N 3.24Å; A140-K142 VanDerWaalsContact C-N 3.25Å; A140-K142 HydrophobicContact CB-CD 4.29Å; A140-K142 HydrophobicContact CB-CG 3.94Å; A140-K142 PolarHBondContact O-N 2.96Å; K142-E144 HydrophobicContact CD-CG 4.49Å; K142-E144 WeakPolarHBondContact CE-OE1 3.19Å; K142-E144 HydrophobicContact CG-CG 4.02Å; K142-E144 IonicContact NZ-OE1 3.33Å; K142-E144 PolarHBondContact NZ-OE1 2.79Å
143	C	97.6	Very high	88.9	Confident	6 Å²	6	48.7 Å²	48.7	4%	0.041	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	123.8	173	-69.4	0	0	0	0	111.5	F135 K161 C164 E165	F135-C143 CarbonylContact O-C 3.54Å; F135-C143 WeakPolarHBondContact O-CA 3.48Å; C143-K161 HydrophobicContact CB-CG 4.13Å; C143-C164 HydrophobicContact CB-CB 3.73Å; C143-C164 WeakPolarHBondContact CB-SG 3.11Å; C143-C164 WeakPolarHBondContact SG-CB 2.96Å; C143-C164 CovalentContact SG-SG 2.03Å; C143-C164 PolarHBondContact SG-SG 3.42Å; C143-E165 HydrophobicContact CB-CG 3.97Å; C143-E165 PolarHBondContact SG-N 3.04Å
144	E	97.4	Very high	88.6	Confident	50 Å²	50	48.3 Å²	48.3	23%	0.234	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	144.2	-178.7	-64.7	-173.9	144.9	0	0	110.6	Y134 F135 N137 K142	Y134-E144 WeakPolarHBondContact CA-O 3.16Å; F135-E144 HydrophobicContact CD1-CB 4.34Å; F135-E144 VanDerWaalsContact CD1-O 3.25Å; F135-E144 WeakPolarHBondContact CD1-O 3.21Å; F135-E144 HydrophobicContact CE1-CB 3.69Å; F135-E144 HydrophobicContact CZ-CB 4.1Å; F135-E144 PolarHBondContact N-O 3.12Å; F135-E144 PolarHBondContact O-N 2.03Å; N137-E144 HydrophobicContact CB-CG 4.28Å; N137-E144 PolarHBondContact ND2-OE2 3.48Å; K142-E144 HydrophobicContact CD-CG 4.49Å; K142-E144 WeakPolarHBondContact CE-OE1 3.19Å; K142-E144 HydrophobicContact CG-CG 4.02Å; K142-E144 IonicContact NZ-OE1 3.33Å; K142-E144 PolarHBondContact NZ-OE1 2.79Å
145	P	96.3	Very high	88.2	Confident	73 Å²	73	52 Å²	52	47%	0.474	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	150	174.6	30.8	-34.2	0	0	0	111.5	K132 K133 Y134	K132-P145 HydrophobicContact CG-CB 4.3Å; K133-P145 CarbonylContact O-C 3.29Å; K133-P145 VanDerWaalsContact O-CA 3.23Å; K133-P145 WeakPolarHBondContact O-CA 3.35Å; Y134-P145 HydrophobicContact CD1-CB 4.12Å; Y134-P145 HydrophobicContact CE1-CB 3.83Å; Y134-P145 HydrophobicContact CE1-CG 4.43Å
146	F	92.3	Very high	88.1	Confident	16 Å²	16	51.4 Å²	51.4	7%	0.07	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	162.2	168.2	76.1	-71.4	0	0	0	110.6	D92 K133 F135 Y148 N157	D92-F146 WeakPolarHBondContact O-CE2 3.41Å; K133-F146 HydrophobicContact CB-CD1 4.07Å; K133-F146 HydrophobicContact CB-CE1 3.51Å; K133-F146 HydrophobicContact CB-CZ 3.84Å; K133-F146 PolarHBondContact N-O 2.54Å; K133-F146 PolarHBondContact O-N 3.33Å; F135-F146 HydrophobicContact CB-CD1 4.04Å; F135-F146 HydrophobicContact CB-CE1 3.96Å; F135-F146 HydrophobicContact CD1-CB 4.13Å; F135-F146 AromaticContact CD1-CD1 3.74Å; F135-F146 HydrophobicContact CD1-CD1 3.74Å; F135-F146 HydrophobicContact CD1-CG 4.17Å; F135-F146 HydrophobicContact CE1-CB 4.4Å; F135-F146 HydrophobicContact CG-CD1 4.32Å; F146-Y148 HydrophobicContact CE2-CD2 4.39Å; F146-N157 HydrophobicContact CZ-CB 4.04Å
147	L	85	Confident	87.9	Confident	92 Å²	92	51.8 Å²	51.8	48%	0.482	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	120.1	174.4	-64.9	177.2	0	0	0	109.3	A130	A130-L147 HydrophobicContact CB-CB 4.37Å
148	Y	83.9	Confident	87.8	Confident	29 Å²	29	50 Å²	50	11%	0.114	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	128.7	176.8	174.4	-115.5	0	0	0	110.3	P93 A130 V131 K133 F146 G150 F151 G152 N157	P93-Y148 WeakPolarHBondContact O-CA 3.32Å; P93-Y148 WeakPolarHBondContact O-CD2 3.35Å; A130-Y148 CarbonylContact C-O 3.56Å; A130-Y148 WeakPolarHBondContact CA-O 3.37Å; V131-Y148 PolarHBondContact N-O 3.22Å; V131-Y148 PolarHBondContact O-N 2.81Å; K133-Y148 HydrophobicContact CG-CD1 4.14Å; K133-Y148 HydrophobicContact CG-CG 4.14Å; F146-Y148 HydrophobicContact CE2-CD2 4.39Å; Y148-G150 PolarHBondContact O-N 2.86Å; Y148-F151 PolarHBondContact OH-N 3.3Å; Y148-G152 VanDerWaalsContact CE2-O 3.3Å; Y148-G152 WeakPolarHBondContact CE2-O 3.02Å; Y148-G152 PolarHBondContact OH-N 2.89Å; Y148-G152 PolarHBondContact OH-O 2.93Å; Y148-N157 VanDerWaalsContact CD2-ND2 3.28Å; Y148-N157 WeakPolarHBondContact CD2-ND2 2.9Å; Y148-N157 VanDerWaalsContact CE2-ND2 3.32Å; Y148-N157 WeakPolarHBondContact CE2-ND2 3.24Å
149	G	74.4	Confident	87.8	Confident	5 Å²	5	52.1 Å²	52.1	5%	0.052	32%	0.315	C	S	.	.			trans	-74.1	-5.2	-175.7	0	0	0	0	0	115.6	P93 H95 C96	P93-G149 PolarHBondContact O-N 3.16Å; H95-G149 CarbonylContact O-C 3.56Å; H95-G149 VanDerWaalsContact O-O 3.07Å; C96-G149 VanDerWaalsContact CA-O 3.28Å; C96-G149 WeakPolarHBondContact CA-O 3.39Å
150	G	74	Confident	88	Confident	44 Å²	44	50.6 Å²	50.6	45%	0.454	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	93.6	-11.2	177	0	0	0	0	0	115.5	Y148	Y148-G150 PolarHBondContact O-N 2.86Å
151	F	70.6	Confident	88.1	Confident	137 Å²	137	52.7 Å²	52.7	60%	0.601	30%	0.296	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.1	137	177.1	-166.1	-95.2	0	0	0	113.3	G94 H95 Y148	G94-F151 CarbonylContact C-O 3.54Å; G94-F151 WeakPolarHBondContact CA-O 3.22Å; H95-F151 PolarHBondContact N-O 3.38Å; H95-F151 WeakPolarHBondContact O-CB 3.49Å; H95-F151 PolarHBondContact O-N 2.58Å; Y148-F151 PolarHBondContact OH-N 3.3Å
152	G	75	Confident	88.1	Confident	37 Å²	37	58.9 Å²	58.9	38%	0.381	31%	0.311	S	S	.	.			trans	70.8	-139	-176.9	0	0	0	0	0	112.2	Y148	Y148-G152 VanDerWaalsContact CE2-O 3.3Å; Y148-G152 WeakPolarHBondContact CE2-O 3.02Å; Y148-G152 PolarHBondContact OH-N 2.89Å; Y148-G152 PolarHBondContact OH-O 2.93Å
153	G	79.8	Confident	87.8	Confident	23 Å²	23	57.7 Å²	57.7	24%	0.237	31%	0.307	C	S	.	.			trans	95.6	-174.7	-173.9	0	0	0	0	0	111.8	R72 D92	R72-G153 VanDerWaalsContact NH2-N 3.12Å; D92-G153 VanDerWaalsContact CG-CA 3.49Å; D92-G153 VanDerWaalsContact OD2-C 3.31Å; D92-G153 WeakPolarHBondContact OD2-CA 3.09Å
154	N	86.3	Confident	87.7	Confident	25 Å²	25	57.4 Å²	57.4	13%	0.134	31%	0.305	C	S	.	.			trans	-124	177.5	166.3	68.4	40	0	0	0	109.4	L89 P90 D92 N156 N157	L89-N154 HydrophobicContact CD1-CB 4.1Å; P90-N154 PolarHBondContact O-ND2 2.79Å; P90-N154 PolarHBondContact O-OD1 3.47Å; D92-N154 HydrophobicContact CB-CB 4.34Å; D92-N154 WeakPolarHBondContact CB-ND2 3.49Å; N154-N156 VanDerWaalsContact C-N 3.26Å; N154-N156 PolarHBondContact O-N 2.85Å; N154-N156 WeakPolarHBondContact OD1-CB 3.02Å; N154-N156 PolarHBondContact OD1-N 2.03Å; N154-N157 WeakPolarHBondContact O-CB 3.18Å
155	E	88.8	Confident	87.5	Confident	124 Å²	124	58 Å²	58	58%	0.579	31%	0.308	S	S	*	.	S	Bend	trans	-73.1	-11.5	-172	-64.7	-178.7	-171.2	0	0	114.7	V86 L89 N157	V86-E155 HydrophobicContact CB-CB 4.4Å; V86-E155 VanDerWaalsContact CG1-C 3.47Å; V86-E155 HydrophobicContact CG1-CB 3.71Å; V86-E155 VanDerWaalsContact CG1-O 3.29Å; V86-E155 WeakPolarHBondContact CG1-O 3.42Å; V86-E155 HydrophobicContact CG2-CB 3.92Å; V86-E155 WeakPolarHBondContact CG2-OE2 3.23Å; L89-E155 HydrophobicContact CD1-CB 4.34Å; E155-N157 PolarHBondContact O-N 2.93Å
156	N	93.1	Very high	87.2	Confident	0 Å²	0	62 Å²	62	0%	0	31%	0.314	C	S	.	.			trans	-77.3	54.8	171.6	-160.4	4.8	0	0	0	110.4	V86 L89 F135 Y136 N154 F158	V86-N156 VanDerWaalsContact O-CB 3.29Å; V86-N156 WeakPolarHBondContact O-CB 3.23Å; L89-N156 HydrophobicContact CB-CB 4.02Å; L89-N156 PolarHBondContact O-ND2 2.78Å; F135-N156 WeakPolarHBondContact CA-OD1 3.27Å; F135-N156 WeakPolarHBondContact CB-O 3.28Å; Y136-N156 PolarHBondContact N-OD1 3.44Å; Y136-N156 PolarHBondContact O-ND2 3.36Å; N154-N156 VanDerWaalsContact C-N 3.26Å; N154-N156 PolarHBondContact O-N 2.85Å; N154-N156 WeakPolarHBondContact OD1-CB 3.02Å; N154-N156 PolarHBondContact OD1-N 2.03Å; N156-F158 VanDerWaalsContact OD1-CE2 3.31Å; N156-F158 WeakPolarHBondContact OD1-CE2 3.49Å
157	N	93.4	Very high	86.9	Confident	32 Å²	32	63.8 Å²	63.8	17%	0.171	32%	0.32	C	S	.	.			trans	-145.5	84.3	-168.9	-177.8	-1.9	0	0	0	108.8	K133 F146 Y148 N154 E155	K133-N157 WeakPolarHBondContact CB-OD1 3.4Å; K133-N157 WeakPolarHBondContact CD-OD1 3.13Å; K133-N157 WeakPolarHBondContact CG-OD1 2.98Å; F146-N157 HydrophobicContact CZ-CB 4.04Å; Y148-N157 VanDerWaalsContact CD2-ND2 3.28Å; Y148-N157 WeakPolarHBondContact CD2-ND2 2.9Å; Y148-N157 VanDerWaalsContact CE2-ND2 3.32Å; Y148-N157 WeakPolarHBondContact CE2-ND2 3.24Å; N154-N157 WeakPolarHBondContact O-CB 3.18Å; E155-N157 PolarHBondContact O-N 2.93Å
158	F	93.3	Very high	87.3	Confident	2 Å²	2	59.9 Å²	59.9	1%	0.009	30%	0.3	C	S	.	.	B	Isolated β-bridge	trans	-97	144.6	-175.3	-57	-73.1	0	0	0	111.4	V86 K133 Y134 N156 T160 E163 C164 R167	V86-F158 HydrophobicContact CG1-CZ 4.03Å; K133-F158 WeakPolarHBondContact CA-O 3.37Å; Y134-F158 PolarHBondContact N-O 3.06Å; Y134-F158 WeakPolarHBondContact O-CD2 2.98Å; Y134-F158 PolarHBondContact O-N 2.64Å; N156-F158 VanDerWaalsContact OD1-CE2 3.31Å; N156-F158 WeakPolarHBondContact OD1-CE2 3.49Å; F158-T160 VanDerWaalsContact C-N 3.33Å; F158-E163 HydrophobicContact CB-CB 4.42Å; F158-E163 HydrophobicContact CB-CG 4.39Å; F158-E163 HydrophobicContact CD1-CG 3.91Å; F158-C164 HydrophobicContact CB-CB 3.82Å; F158-C164 HydrophobicContact CD2-CB 3.32Å; F158-C164 VanDerWaalsContact CD2-SG 3.54Å; F158-C164 HydrophobicContact CE2-CB 4.04Å; F158-C164 HydrophobicContact CG-CB 3.66Å; F158-R167 HydrophobicContact CE1-CB 4.15Å; F158-R167 HydrophobicContact CE1-CG 4.38Å; F158-R167 HydrophobicContact CZ-CB 4.3Å
159	E	91.2	Very high	87.6	Confident	105 Å²	105	62.8 Å²	62.8	49%	0.491	32%	0.317	S	S	.	.	S	Bend	trans	-64.8	-42.3	177.7	-172	66.5	-146.8	0	0	110.6	K133 E163	K133-E159 IonicContact NZ-OE2 2.87Å; K133-E159 PolarHBondContact NZ-OE2 3.49Å; E159-E163 WeakPolarHBondContact CB-OE2 3.04Å; E159-E163 PolarHBondContact N-OE2 2.85Å; E159-E163 VanDerWaalsContact N-OE2 3.1Å
160	T	93.6	Very high	88.2	Confident	66 Å²	66	66.5 Å²	66.5	41%	0.405	34%	0.339	S	S	.	.	S	Bend	trans	-126.3	153.4	-175.6	71	0	0	0	0	112.2	F158 K162 E163 C164	F158-T160 VanDerWaalsContact C-N 3.33Å; T160-K162 PolarHBondContact O-N 3.41Å; T160-E163 PolarHBondContact O-N 3.41Å; T160-E163 WeakPolarHBondContact OG1-CB 3.24Å; T160-E163 PolarHBondContact OG1-N 2.8Å; T160-E163 VanDerWaalsContact OG1-N 3.16Å; T160-C164 PolarHBondContact O-N 2.84Å; T160-C164 VanDerWaalsContact O-N 3.15Å
161	K	95.5	Very high	88.7	Confident	93 Å²	93	65.5 Å²	65.5	40%	0.404	32%	0.323	S	S	.	.	H	α-helix	trans	-57.3	-41.2	173	-164.8	-175.5	-174.2	-124.8	0	111.7	Y134 C143 E163 C164 E165	Y134-K161 HydrophobicContact CD1-CB 3.69Å; Y134-K161 HydrophobicContact CD1-CG 3.9Å; Y134-K161 HydrophobicContact CD2-CB 4.41Å; Y134-K161 VanDerWaalsContact CD2-N 3.3Å; Y134-K161 HydrophobicContact CE1-CB 3.59Å; Y134-K161 HydrophobicContact CE1-CD 4.3Å; Y134-K161 HydrophobicContact CE1-CG 3.95Å; Y134-K161 HydrophobicContact CE2-CB 4.35Å; Y134-K161 HydrophobicContact CG-CB 4.1Å; C143-K161 HydrophobicContact CB-CG 4.13Å; K161-E163 VanDerWaalsContact C-N 3.33Å; K161-E163 PolarHBondContact O-N 3.43Å; K161-C164 WeakPolarHBondContact O-CB 3.24Å; K161-C164 PolarHBondContact O-N 3.12Å; K161-E165 WeakPolarHBondContact CE-OE1 3.5Å; K161-E165 HydrophobicContact CG-CG 4.28Å; K161-E165 IonicContact NZ-OE1 2.66Å; K161-E165 PolarHBondContact NZ-OE1 3.24Å; K161-E165 WeakPolarHBondContact O-CG 3.49Å; K161-E165 PolarHBondContact O-N 3.23Å
162	K	92.8	Very high	89.4	Confident	169 Å²	169	61.3 Å²	61.3	74%	0.735	31%	0.309	S	S	*	.	H	α-helix	trans	-62.6	-40.2	-178.7	-173.3	178.1	179.3	-178.1	0	111.8	T160 E165 W166	T160-K162 PolarHBondContact O-N 3.41Å; K162-E165 PolarHBondContact O-N 3.32Å; K162-W166 VanDerWaalsContact O-CB 3.24Å; K162-W166 WeakPolarHBondContact O-CB 3.11Å; K162-W166 PolarHBondContact O-N 3.09Å
163	E	90.3	Very high	89.7	Confident	83 Å²	83	65.4 Å²	65.4	39%	0.388	31%	0.313	S	S	.	.	H	α-helix	trans	-64	-46.1	174.5	-176.3	-171.9	178.9	0	0	111.5	F158 E159 T160 K161 E165 W166 R167	F158-E163 HydrophobicContact CB-CB 4.42Å; F158-E163 HydrophobicContact CB-CG 4.39Å; F158-E163 HydrophobicContact CD1-CG 3.91Å; E159-E163 WeakPolarHBondContact CB-OE2 3.04Å; E159-E163 PolarHBondContact N-OE2 2.85Å; E159-E163 VanDerWaalsContact N-OE2 3.1Å; T160-E163 PolarHBondContact O-N 3.41Å; T160-E163 WeakPolarHBondContact OG1-CB 3.24Å; T160-E163 PolarHBondContact OG1-N 2.8Å; T160-E163 VanDerWaalsContact OG1-N 3.16Å; K161-E163 VanDerWaalsContact C-N 3.33Å; K161-E163 PolarHBondContact O-N 3.43Å; E163-E165 PolarHBondContact O-N 2.78Å; E163-W166 PolarHBondContact O-N 2.87Å; E163-R167 WeakPolarHBondContact O-CB 3.46Å; E163-R167 PolarHBondContact O-N 2.92Å
164	C	94.6	Very high	90.1	Very high	0 Å²	0	67.2 Å²	67.2	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-58.6	-48.1	174.8	178.4	0	0	0	0	112	F135 Y136 C143 F158 T160 K161 R167 C168	F135-C164 VanDerWaalsContact C-SG 3.55Å; Y136-C164 PolarHBondContact N-SG 3.48Å; Y136-C164 VanDerWaalsContact N-SG 3.41Å; C143-C164 HydrophobicContact CB-CB 3.73Å; C143-C164 WeakPolarHBondContact CB-SG 3.11Å; C143-C164 WeakPolarHBondContact SG-CB 2.96Å; C143-C164 CovalentContact SG-SG 2.03Å; C143-C164 PolarHBondContact SG-SG 3.42Å; F158-C164 HydrophobicContact CB-CB 3.82Å; F158-C164 HydrophobicContact CD2-CB 3.32Å; F158-C164 VanDerWaalsContact CD2-SG 3.54Å; F158-C164 HydrophobicContact CE2-CB 4.04Å; F158-C164 HydrophobicContact CG-CB 3.66Å; T160-C164 PolarHBondContact O-N 2.84Å; T160-C164 VanDerWaalsContact O-N 3.15Å; K161-C164 WeakPolarHBondContact O-CB 3.24Å; K161-C164 PolarHBondContact O-N 3.12Å; C164-R167 PolarHBondContact O-N 2.75Å; C164-C168 VanDerWaalsContact O-CB 3.22Å; C164-C168 WeakPolarHBondContact O-CB 3.23Å; C164-C168 PolarHBondContact O-N 2.77Å
165	E	94.6	Very high	90.2	Very high	62 Å²	62	66.6 Å²	66.6	29%	0.29	32%	0.315	S	S	.	.	H	α-helix	trans	-65.9	-42.7	-179.2	-70.5	173.7	161.2	0	0	111	C143 K161 K162 E163 R167 I169 T170	C143-E165 HydrophobicContact CB-CG 3.97Å; C143-E165 PolarHBondContact SG-N 3.04Å; K161-E165 WeakPolarHBondContact CE-OE1 3.5Å; K161-E165 HydrophobicContact CG-CG 4.28Å; K161-E165 IonicContact NZ-OE1 2.66Å; K161-E165 PolarHBondContact NZ-OE1 3.24Å; K161-E165 WeakPolarHBondContact O-CG 3.49Å; K161-E165 PolarHBondContact O-N 3.23Å; K162-E165 PolarHBondContact O-N 3.32Å; E163-E165 PolarHBondContact O-N 2.78Å; E165-R167 PolarHBondContact O-N 3.29Å; E165-I169 HydrophobicContact CB-CD1 4.26Å; E165-I169 HydrophobicContact CG-CD1 4.01Å; E165-I169 WeakPolarHBondContact O-CA 3.48Å; E165-I169 WeakPolarHBondContact O-CB 3.21Å; E165-I169 PolarHBondContact O-N 2.68Å; E165-T170 PolarHBondContact O-N 3.3Å; E165-T170 VanDerWaalsContact O-N 3.09Å
166	W	88.6	Confident	90.4	Very high	158 Å²	158	61.1 Å²	61.1	60%	0.598	29%	0.29	S	S	*	.	I	π-helix	trans	-59.4	-49.6	175.9	-177.1	-107.1	0	0	0	111.6	K162 E163 T170 L171	K162-W166 VanDerWaalsContact O-CB 3.24Å; K162-W166 WeakPolarHBondContact O-CB 3.11Å; K162-W166 PolarHBondContact O-N 3.09Å; E163-W166 PolarHBondContact O-N 2.87Å; W166-T170 HydrophobicContact CD2-CG2 4.36Å; W166-T170 HydrophobicContact CE3-CG2 3.54Å; W166-T170 HydrophobicContact CH2-CG2 3.99Å; W166-T170 HydrophobicContact CZ3-CG2 3.34Å; W166-T170 WeakPolarHBondContact O-CB 3.27Å; W166-T170 PolarHBondContact O-N 3.43Å; W166-L171 HydrophobicContact CZ2-CD2 4.36Å; W166-L171 PolarHBondContact O-N 3.05Å
167	R	87.1	Confident	90.3	Very high	54 Å²	54	67 Å²	67	20%	0.204	32%	0.318	C	S	.	.	I	π-helix	trans	-72.2	-37.4	-176.8	-159.9	-176.4	-175.8	160.5	-8.3	113.2	F158 E163 C164 E165 D213	F158-R167 HydrophobicContact CE1-CB 4.15Å; F158-R167 HydrophobicContact CE1-CG 4.38Å; F158-R167 HydrophobicContact CZ-CB 4.3Å; E163-R167 WeakPolarHBondContact O-CB 3.46Å; E163-R167 PolarHBondContact O-N 2.92Å; C164-R167 PolarHBondContact O-N 2.75Å; E165-R167 PolarHBondContact O-N 3.29Å; R167-D213 IonicContact CZ-OD1 3.66Å; R167-D213 IonicContact NE-OD1 3.52Å; R167-D213 PolarHBondContact NE-OD1 2.81Å; R167-D213 IonicContact NH2-OD1 2.66Å; R167-D213 PolarHBondContact NH2-OD1 2.7Å
168	C	92.2	Very high	90.2	Very high	9 Å²	9	65.8 Å²	65.8	6%	0.061	31%	0.311	C	S	.	.	I	π-helix	trans	-103.7	-15.9	-170.4	-63.6	0	0	0	0	115.5	C87 Y136 C164	C87-C168 HydrophobicContact CB-CB 3.62Å; C87-C168 WeakPolarHBondContact CB-SG 3.11Å; C87-C168 WeakPolarHBondContact SG-CA 3.47Å; C87-C168 WeakPolarHBondContact SG-CB 3.32Å; C87-C168 CovalentContact SG-SG 2.03Å; C87-C168 PolarHBondContact SG-SG 3.49Å; Y136-C168 VanDerWaalsContact CB-SG 3.51Å; Y136-C168 HydrophobicContact CD1-CB 4.09Å; Y136-C168 HydrophobicContact CD2-CB 3.54Å; Y136-C168 HydrophobicContact CE2-CB 4.18Å; Y136-C168 HydrophobicContact CG-CB 3.48Å; Y136-C168 VanDerWaalsContact CG-CB 3.48Å; C164-C168 VanDerWaalsContact O-CB 3.22Å; C164-C168 WeakPolarHBondContact O-CB 3.23Å; C164-C168 PolarHBondContact O-N 2.77Å
169	I	90.8	Very high	90.2	Very high	91 Å²	91	69.8 Å²	69.8	47%	0.467	34%	0.337	S	S	.	.	I	π-helix	trans	-117	-40.7	-179.7	-53.9	178.6	0	0	0	110.7	Y136 E165	Y136-I169 HydrophobicContact CD2-CG1 4.15Å; Y136-I169 HydrophobicContact CE2-CD1 4.11Å; Y136-I169 HydrophobicContact CE2-CG1 3.64Å; E165-I169 HydrophobicContact CB-CD1 4.26Å; E165-I169 HydrophobicContact CG-CD1 4.01Å; E165-I169 WeakPolarHBondContact O-CA 3.48Å; E165-I169 WeakPolarHBondContact O-CB 3.21Å; E165-I169 PolarHBondContact O-N 2.68Å
170	T	86.7	Confident	90.4	Very high	82 Å²	82	70.3 Å²	70.3	50%	0.503	34%	0.338	S	S	.	.	I	π-helix	trans	-87.7	-42.9	-174.7	-48	0	0	0	0	113.9	E165 W166	E165-T170 PolarHBondContact O-N 3.3Å; E165-T170 VanDerWaalsContact O-N 3.09Å; W166-T170 HydrophobicContact CD2-CG2 4.36Å; W166-T170 HydrophobicContact CE3-CG2 3.54Å; W166-T170 HydrophobicContact CH2-CG2 3.99Å; W166-T170 HydrophobicContact CZ3-CG2 3.34Å; W166-T170 WeakPolarHBondContact O-CB 3.27Å; W166-T170 PolarHBondContact O-N 3.43Å
171	L	83.8	Confident	90.3	Very high	23 Å²	23	68 Å²	68	12%	0.12	33%	0.325	C	S	.	.	S	Bend	trans	-74.8	144.2	178.8	-68	-178.8	0	0	0	111.8	W166 Q178 N212	W166-L171 HydrophobicContact CZ2-CD2 4.36Å; W166-L171 PolarHBondContact O-N 3.05Å; L171-Q178 HydrophobicContact CB-CG 4.34Å; L171-N212 HydrophobicContact CD1-CB 3.85Å
172	P	85.1	Confident	90.2	Very high	49 Å²	49	66.8 Å²	66.8	32%	0.318	33%	0.326	S	S	.	.			trans	-54.8	140.8	168.1	-25.4	34.2	0	0	0	111.9	N174 E177 Q178	P172-N174 PolarHBondContact O-N 2.69Å; P172-E177 HydrophobicContact CB-CB 3.7Å; P172-E177 HydrophobicContact CG-CB 4.06Å; P172-Q178 PolarHBondContact O-NE2 3.36Å
173	R	83.1	Confident	90	Very high	124 Å²	124	60.1 Å²	60.1	47%	0.468	31%	0.305	S	S	.	.	S	Bend	trans	-67.5	-24.1	177.4	-73.6	-165.3	179.3	-143.3	-0.7	113.4	H85 D88 P175	H85-R173 PolarHBondContact CD2-O 2.81Å; H85-R173 PolarHBondContact NE2-O 3.35Å; D88-R173 VanDerWaalsContact CG-NH1 3.27Å; D88-R173 IonicContact OD1-CZ 2.95Å; D88-R173 IonicContact OD1-NH1 2.78Å; D88-R173 PolarHBondContact OD1-NH1 2.84Å; D88-R173 IonicContact OD1-NH2 2.85Å; D88-R173 IonicContact OD2-NH1 2.59Å; D88-R173 PolarHBondContact OD2-NH1 2.81Å; R173-P175 VanDerWaalsContact O-CD 3.3Å; R173-P175 WeakPolarHBondContact O-CD 3.47Å
174	N	86.3	Confident	89.8	Confident	60 Å²	60	61.5 Å²	61.5	32%	0.321	32%	0.315	S	S	.	.	S	Bend	trans	-79.2	116.2	173.1	-177.6	1.4	0	0	0	108	P172 C176 E177	P172-N174 PolarHBondContact O-N 2.69Å; N174-C176 PolarHBondContact O-N 2.71Å; N174-C176 VanDerWaalsContact O-N 3.14Å; N174-C176 WeakPolarHBondContact OD1-CB 3.32Å; N174-C176 PolarHBondContact OD1-N 2.96Å; N174-C176 VanDerWaalsContact OD1-N 3.07Å; N174-C176 PolarHBondContact OD1-SG 3.42Å; N174-C176 VanDerWaalsContact OD1-SG 3.4Å; N174-E177 HydrophobicContact CB-CB 4.21Å; N174-E177 HydrophobicContact CB-CG 4.02Å; N174-E177 PolarHBondContact ND2-OE1 3.39Å; N174-E177 PolarHBondContact O-N 2.81Å
175	P	89.1	Confident	89.4	Confident	13 Å²	13	64.3 Å²	64.3	8%	0.084	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-51.2	-38.6	175.3	-28.4	37.6	0	0	0	112.1	R173 E177 Q178 D213 N214 F216	R173-P175 VanDerWaalsContact O-CD 3.3Å; R173-P175 WeakPolarHBondContact O-CD 3.47Å; P175-E177 PolarHBondContact O-N 3.5Å; P175-E177 VanDerWaalsContact O-N 3.14Å; P175-Q178 WeakPolarHBondContact O-CB 3.3Å; P175-Q178 PolarHBondContact O-N 3.36Å; P175-D213 HydrophobicContact CB-CB 3.72Å; P175-D213 HydrophobicContact CG-CB 3.76Å; P175-N214 WeakPolarHBondContact O-CB 3.33Å; P175-F216 HydrophobicContact CB-CZ 4.28Å
176	C	93.5	Very high	89	Confident	9 Å²	9	66.6 Å²	66.6	6%	0.061	36%	0.363	C	S	.	.	G	3₁₀ helix	trans	-72.1	-7.7	-176.2	-41.8	0	0	0	0	113.7	N174 Y194 C226	N174-C176 PolarHBondContact O-N 2.71Å; N174-C176 VanDerWaalsContact O-N 3.14Å; N174-C176 WeakPolarHBondContact OD1-CB 3.32Å; N174-C176 PolarHBondContact OD1-N 2.96Å; N174-C176 VanDerWaalsContact OD1-N 3.07Å; N174-C176 PolarHBondContact OD1-SG 3.42Å; N174-C176 VanDerWaalsContact OD1-SG 3.4Å; C176-Y194 HydrophobicContact CB-CD1 3.77Å; C176-Y194 HydrophobicContact CB-CE1 4.34Å; C176-Y194 HydrophobicContact CB-CG 3.97Å; C176-Y194 WeakPolarHBondContact O-CD1 2.97Å; C176-C226 HydrophobicContact CB-CB 3.74Å; C176-C226 WeakPolarHBondContact CB-SG 3.3Å; C176-C226 WeakPolarHBondContact SG-CA 3.04Å; C176-C226 WeakPolarHBondContact SG-CB 3.4Å; C176-C226 CovalentContact SG-SG 2.03Å; C176-C226 PolarHBondContact SG-SG 2.82Å
177	E	91.4	Very high	88.7	Confident	124 Å²	124	64 Å²	64	58%	0.579	36%	0.361	S	S	*	.	G	3₁₀ helix	trans	-98.8	-6	172	-72.4	164.6	-150.2	0	0	112.3	P172 N174 P175	P172-E177 HydrophobicContact CB-CB 3.7Å; P172-E177 HydrophobicContact CG-CB 4.06Å; N174-E177 HydrophobicContact CB-CB 4.21Å; N174-E177 HydrophobicContact CB-CG 4.02Å; N174-E177 PolarHBondContact ND2-OE1 3.39Å; N174-E177 PolarHBondContact O-N 2.81Å; P175-E177 PolarHBondContact O-N 3.5Å; P175-E177 VanDerWaalsContact O-N 3.14Å
178	Q	91.7	Very high	88.6	Confident	5 Å²	5	67.6 Å²	67.6	2%	0.023	38%	0.384	C	S	.	.	S	Bend	trans	-83.7	150.3	177.3	-53.8	174.6	3.2	0	0	110.1	L171 P172 P175 N212 D213 N214	L171-Q178 HydrophobicContact CB-CG 4.34Å; P172-Q178 PolarHBondContact O-NE2 3.36Å; P175-Q178 WeakPolarHBondContact O-CB 3.3Å; P175-Q178 PolarHBondContact O-N 3.36Å; Q178-N212 VanDerWaalsContact OE1-CB 3.24Å; Q178-D213 PolarHBondContact NE2-OD2 3.31Å; Q178-D213 VanDerWaalsContact NE2-OD2 3.16Å; Q178-N214 HydrophobicContact CB-CB 4.13Å; Q178-N214 PolarHBondContact O-ND2 2.89Å
179	P	93	Very high	88.4	Confident	86 Å²	86	69.8 Å²	69.8	56%	0.558	40%	0.397	S	S	*	.	P	Polyproline II helix	trans	-70.3	167.1	176.2	30.3	-36.3	0	0	0	111.6	A181 N212	P179-A181 PolarHBondContact O-N 3.39Å; P179-N212 PolarHBondContact O-ND2 2.75Å; P179-N212 PolarHBondContact O-OD1 3.27Å
180	K	94.2	Very high	88.3	Confident	116 Å²	116	68.3 Å²	68.3	50%	0.504	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-64.2	134.2	166.2	71.2	-170.3	178.1	-168.6	0	110.8	F193	K180-F193 HydrophobicContact CB-CB 4.23Å; K180-F193 HydrophobicContact CB-CD1 3.83Å; K180-F193 HydrophobicContact CB-CD2 3.56Å; K180-F193 HydrophobicContact CB-CE1 4.08Å; K180-F193 HydrophobicContact CB-CE2 3.8Å; K180-F193 HydrophobicContact CB-CG 3.58Å; K180-F193 HydrophobicContact CB-CZ 4.08Å; K180-F193 HydrophobicContact CD-CD1 4.29Å; K180-F193 HydrophobicContact CD-CE1 3.73Å; K180-F193 HydrophobicContact CD-CE2 4.11Å; K180-F193 HydrophobicContact CD-CZ 3.65Å; K180-F193 HydrophobicContact CG-CE2 4.37Å; K180-F193 HydrophobicContact CG-CZ 4.38Å
181	A	91.9	Very high	88.6	Confident	17 Å²	17	67.4 Å²	67.4	14%	0.14	38%	0.379	C	S	.	.			trans	-116.4	94.4	178.9	0	0	0	0	0	110.9	P179 G183 F204 Y206 N212	P179-A181 PolarHBondContact O-N 3.39Å; A181-G183 VanDerWaalsContact C-N 3.34Å; A181-F204 WeakPolarHBondContact O-CE2 3.25Å; A181-Y206 WeakPolarHBondContact O-CD2 3.07Å; A181-N212 HydrophobicContact CB-CB 4.11Å
182	V	93.3	Very high	89.1	Confident	68 Å²	68	68.8 Å²	68.8	41%	0.412	38%	0.383	S	S	.	.			trans	-62.7	-41.6	178.4	175.5	0	0	0	0	111	F204 A205 Y206 S207	V182-F204 HydrophobicContact CG2-CD2 4.28Å; V182-A205 WeakPolarHBondContact CG1-O 3.32Å; V182-Y206 VanDerWaalsContact O-CD2 3.3Å; V182-Y206 WeakPolarHBondContact O-CD2 3.48Å; V182-S207 WeakPolarHBondContact O-CB 3.2Å; V182-S207 PolarHBondContact O-N 2.81Å; V182-S207 PolarHBondContact O-OG 2.64Å
183	G	88.4	Confident	89.6	Confident	29 Å²	29	66.9 Å²	66.9	30%	0.299	37%	0.37	S	S	.	.			trans	75	-174.9	-171	0	0	0	0	0	113.3	A181 S207 C209	A181-G183 VanDerWaalsContact C-N 3.34Å; G183-S207 WeakPolarHBondContact CA-OG 3.13Å; G183-S207 PolarHBondContact O-OG 3.12Å; G183-C209 WeakPolarHBondContact CA-O 3.41Å
184	N	85.8	Confident	90.2	Very high	113 Å²	113	63 Å²	63	60%	0.604	36%	0.356	S	S	*	.	S	Bend	trans	-125.7	16.4	-172.6	72.7	-12.9	0	0	0	114.6	S207 Q210	N184-S207 PolarHBondContact N-OG 2.75Å; N184-S207 VanDerWaalsContact N-OG 3.12Å; N184-Q210 PolarHBondContact ND2-NE2 3.41Å; N184-Q210 PolarHBondContact ND2-OE1 3Å; N184-Q210 PolarHBondContact OD1-NE2 2.99Å; N184-Q210 PolarHBondContact OD1-OE1 3.43Å
185	C	87.8	Confident	90.5	Very high	59 Å²	59	61.4 Å²	61.4	40%	0.399	35%	0.347	S	S	.	.			trans	-84.5	172.1	179	-80.6	0	0	0	0	113	S207 C209	C185-S207 CarbonylContact C-O 3.51Å; C185-S207 VanDerWaalsContact C-O 3.3Å; C185-S207 WeakPolarHBondContact CB-O 3.01Å; C185-S207 PolarHBondContact N-OG 3.32Å; C185-S207 VanDerWaalsContact N-OG 3.1Å; C185-S207 VanDerWaalsContact O-CB 3.32Å; C185-S207 WeakPolarHBondContact O-CB 3.42Å; C185-C209 HydrophobicContact CB-CB 3.85Å; C185-C209 WeakPolarHBondContact CB-SG 3.24Å; C185-C209 WeakPolarHBondContact SG-CB 3.23Å; C185-C209 CovalentContact SG-SG 2.01Å; C185-C209 PolarHBondContact SG-SG 2.97Å
186	A	85.1	Confident	90.5	Very high	109 Å²	109	64 Å²	64	90%	0.901	37%	0.369	S	S	*	.	S	Bend	trans	-92.9	3.5	-175.1	0	0	0	0	0	114.5
187	N	82.3	Confident	90.1	Very high	103 Å²	103	72 Å²	72	55%	0.551	41%	0.406	S	S	*	.			trans	-107.3	92.6	-173.5	-174.9	16.9	0	0	0	111.5	V189 S207 G208	N187-V189 PolarHBondContact O-N 3.23Å; N187-S207 CarbonylContact C-O 3.15Å; N187-S207 WeakPolarHBondContact CA-O 3.03Å; N187-S207 PolarHBondContact N-O 2.94Å; N187-S207 CarbonylContact O-C 3.58Å; N187-S207 WeakPolarHBondContact O-CA 3.13Å; N187-G208 PolarHBondContact O-N 3.31Å
188	L	85.4	Confident	89.9	Confident	131 Å²	131	69.7 Å²	69.7	69%	0.686	40%	0.4	S	S	*	.			trans	-76.8	107.3	179.8	-67	169.5	0	0	0	111.3	A205 Y206	L188-A205 HydrophobicContact CD2-CB 4.02Å; L188-Y206 CarbonylContact C-O 3.48Å; L188-Y206 WeakPolarHBondContact CA-O 3.4Å
189	V	87.6	Confident	89.8	Confident	55 Å²	55	76.4 Å²	76.4	33%	0.333	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	140.4	174.8	-168.7	0	0	0	0	109.1	N187 R191 Y206	N187-V189 PolarHBondContact O-N 3.23Å; V189-R191 PolarHBondContact O-N 2.64Å; V189-Y206 PolarHBondContact N-O 3.01Å; V189-Y206 PolarHBondContact O-N 2.82Å
190	T	88.6	Confident	89.6	Confident	60 Å²	60	73.3 Å²	73.3	37%	0.368	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	128.2	172.3	-64.7	0	0	0	0	109.2	R203	T190-R203 HydrophobicContact CG2-CB 4.11Å; T190-R203 PolarHBondContact OG1-NH2 3.27Å
191	R	93.7	Very high	89.4	Confident	63 Å²	63	68 Å²	68	24%	0.238	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	171.3	175.5	-67.8	-65.6	-173.9	94.9	-11.7	109.4	V189 R203 F204 Y206 N215 F216	V189-R191 PolarHBondContact O-N 2.64Å; R191-R203 CarbonylContact O-C 3.55Å; R191-R203 WeakPolarHBondContact O-CA 3.36Å; R191-F204 HydrophobicContact CB-CD1 4.04Å; R191-F204 HydrophobicContact CB-CE1 3.49Å; R191-F204 VanDerWaalsContact CB-CE1 3.49Å; R191-F204 HydrophobicContact CB-CZ 3.9Å; R191-F204 PolarHBondContact N-O 3.28Å; R191-F204 WeakPolarHBondContact O-CD1 3.3Å; R191-F204 PolarHBondContact O-N 2.79Å; R191-Y206 HydrophobicContact CG-CD1 4.02Å; R191-Y206 HydrophobicContact CG-CG 4.12Å; R191-N215 VanDerWaalsContact CB-OD1 3.24Å; R191-N215 WeakPolarHBondContact CB-OD1 3.44Å; R191-N215 WeakPolarHBondContact CD-OD1 3.5Å; R191-N215 WeakPolarHBondContact CG-OD1 3.44Å; R191-N215 PolarHBondContact NH1-OD1 3.43Å; R191-F216 CarbonylContact C-O 3.58Å; R191-F216 WeakPolarHBondContact CA-O 3.44Å; R191-F216 WeakPolarHBondContact CD-O 3.36Å
192	Y	94.4	Very high	89.3	Confident	51 Å²	51	70 Å²	70	20%	0.2	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	145.8	178.9	-58.6	-95.2	0	0	0	110.6	E202 R203 N215 F216 E217 I219	Y192-E202 CarbonylContact C-O 3.51Å; Y192-E202 VanDerWaalsContact CA-O 3.26Å; Y192-E202 WeakPolarHBondContact CA-O 3.47Å; Y192-R203 HydrophobicContact CD1-CB 3.92Å; Y192-R203 HydrophobicContact CE1-CB 3.76Å; Y192-N215 WeakPolarHBondContact O-CA 3.48Å; Y192-F216 PolarHBondContact N-O 3.25Å; Y192-F216 WeakPolarHBondContact O-CD2 3.24Å; Y192-F216 PolarHBondContact O-N 2.8Å; Y192-E217 WeakPolarHBondContact CE2-O 3.26Å; Y192-I219 HydrophobicContact CD1-CB 3.65Å; Y192-I219 HydrophobicContact CD1-CD1 4.07Å; Y192-I219 HydrophobicContact CD1-CG1 3.64Å; Y192-I219 HydrophobicContact CD2-CB 4.33Å; Y192-I219 HydrophobicContact CE1-CB 3.62Å; Y192-I219 HydrophobicContact CE1-CD1 4.01Å; Y192-I219 HydrophobicContact CE1-CG1 3.91Å; Y192-I219 HydrophobicContact CE2-CB 4.33Å; Y192-I219 HydrophobicContact CG-CB 4.01Å; Y192-I219 HydrophobicContact CG-CG1 4.25Å
193	F	95.6	Very high	89.3	Confident	10 Å²	10	74.8 Å²	74.8	4%	0.044	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	146.9	172.8	80.6	-76.3	0	0	0	108.9	K180 N195 C201 E202 F204 N214	K180-F193 HydrophobicContact CB-CB 4.23Å; K180-F193 HydrophobicContact CB-CD1 3.83Å; K180-F193 HydrophobicContact CB-CD2 3.56Å; K180-F193 HydrophobicContact CB-CE1 4.08Å; K180-F193 HydrophobicContact CB-CE2 3.8Å; K180-F193 HydrophobicContact CB-CG 3.58Å; K180-F193 HydrophobicContact CB-CZ 4.08Å; K180-F193 HydrophobicContact CD-CD1 4.29Å; K180-F193 HydrophobicContact CD-CE1 3.73Å; K180-F193 HydrophobicContact CD-CE2 4.11Å; K180-F193 HydrophobicContact CD-CZ 3.65Å; K180-F193 HydrophobicContact CG-CE2 4.37Å; K180-F193 HydrophobicContact CG-CZ 4.38Å; F193-N195 HydrophobicContact CD2-CB 4.36Å; F193-N195 HydrophobicContact CE2-CB 3.54Å; F193-N195 HydrophobicContact CZ-CB 3.78Å; F193-N195 PolarHBondContact O-N 2.86Å; F193-C201 CarbonylContact O-C 3.59Å; F193-C201 WeakPolarHBondContact O-CA 3.38Å; F193-E202 HydrophobicContact CD1-CB 4.26Å; F193-E202 VanDerWaalsContact CD1-O 3.3Å; F193-E202 WeakPolarHBondContact CD1-O 3.38Å; F193-E202 HydrophobicContact CE1-CB 3.69Å; F193-E202 HydrophobicContact CZ-CB 4.16Å; F193-E202 PolarHBondContact N-O 3.2Å; F193-E202 PolarHBondContact O-N 2.86Å; F193-F204 HydrophobicContact CB-CD1 4.05Å; F193-F204 HydrophobicContact CB-CE1 3.98Å; F193-F204 HydrophobicContact CD1-CB 4.02Å; F193-F204 AromaticContact CD1-CD1 3.69Å; F193-F204 HydrophobicContact CD1-CD1 3.69Å; F193-F204 HydrophobicContact CD1-CE1 4.45Å; F193-F204 HydrophobicContact CD1-CG 4.06Å; F193-F204 HydrophobicContact CE1-CB 4.23Å; F193-F204 HydrophobicContact CG-CD1 4.28Å; F193-N214 WeakPolarHBondContact CA-OD1 3.34Å; F193-N214 HydrophobicContact CB-CB 4.44Å; F193-N214 WeakPolarHBondContact CB-O 3.34Å
194	Y	94.9	Very high	89.5	Confident	42 Å²	42	74.2 Å²	74.2	17%	0.165	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	118.3	169.6	178.1	-92.7	0	0	0	109.7	C176 A196 N214 C222 C226 V228	C176-Y194 HydrophobicContact CB-CD1 3.77Å; C176-Y194 HydrophobicContact CB-CE1 4.34Å; C176-Y194 HydrophobicContact CB-CG 3.97Å; C176-Y194 WeakPolarHBondContact O-CD1 2.97Å; Y194-A196 HydrophobicContact CE1-CB 4.18Å; Y194-N214 PolarHBondContact N-OD1 3.34Å; Y194-N214 PolarHBondContact O-ND2 2.82Å; Y194-C222 PolarHBondContact N-SG 2.87Å; Y194-C226 WeakPolarHBondContact CB-SG 3.3Å; Y194-C226 HydrophobicContact CD2-CB 3.46Å; Y194-C226 VanDerWaalsContact CD2-CB 3.46Å; Y194-C226 HydrophobicContact CE2-CB 4.09Å; Y194-C226 HydrophobicContact CG-CB 3.79Å; Y194-V228 HydrophobicContact CD2-CG2 3.89Å; Y194-V228 HydrophobicContact CE2-CG2 3.95Å
195	N	93.1	Very high	89.8	Confident	26 Å²	26	71.3 Å²	71.3	14%	0.139	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	110.1	174.2	-177.9	-8	0	0	0	109.2	F193 E197 T198 K199 D200 E202	F193-N195 HydrophobicContact CD2-CB 4.36Å; F193-N195 HydrophobicContact CE2-CB 3.54Å; F193-N195 HydrophobicContact CZ-CB 3.78Å; F193-N195 PolarHBondContact O-N 2.86Å; N195-E197 PolarHBondContact O-N 3.08Å; N195-E197 WeakPolarHBondContact OD1-CB 2.97Å; N195-E197 PolarHBondContact OD1-N 3.26Å; N195-T198 VanDerWaalsContact CB-OG1 3.3Å; N195-T198 WeakPolarHBondContact CB-OG1 3.4Å; N195-T198 PolarHBondContact O-N 2.03Å; N195-T198 PolarHBondContact O-OG1 2.98Å; N195-K199 VanDerWaalsContact O-CA 3.3Å; N195-K199 WeakPolarHBondContact O-CA 3.21Å; N195-K199 PolarHBondContact O-N 2.91Å; N195-D200 PolarHBondContact N-O 3.29Å; N195-D200 PolarHBondContact O-N 2.74Å; N195-E202 HydrophobicContact CB-CG 4.28Å; N195-E202 WeakPolarHBondContact CB-OE1 3.36Å; N195-E202 VanDerWaalsContact ND2-CD 3.34Å; N195-E202 PolarHBondContact ND2-OE1 2.78Å; N195-E202 PolarHBondContact ND2-OE2 3.46Å
196	A	88.6	Confident	90	Very high	67 Å²	67	69.8 Å²	69.8	55%	0.554	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-21.7	-179.8	0	0	0	0	0	113.9	Y194	Y194-A196 HydrophobicContact CE1-CB 4.18Å
197	E	86.4	Confident	90.2	Very high	179 Å²	179	64.8 Å²	64.8	84%	0.836	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-45	177.5	-60.6	-179	174.7	0	0	111.6	N195	N195-E197 PolarHBondContact O-N 3.08Å; N195-E197 WeakPolarHBondContact OD1-CB 2.97Å; N195-E197 PolarHBondContact OD1-N 3.26Å
198	T	86.5	Confident	90.3	Very high	74 Å²	74	61.5 Å²	61.5	45%	0.454	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-13.6	179.2	58.9	0	0	0	0	112.9	N195 D200 E202	N195-T198 VanDerWaalsContact CB-OG1 3.3Å; N195-T198 WeakPolarHBondContact CB-OG1 3.4Å; N195-T198 PolarHBondContact O-N 2.03Å; N195-T198 PolarHBondContact O-OG1 2.98Å; T198-D200 PolarHBondContact O-N 3.49Å; T198-E202 WeakPolarHBondContact CB-OE1 3.34Å; T198-E202 WeakPolarHBondContact CG2-OE1 3.37Å; T198-E202 PolarHBondContact OG1-OE1 2.74Å
199	K	88.6	Confident	90.2	Very high	146 Å²	146	56.8 Å²	56.8	64%	0.635	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.1	33.1	-171.8	-56.7	-178.6	178.6	-179.4	0	112.7	N195	N195-K199 VanDerWaalsContact O-CA 3.3Å; N195-K199 WeakPolarHBondContact O-CA 3.21Å; N195-K199 PolarHBondContact O-N 2.91Å
200	D	88.7	Confident	90	Very high	21 Å²	21	60.5 Å²	60.5	11%	0.112	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	159.6	-177.1	-169.7	17	0	0	0	110.8	N195 T198 V231 R238	N195-D200 PolarHBondContact N-O 3.29Å; N195-D200 PolarHBondContact O-N 2.74Å; T198-D200 PolarHBondContact O-N 3.49Å; D200-V231 HydrophobicContact CB-CG1 4.16Å; D200-R238 IonicContact OD1-CZ 3.78Å; D200-R238 IonicContact OD1-NH1 2.95Å; D200-R238 PolarHBondContact OD1-NH1 3.24Å; D200-R238 VanDerWaalsContact OD2-CD 3.3Å; D200-R238 WeakPolarHBondContact OD2-CD 3.49Å
201	C	90.8	Very high	89.8	Confident	4 Å²	4	58.8 Å²	58.8	3%	0.027	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	112.1	171.6	-73.3	0	0	0	0	110.2	F193 I219 C222 E223	F193-C201 CarbonylContact O-C 3.59Å; F193-C201 WeakPolarHBondContact O-CA 3.38Å; C201-I219 HydrophobicContact CB-CG1 3.88Å; C201-C222 HydrophobicContact CB-CB 3.69Å; C201-C222 WeakPolarHBondContact CB-SG 3.43Å; C201-C222 WeakPolarHBondContact SG-CB 3.45Å; C201-C222 CovalentContact SG-SG 2.03Å; C201-C222 PolarHBondContact SG-SG 2.95Å; C201-E223 HydrophobicContact CB-CG 4.12Å; C201-E223 PolarHBondContact SG-N 3.09Å; C201-E223 VanDerWaalsContact SG-N 3.35Å
202	E	90.4	Very high	89.6	Confident	60 Å²	60	56.5 Å²	56.5	28%	0.28	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	143.9	-177.3	-69.8	176	-153.4	0	0	111.1	Y192 F193 N195 T198	Y192-E202 CarbonylContact C-O 3.51Å; Y192-E202 VanDerWaalsContact CA-O 3.26Å; Y192-E202 WeakPolarHBondContact CA-O 3.47Å; F193-E202 HydrophobicContact CD1-CB 4.26Å; F193-E202 VanDerWaalsContact CD1-O 3.3Å; F193-E202 WeakPolarHBondContact CD1-O 3.38Å; F193-E202 HydrophobicContact CE1-CB 3.69Å; F193-E202 HydrophobicContact CZ-CB 4.16Å; F193-E202 PolarHBondContact N-O 3.2Å; F193-E202 PolarHBondContact O-N 2.86Å; N195-E202 HydrophobicContact CB-CG 4.28Å; N195-E202 WeakPolarHBondContact CB-OE1 3.36Å; N195-E202 VanDerWaalsContact ND2-CD 3.34Å; N195-E202 PolarHBondContact ND2-OE1 2.78Å; N195-E202 PolarHBondContact ND2-OE2 3.46Å; T198-E202 WeakPolarHBondContact CB-OE1 3.34Å; T198-E202 WeakPolarHBondContact CG2-OE1 3.37Å; T198-E202 PolarHBondContact OG1-OE1 2.74Å
203	R	93	Very high	89.3	Confident	169 Å²	169	55.4 Å²	55.4	64%	0.638	30%	0.295	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.9	142.3	172.2	68.7	-179.9	-69.5	-170.4	1.2	111.3	T190 R191 Y192	T190-R203 HydrophobicContact CG2-CB 4.11Å; T190-R203 PolarHBondContact OG1-NH2 3.27Å; R191-R203 CarbonylContact O-C 3.55Å; R191-R203 WeakPolarHBondContact O-CA 3.36Å; Y192-R203 HydrophobicContact CD1-CB 3.92Å; Y192-R203 HydrophobicContact CE1-CB 3.76Å
204	F	92.6	Very high	89.3	Confident	16 Å²	16	54.9 Å²	54.9	7%	0.07	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	159.4	171	77.6	-71.6	0	0	0	111	A181 V182 R191 F193 Y206 N215	A181-F204 WeakPolarHBondContact O-CE2 3.25Å; V182-F204 HydrophobicContact CG2-CD2 4.28Å; R191-F204 HydrophobicContact CB-CD1 4.04Å; R191-F204 HydrophobicContact CB-CE1 3.49Å; R191-F204 VanDerWaalsContact CB-CE1 3.49Å; R191-F204 HydrophobicContact CB-CZ 3.9Å; R191-F204 PolarHBondContact N-O 3.28Å; R191-F204 WeakPolarHBondContact O-CD1 3.3Å; R191-F204 PolarHBondContact O-N 2.79Å; F193-F204 HydrophobicContact CB-CD1 4.05Å; F193-F204 HydrophobicContact CB-CE1 3.98Å; F193-F204 HydrophobicContact CD1-CB 4.02Å; F193-F204 AromaticContact CD1-CD1 3.69Å; F193-F204 HydrophobicContact CD1-CD1 3.69Å; F193-F204 HydrophobicContact CD1-CE1 4.45Å; F193-F204 HydrophobicContact CD1-CG 4.06Å; F193-F204 HydrophobicContact CE1-CB 4.23Å; F193-F204 HydrophobicContact CG-CD1 4.28Å; F204-Y206 HydrophobicContact CE2-CD2 4.17Å; F204-Y206 HydrophobicContact CE2-CG 4.41Å; F204-Y206 HydrophobicContact CZ-CD2 4.44Å; F204-Y206 PolarHBondContact O-N 3.46Å; F204-N215 HydrophobicContact CZ-CB 4.15Å
205	A	91.5	Very high	89.3	Confident	53 Å²	53	54 Å²	54	44%	0.438	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	103.6	174.6	0	0	0	0	0	108.8	V182 L188	V182-A205 WeakPolarHBondContact CG1-O 3.32Å; L188-A205 HydrophobicContact CD2-CB 4.02Å
206	Y	92.8	Very high	89.3	Confident	26 Å²	26	53.2 Å²	53.2	10%	0.102	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	130.8	174.4	176.9	-128	0	0	0	109.6	A181 V182 L188 V189 R191 F204 G208 C209 G211 N215	A181-Y206 WeakPolarHBondContact O-CD2 3.07Å; V182-Y206 VanDerWaalsContact O-CD2 3.3Å; V182-Y206 WeakPolarHBondContact O-CD2 3.48Å; L188-Y206 CarbonylContact C-O 3.48Å; L188-Y206 WeakPolarHBondContact CA-O 3.4Å; V189-Y206 PolarHBondContact N-O 3.01Å; V189-Y206 PolarHBondContact O-N 2.82Å; R191-Y206 HydrophobicContact CG-CD1 4.02Å; R191-Y206 HydrophobicContact CG-CG 4.12Å; F204-Y206 HydrophobicContact CE2-CD2 4.17Å; F204-Y206 HydrophobicContact CE2-CG 4.41Å; F204-Y206 HydrophobicContact CZ-CD2 4.44Å; F204-Y206 PolarHBondContact O-N 3.46Å; Y206-G208 VanDerWaalsContact CE1-CA 3.43Å; Y206-G208 VanDerWaalsContact CZ-C 3.45Å; Y206-G208 PolarHBondContact O-N 3.07Å; Y206-C209 WeakPolarHBondContact CE2-O 3.12Å; Y206-C209 VanDerWaalsContact CZ-N 3.31Å; Y206-C209 WeakPolarHBondContact OH-CA 3.29Å; Y206-C209 PolarHBondContact OH-N 2.91Å; Y206-C209 PolarHBondContact OH-O 3.43Å; Y206-G211 PolarHBondContact OH-N 3.5Å; Y206-N215 VanDerWaalsContact CD2-ND2 3.25Å; Y206-N215 WeakPolarHBondContact CD2-ND2 2.98Å; Y206-N215 VanDerWaalsContact CE2-ND2 3.3Å; Y206-N215 WeakPolarHBondContact CE2-ND2 3.22Å
207	S	89.5	Confident	89.4	Confident	4 Å²	4	55.6 Å²	55.6	3%	0.028	29%	0.286	C	S	.	.			trans	-72.3	-5	-177.6	73.3	0	0	0	0	114.7	V182 G183 N184 C185 N187 C209	V182-S207 WeakPolarHBondContact O-CB 3.2Å; V182-S207 PolarHBondContact O-N 2.81Å; V182-S207 PolarHBondContact O-OG 2.64Å; G183-S207 WeakPolarHBondContact CA-OG 3.13Å; G183-S207 PolarHBondContact O-OG 3.12Å; N184-S207 PolarHBondContact N-OG 2.75Å; N184-S207 VanDerWaalsContact N-OG 3.12Å; C185-S207 CarbonylContact C-O 3.51Å; C185-S207 VanDerWaalsContact C-O 3.3Å; C185-S207 WeakPolarHBondContact CB-O 3.01Å; C185-S207 PolarHBondContact N-OG 3.32Å; C185-S207 VanDerWaalsContact N-OG 3.1Å; C185-S207 VanDerWaalsContact O-CB 3.32Å; C185-S207 WeakPolarHBondContact O-CB 3.42Å; N187-S207 CarbonylContact C-O 3.15Å; N187-S207 WeakPolarHBondContact CA-O 3.03Å; N187-S207 PolarHBondContact N-O 2.94Å; N187-S207 CarbonylContact O-C 3.58Å; N187-S207 WeakPolarHBondContact O-CA 3.13Å; S207-C209 PolarHBondContact OG-O 3.06Å
208	G	84.3	Confident	89.4	Confident	35 Å²	35	52.1 Å²	52.1	36%	0.361	27%	0.269	S	S	.	.	S	Bend	trans	97.4	-10.7	178	0	0	0	0	0	114.7	N187 Y206	N187-G208 PolarHBondContact O-N 3.31Å; Y206-G208 VanDerWaalsContact CE1-CA 3.43Å; Y206-G208 VanDerWaalsContact CZ-C 3.45Å; Y206-G208 PolarHBondContact O-N 3.07Å
209	C	83.5	Confident	89.4	Confident	32 Å²	32	48.9 Å²	48.9	22%	0.216	25%	0.249	C	C	.	.	S	Bend	trans	-147.4	173.5	175.6	76.8	0	0	0	0	112.1	G183 C185 Y206 S207 G211	G183-C209 WeakPolarHBondContact CA-O 3.41Å; C185-C209 HydrophobicContact CB-CB 3.85Å; C185-C209 WeakPolarHBondContact CB-SG 3.24Å; C185-C209 WeakPolarHBondContact SG-CB 3.23Å; C185-C209 CovalentContact SG-SG 2.01Å; C185-C209 PolarHBondContact SG-SG 2.97Å; Y206-C209 WeakPolarHBondContact CE2-O 3.12Å; Y206-C209 VanDerWaalsContact CZ-N 3.31Å; Y206-C209 WeakPolarHBondContact OH-CA 3.29Å; Y206-C209 PolarHBondContact OH-N 2.91Å; Y206-C209 PolarHBondContact OH-O 3.43Å; S207-C209 PolarHBondContact OG-O 3.06Å; C209-G211 PolarHBondContact O-N 3.15Å
210	Q	82.7	Confident	89.1	Confident	132 Å²	132	47.8 Å²	47.8	62%	0.617	25%	0.247	S	C	*	.	S	Bend	trans	56.2	30.5	176.9	-60.1	-177	-3.8	0	0	114.4	N184	N184-Q210 PolarHBondContact ND2-NE2 3.41Å; N184-Q210 PolarHBondContact ND2-OE1 3Å; N184-Q210 PolarHBondContact OD1-NE2 2.99Å; N184-Q210 PolarHBondContact OD1-OE1 3.43Å
211	G	84.4	Confident	89	Confident	24 Å²	24	51.6 Å²	51.6	25%	0.247	26%	0.264	C	S	.	.			trans	-74.4	173.3	170.9	0	0	0	0	0	112.5	Y206 C209	Y206-G211 PolarHBondContact OH-N 3.5Å; C209-G211 PolarHBondContact O-N 3.15Å
212	N	88.5	Confident	89	Confident	15 Å²	15	51.4 Å²	51.4	8%	0.08	26%	0.262	C	S	.	.			trans	-119.5	-172.6	165	64.6	13.5	0	0	0	108.9	L171 Q178 P179 A181 N214 N215	L171-N212 HydrophobicContact CD1-CB 3.85Å; Q178-N212 VanDerWaalsContact OE1-CB 3.24Å; P179-N212 PolarHBondContact O-ND2 2.75Å; P179-N212 PolarHBondContact O-OD1 3.27Å; A181-N212 HydrophobicContact CB-CB 4.11Å; N212-N214 PolarHBondContact O-N 3.31Å; N212-N214 PolarHBondContact OD1-N 2.8Å; N212-N215 VanDerWaalsContact O-CB 3.22Å; N212-N215 WeakPolarHBondContact O-CB 3.34Å
213	D	90	Very high	89	Confident	28 Å²	28	50.3 Å²	50.3	15%	0.15	26%	0.257	C	S	.	.	S	Bend	trans	-74.5	-15.7	-173.6	-53.2	-47.2	0	0	0	112.3	H85 R167 P175 Q178 N215	H85-D213 IonicContact NE2-OD2 3.6Å; R167-D213 IonicContact CZ-OD1 3.66Å; R167-D213 IonicContact NE-OD1 3.52Å; R167-D213 PolarHBondContact NE-OD1 2.81Å; R167-D213 IonicContact NH2-OD1 2.66Å; R167-D213 PolarHBondContact NH2-OD1 2.7Å; P175-D213 HydrophobicContact CB-CB 3.72Å; P175-D213 HydrophobicContact CG-CB 3.76Å; Q178-D213 PolarHBondContact NE2-OD2 3.31Å; Q178-D213 VanDerWaalsContact NE2-OD2 3.16Å; D213-N215 PolarHBondContact O-N 2.77Å
214	N	94.9	Very high	88.7	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.264	C	S	.	.	S	Bend	trans	-77.7	51.7	171	-154.6	5.5	0	0	0	111.7	P175 Q178 F193 Y194 N212 F216	P175-N214 WeakPolarHBondContact O-CB 3.33Å; Q178-N214 HydrophobicContact CB-CB 4.13Å; Q178-N214 PolarHBondContact O-ND2 2.89Å; F193-N214 WeakPolarHBondContact CA-OD1 3.34Å; F193-N214 HydrophobicContact CB-CB 4.44Å; F193-N214 WeakPolarHBondContact CB-O 3.34Å; Y194-N214 PolarHBondContact N-OD1 3.34Å; Y194-N214 PolarHBondContact O-ND2 2.82Å; N212-N214 PolarHBondContact O-N 3.31Å; N212-N214 PolarHBondContact OD1-N 2.8Å; N214-F216 WeakPolarHBondContact OD1-CE2 3.15Å
215	N	94.3	Very high	88.4	Confident	23 Å²	23	56.7 Å²	56.7	12%	0.123	29%	0.286	C	S	.	.			trans	-146.3	85.9	-173.4	-176.6	-18.3	0	0	0	109.5	R191 Y192 F204 Y206 N212 D213	R191-N215 VanDerWaalsContact CB-OD1 3.24Å; R191-N215 WeakPolarHBondContact CB-OD1 3.44Å; R191-N215 WeakPolarHBondContact CD-OD1 3.5Å; R191-N215 WeakPolarHBondContact CG-OD1 3.44Å; R191-N215 PolarHBondContact NH1-OD1 3.43Å; Y192-N215 WeakPolarHBondContact O-CA 3.48Å; F204-N215 HydrophobicContact CZ-CB 4.15Å; Y206-N215 VanDerWaalsContact CD2-ND2 3.25Å; Y206-N215 WeakPolarHBondContact CD2-ND2 2.98Å; Y206-N215 VanDerWaalsContact CE2-ND2 3.3Å; Y206-N215 WeakPolarHBondContact CE2-ND2 3.22Å; N212-N215 VanDerWaalsContact O-CB 3.22Å; N212-N215 WeakPolarHBondContact O-CB 3.34Å; D213-N215 PolarHBondContact O-N 2.77Å
216	F	93.8	Very high	88.4	Confident	10 Å²	10	54.9 Å²	54.9	4%	0.044	27%	0.27	C	S	.	.	B	Isolated β-bridge	trans	-95.9	143.9	-176.5	-55.5	-83.5	0	0	0	110.9	P175 R191 Y192 N214 E221 C222 R225	P175-F216 HydrophobicContact CB-CZ 4.28Å; R191-F216 CarbonylContact C-O 3.58Å; R191-F216 WeakPolarHBondContact CA-O 3.44Å; R191-F216 WeakPolarHBondContact CD-O 3.36Å; Y192-F216 PolarHBondContact N-O 3.25Å; Y192-F216 WeakPolarHBondContact O-CD2 3.24Å; Y192-F216 PolarHBondContact O-N 2.8Å; N214-F216 WeakPolarHBondContact OD1-CE2 3.15Å; F216-E221 HydrophobicContact CD1-CB 4.32Å; F216-E221 HydrophobicContact CD1-CG 3.86Å; F216-C222 HydrophobicContact CB-CB 3.87Å; F216-C222 HydrophobicContact CD1-CB 4.32Å; F216-C222 HydrophobicContact CD2-CB 3.33Å; F216-C222 VanDerWaalsContact CD2-SG 3.52Å; F216-C222 HydrophobicContact CE2-CB 3.89Å; F216-C222 HydrophobicContact CG-CB 3.57Å; F216-R225 HydrophobicContact CE1-CB 3.89Å; F216-R225 HydrophobicContact CE1-CG 4Å; F216-R225 HydrophobicContact CZ-CB 4.15Å; F216-R225 HydrophobicContact CZ-CG 4.18Å
217	E	89.4	Confident	88.1	Confident	116 Å²	116	59.8 Å²	59.8	54%	0.542	30%	0.298	S	S	.	.	S	Bend	trans	-74.5	-37.4	176.4	-173.9	168.5	-170	0	0	111.5	Y192	Y192-E217 WeakPolarHBondContact CE2-O 3.26Å
218	H	86.9	Confident	87.7	Confident	106 Å²	106	60.6 Å²	60.6	49%	0.491	30%	0.303	S	S	.	.	S	Bend	trans	-121.6	147.6	-178.6	-59.7	-61.8	0	0	0	111.3	E220 E221 C222	H218-E220 VanDerWaalsContact C-N 3.31Å; H218-E220 PolarHBondContact O-N 3.1Å; H218-E221 HydrophobicContact CB-CB 4.49Å; H218-E221 WeakPolarHBondContact O-CB 3.04Å; H218-E221 PolarHBondContact O-N 3.22Å; H218-C222 PolarHBondContact O-N 2.67Å
219	I	85.8	Confident	87	Confident	7 Å²	7	64.1 Å²	64.1	4%	0.036	32%	0.317	C	S	.	.	H	α-helix	trans	-68.2	-35.5	-178.1	-160.8	179.4	0	0	0	111.3	Y192 C201 E221 C222 E223 V235	Y192-I219 HydrophobicContact CD1-CB 3.65Å; Y192-I219 HydrophobicContact CD1-CD1 4.07Å; Y192-I219 HydrophobicContact CD1-CG1 3.64Å; Y192-I219 HydrophobicContact CD2-CB 4.33Å; Y192-I219 HydrophobicContact CE1-CB 3.62Å; Y192-I219 HydrophobicContact CE1-CD1 4.01Å; Y192-I219 HydrophobicContact CE1-CG1 3.91Å; Y192-I219 HydrophobicContact CE2-CB 4.33Å; Y192-I219 HydrophobicContact CG-CB 4.01Å; Y192-I219 HydrophobicContact CG-CG1 4.25Å; C201-I219 HydrophobicContact CB-CG1 3.88Å; I219-E221 PolarHBondContact O-N 2.71Å; I219-C222 WeakPolarHBondContact O-CB 3.38Å; I219-C222 PolarHBondContact O-N 2.88Å; I219-C222 VanDerWaalsContact O-N 3.12Å; I219-E223 WeakPolarHBondContact CD1-OE1 3.03Å; I219-E223 HydrophobicContact CG1-CG 4.4Å; I219-E223 WeakPolarHBondContact CG1-OE1 3.25Å; I219-E223 WeakPolarHBondContact O-CG 3.15Å; I219-E223 PolarHBondContact O-N 3.16Å; I219-V235 HydrophobicContact CD1-CG1 4.47Å; I219-V235 HydrophobicContact CD1-CG2 3.67Å; I219-V235 HydrophobicContact CG2-CG2 4.25Å
220	E	82.7	Confident	86.3	Confident	123 Å²	123	69 Å²	69	58%	0.575	34%	0.341	S	S	*	.	H	α-helix	trans	-63.1	-34.4	179.2	-60.1	77.9	-171.3	0	0	111.2	H218 K224	H218-E220 VanDerWaalsContact C-N 3.31Å; H218-E220 PolarHBondContact O-N 3.1Å; E220-K224 WeakPolarHBondContact O-CB 3.48Å; E220-K224 PolarHBondContact O-N 3.03Å
221	E	87.9	Confident	85.9	Confident	101 Å²	101	64.7 Å²	64.7	47%	0.472	32%	0.323	S	S	.	.	H	α-helix	trans	-66.1	-47	174.4	-169.5	-169.8	171.8	0	0	110.8	F216 H218 I219 R225	F216-E221 HydrophobicContact CD1-CB 4.32Å; F216-E221 HydrophobicContact CD1-CG 3.86Å; H218-E221 HydrophobicContact CB-CB 4.49Å; H218-E221 WeakPolarHBondContact O-CB 3.04Å; H218-E221 PolarHBondContact O-N 3.22Å; I219-E221 PolarHBondContact O-N 2.71Å; E221-R225 WeakPolarHBondContact O-CB 2.93Å; E221-R225 PolarHBondContact O-N 2.76Å
222	C	90.8	Very high	85.4	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-59.1	-50.4	175.4	-179.7	0	0	0	0	111.2	Y194 C201 F216 H218 I219 K224 R225 C226	Y194-C222 PolarHBondContact N-SG 2.87Å; C201-C222 HydrophobicContact CB-CB 3.69Å; C201-C222 WeakPolarHBondContact CB-SG 3.43Å; C201-C222 WeakPolarHBondContact SG-CB 3.45Å; C201-C222 CovalentContact SG-SG 2.03Å; C201-C222 PolarHBondContact SG-SG 2.95Å; F216-C222 HydrophobicContact CB-CB 3.87Å; F216-C222 HydrophobicContact CD1-CB 4.32Å; F216-C222 HydrophobicContact CD2-CB 3.33Å; F216-C222 VanDerWaalsContact CD2-SG 3.52Å; F216-C222 HydrophobicContact CE2-CB 3.89Å; F216-C222 HydrophobicContact CG-CB 3.57Å; H218-C222 PolarHBondContact O-N 2.67Å; I219-C222 WeakPolarHBondContact O-CB 3.38Å; I219-C222 PolarHBondContact O-N 2.88Å; I219-C222 VanDerWaalsContact O-N 3.12Å; C222-K224 PolarHBondContact O-N 3.04Å; C222-R225 PolarHBondContact O-N 3.5Å; C222-C226 WeakPolarHBondContact O-CB 3.31Å; C222-C226 PolarHBondContact O-N 3.43Å; C222-C226 PolarHBondContact O-SG 3.32Å
223	E	89.1	Confident	84.4	Confident	37 Å²	37	67.6 Å²	67.6	17%	0.173	34%	0.341	C	S	.	.	H	α-helix	trans	-62.4	-44.9	-177.5	-73	170.2	-160.9	0	0	112.1	C201 I219 N227 V228 R238	C201-E223 HydrophobicContact CB-CG 4.12Å; C201-E223 PolarHBondContact SG-N 3.09Å; C201-E223 VanDerWaalsContact SG-N 3.35Å; I219-E223 WeakPolarHBondContact CD1-OE1 3.03Å; I219-E223 HydrophobicContact CG1-CG 4.4Å; I219-E223 WeakPolarHBondContact CG1-OE1 3.25Å; I219-E223 WeakPolarHBondContact O-CG 3.15Å; I219-E223 PolarHBondContact O-N 3.16Å; E223-N227 WeakPolarHBondContact O-CA 3.42Å; E223-N227 PolarHBondContact O-N 2.04Å; E223-V228 HydrophobicContact CB-CB 4.09Å; E223-V228 HydrophobicContact CB-CG2 4.39Å; E223-V228 HydrophobicContact CG-CB 3.98Å; E223-V228 HydrophobicContact CG-CG1 4.46Å; E223-V228 HydrophobicContact CG-CG2 4.21Å; E223-V228 PolarHBondContact O-N 2.85Å; E223-R238 VanDerWaalsContact CD-NH2 3.35Å; E223-R238 IonicContact OE1-CZ 2.67Å; E223-R238 IonicContact OE1-NH1 3.71Å; E223-R238 PolarHBondContact OE1-NH1 2.87Å; E223-R238 IonicContact OE1-NH2 3.78Å; E223-R238 PolarHBondContact OE1-NH2 3.43Å; E223-R238 IonicContact OE2-NH2 2.63Å
224	K	86.4	Confident	83.9	Confident	177 Å²	177	68.8 Å²	68.8	77%	0.77	35%	0.347	S	S	*	.	H	α-helix	trans	-64.7	-42.5	176.5	-177.4	-179.2	179	-177.1	0	111.1	E220 C222 N227	E220-K224 WeakPolarHBondContact O-CB 3.48Å; E220-K224 PolarHBondContact O-N 3.03Å; C222-K224 PolarHBondContact O-N 3.04Å; K224-N227 PolarHBondContact O-OD1 2.82Å
225	R	88	Confident	83.2	Confident	141 Å²	141	71.3 Å²	71.3	53%	0.532	36%	0.363	S	S	.	.	H	α-helix	trans	-73.7	-33	-176.6	-169.1	62.9	177.9	123.7	-5.3	112.3	F216 E221 C222	F216-R225 HydrophobicContact CE1-CB 3.89Å; F216-R225 HydrophobicContact CE1-CG 4Å; F216-R225 HydrophobicContact CZ-CB 4.15Å; F216-R225 HydrophobicContact CZ-CG 4.18Å; E221-R225 WeakPolarHBondContact O-CB 2.93Å; E221-R225 PolarHBondContact O-N 2.76Å; C222-R225 PolarHBondContact O-N 3.5Å
226	C	90.3	Very high	82.9	Confident	16 Å²	16	70.6 Å²	70.6	11%	0.108	36%	0.36	C	S	.	.	H	α-helix	trans	-101.4	6	-177.1	-58.6	0	0	0	0	114.1	C176 Y194 C222 V228	C176-C226 HydrophobicContact CB-CB 3.74Å; C176-C226 WeakPolarHBondContact CB-SG 3.3Å; C176-C226 WeakPolarHBondContact SG-CA 3.04Å; C176-C226 WeakPolarHBondContact SG-CB 3.4Å; C176-C226 CovalentContact SG-SG 2.03Å; C176-C226 PolarHBondContact SG-SG 2.82Å; Y194-C226 WeakPolarHBondContact CB-SG 3.3Å; Y194-C226 HydrophobicContact CD2-CB 3.46Å; Y194-C226 VanDerWaalsContact CD2-CB 3.46Å; Y194-C226 HydrophobicContact CE2-CB 4.09Å; Y194-C226 HydrophobicContact CG-CB 3.79Å; C222-C226 WeakPolarHBondContact O-CB 3.31Å; C222-C226 PolarHBondContact O-N 3.43Å; C222-C226 PolarHBondContact O-SG 3.32Å; C226-V228 VanDerWaalsContact C-N 3.35Å; C226-V228 HydrophobicContact CB-CG2 4.43Å; C226-V228 PolarHBondContact O-N 2.84Å
227	N	87.2	Confident	82.7	Confident	128 Å²	128	70.2 Å²	70.2	68%	0.684	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.7	45.4	178	-65.3	-24.6	0	0	0	113.8	E223 K224 T229	E223-N227 WeakPolarHBondContact O-CA 3.42Å; E223-N227 PolarHBondContact O-N 2.04Å; K224-N227 PolarHBondContact O-OD1 2.82Å; N227-T229 PolarHBondContact O-N 2.63Å
228	V	81.6	Confident	82.6	Confident	22 Å²	22	66.8 Å²	66.8	13%	0.133	34%	0.34	C	S	.	.			trans	-71.5	115.5	174.2	-174.5	0	0	0	0	108.5	Y194 E223 C226 V231	Y194-V228 HydrophobicContact CD2-CG2 3.89Å; Y194-V228 HydrophobicContact CE2-CG2 3.95Å; E223-V228 HydrophobicContact CB-CB 4.09Å; E223-V228 HydrophobicContact CB-CG2 4.39Å; E223-V228 HydrophobicContact CG-CB 3.98Å; E223-V228 HydrophobicContact CG-CG1 4.46Å; E223-V228 HydrophobicContact CG-CG2 4.21Å; E223-V228 PolarHBondContact O-N 2.85Å; C226-V228 VanDerWaalsContact C-N 3.35Å; C226-V228 HydrophobicContact CB-CG2 4.43Å; C226-V228 PolarHBondContact O-N 2.84Å; V228-V231 HydrophobicContact CG1-CB 4.22Å; V228-V231 HydrophobicContact CG1-CG1 3.86Å; V228-V231 HydrophobicContact CG1-CG2 3.37Å
229	T	69.3	Low	82.7	Confident	108 Å²	108	64.1 Å²	64.1	66%	0.663	33%	0.328	S	S	*	.			trans	-125.5	-19.9	-172.3	44.2	0	0	0	0	114.3	N227	N227-T229 PolarHBondContact O-N 2.63Å
230	D	68.9	Low	82.9	Confident	136 Å²	136	68.7 Å²	68.7	73%	0.727	36%	0.358	S	S	*	.	S	Bend	trans	-105.8	15.5	-171.8	-74.4	-38.7	0	0	0	114.5
231	V	74.2	Confident	83.4	Confident	40 Å²	40	68.1 Å²	68.1	24%	0.242	35%	0.354	C	S	.	.	S	Bend	trans	-113.3	151.3	179.7	-53.8	0	0	0	0	111.4	D200 V228 S233 R238	D200-V231 HydrophobicContact CB-CG1 4.16Å; V228-V231 HydrophobicContact CG1-CB 4.22Å; V228-V231 HydrophobicContact CG1-CG1 3.86Å; V228-V231 HydrophobicContact CG1-CG2 3.37Å; V231-S233 PolarHBondContact O-N 2.91Å; V231-R238 VanDerWaalsContact CG2-CZ 3.47Å
232	P	72.5	Confident	83.7	Confident	17 Å²	17	66.8 Å²	66.8	11%	0.11	35%	0.347	C	S	.	.			trans	-55.4	134.4	172.8	-25.4	33.9	0	0	0	111.8	N234 C237 R238 Y255	P232-N234 PolarHBondContact O-N 2.79Å; P232-C237 HydrophobicContact CB-CB 3.64Å; P232-C237 HydrophobicContact CG-CB 4.05Å; P232-R238 VanDerWaalsContact O-CZ 3.29Å; P232-R238 PolarHBondContact O-NE 2.88Å; P232-R238 PolarHBondContact O-NH2 3.44Å; P232-Y255 HydrophobicContact CB-CE1 4.46Å; P232-Y255 HydrophobicContact CG-CD1 3.75Å; P232-Y255 HydrophobicContact CG-CE1 3.19Å
233	S	68.8	Low	83.7	Confident	83 Å²	83	69.4 Å²	69.4	58%	0.58	36%	0.362	S	S	*	.	S	Bend	trans	-60.1	-35.5	178	46.6	0	0	0	0	112.5	V231 V235 R238	V231-S233 PolarHBondContact O-N 2.91Å; S233-V235 PolarHBondContact O-N 3.39Å; S233-R238 PolarHBondContact O-NH2 2.75Å
234	N	79.4	Confident	83.8	Confident	53 Å²	53	68.8 Å²	68.8	28%	0.283	37%	0.366	S	S	.	.	S	Bend	trans	-80.6	120.1	176.7	-170	-31.2	0	0	0	111.6	P232 A236 C237 K286	P232-N234 PolarHBondContact O-N 2.79Å; N234-A236 PolarHBondContact O-N 3.36Å; N234-A236 WeakPolarHBondContact OD1-CB 3.32Å; N234-A236 PolarHBondContact OD1-N 3.23Å; N234-C237 WeakPolarHBondContact O-CB 3.32Å; N234-C237 PolarHBondContact O-N 2.99Å; N234-K286 WeakPolarHBondContact CB-O 3.35Å
235	V	80.6	Confident	83.7	Confident	54 Å²	54	65.9 Å²	65.9	33%	0.327	35%	0.353	S	S	.	.	H	α-helix	trans	-57	-33.2	-180	-176.5	0	0	0	0	112.7	I219 S233 C237 R238	I219-V235 HydrophobicContact CD1-CG1 4.47Å; I219-V235 HydrophobicContact CD1-CG2 3.67Å; I219-V235 HydrophobicContact CG2-CG2 4.25Å; S233-V235 PolarHBondContact O-N 3.39Å; V235-C237 PolarHBondContact O-N 2.92Å; V235-R238 PolarHBondContact O-N 2.82Å; V235-R238 VanDerWaalsContact O-N 3.11Å
236	A	87	Confident	83.2	Confident	8 Å²	8	66.5 Å²	66.5	7%	0.066	36%	0.362	C	S	.	.	H	α-helix	trans	-55.5	-43.1	176.1	0	0	0	0	0	111.2	N234 R238 Q239 E274 N275 F277	N234-A236 PolarHBondContact O-N 3.36Å; N234-A236 WeakPolarHBondContact OD1-CB 3.32Å; N234-A236 PolarHBondContact OD1-N 3.23Å; A236-R238 PolarHBondContact O-N 2.92Å; A236-Q239 WeakPolarHBondContact O-CB 3.25Å; A236-Q239 PolarHBondContact O-N 2Å; A236-E274 HydrophobicContact CB-CB 3.49Å; A236-E274 VanDerWaalsContact CB-CB 3.49Å; A236-N275 WeakPolarHBondContact O-CB 3.19Å; A236-N275 PolarHBondContact O-N 2.71Å; A236-F277 HydrophobicContact CB-CZ 4.28Å
237	C	90.5	Very high	82.8	Confident	2 Å²	2	70.5 Å²	70.5	1%	0.014	39%	0.386	C	S	.	.	H	α-helix	trans	-70.2	-17.6	-177.2	-51.9	0	0	0	0	113.3	P232 N234 V235 Q239 Y255 K286 C287	P232-C237 HydrophobicContact CB-CB 3.64Å; P232-C237 HydrophobicContact CG-CB 4.05Å; N234-C237 WeakPolarHBondContact O-CB 3.32Å; N234-C237 PolarHBondContact O-N 2.99Å; V235-C237 PolarHBondContact O-N 2.92Å; C237-Q239 VanDerWaalsContact C-N 3.33Å; C237-Y255 HydrophobicContact CB-CD1 4.18Å; C237-Y255 HydrophobicContact CB-CG 4.26Å; C237-Y255 VanDerWaalsContact O-CD1 3.29Å; C237-Y255 WeakPolarHBondContact O-CD1 3.29Å; C237-K286 VanDerWaalsContact SG-C 3.56Å; C237-K286 PolarHBondContact SG-O 2.89Å; C237-K286 VanDerWaalsContact SG-O 3.41Å; C237-C287 HydrophobicContact CB-CB 3.54Å; C237-C287 WeakPolarHBondContact CB-SG 2.99Å; C237-C287 WeakPolarHBondContact SG-CA 3.47Å; C237-C287 WeakPolarHBondContact SG-CB 2.91Å; C237-C287 CovalentContact SG-SG 2.01Å; C237-C287 PolarHBondContact SG-SG 2.8Å
238	R	87	Confident	82.4	Confident	43 Å²	43	67.7 Å²	67.7	16%	0.162	38%	0.377	C	S	.	.	H	α-helix	trans	-80.6	-18.5	177.4	-52.6	-171	-164.9	169	10.1	112.6	D200 E223 V231 P232 S233 V235 A236	D200-R238 IonicContact OD1-CZ 3.78Å; D200-R238 IonicContact OD1-NH1 2.95Å; D200-R238 PolarHBondContact OD1-NH1 3.24Å; D200-R238 VanDerWaalsContact OD2-CD 3.3Å; D200-R238 WeakPolarHBondContact OD2-CD 3.49Å; E223-R238 VanDerWaalsContact CD-NH2 3.35Å; E223-R238 IonicContact OE1-CZ 2.67Å; E223-R238 IonicContact OE1-NH1 3.71Å; E223-R238 PolarHBondContact OE1-NH1 2.87Å; E223-R238 IonicContact OE1-NH2 3.78Å; E223-R238 PolarHBondContact OE1-NH2 3.43Å; E223-R238 IonicContact OE2-NH2 2.63Å; V231-R238 VanDerWaalsContact CG2-CZ 3.47Å; P232-R238 VanDerWaalsContact O-CZ 3.29Å; P232-R238 PolarHBondContact O-NE 2.88Å; P232-R238 PolarHBondContact O-NH2 3.44Å; S233-R238 PolarHBondContact O-NH2 2.75Å; V235-R238 PolarHBondContact O-N 2.82Å; V235-R238 VanDerWaalsContact O-N 3.11Å; A236-R238 PolarHBondContact O-N 2.92Å
239	Q	88.4	Confident	82.7	Confident	51 Å²	51	70.8 Å²	70.8	24%	0.238	40%	0.397	C	S	.	.	S	Bend	trans	-71.3	148.8	179.9	-57.9	171.3	4.1	0	0	110	A236 C237 N273 E274 N275	A236-Q239 WeakPolarHBondContact O-CB 3.25Å; A236-Q239 PolarHBondContact O-N 2Å; C237-Q239 VanDerWaalsContact C-N 3.33Å; Q239-N273 VanDerWaalsContact OE1-CB 3.23Å; Q239-E274 PolarHBondContact NE2-OE2 2.74Å; Q239-N275 HydrophobicContact CB-CB 4.13Å; Q239-N275 WeakPolarHBondContact O-CB 3.25Å; Q239-N275 PolarHBondContact O-ND2 2.88Å
240	P	90.4	Very high	83.8	Confident	102 Å²	102	68.5 Å²	68.5	66%	0.662	38%	0.383	S	S	*	.	P	Polyproline II helix	trans	-69	166.8	179.1	29.8	-36.5	0	0	0	111.5	K242 N273	P240-K242 PolarHBondContact O-N 3.04Å; P240-N273 PolarHBondContact O-ND2 3.36Å; P240-N273 PolarHBondContact O-OD1 3.41Å
241	K	93.4	Very high	84.9	Confident	111 Å²	111	66.8 Å²	66.8	48%	0.483	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-57.7	122.6	166.5	-175.2	177.2	70.1	-175.5	0	110.5	F254 F265	K241-F254 HydrophobicContact CB-CD1 4.33Å; K241-F254 HydrophobicContact CB-CD2 3.62Å; K241-F254 HydrophobicContact CB-CE1 4.39Å; K241-F254 HydrophobicContact CB-CE2 3.67Å; K241-F254 HydrophobicContact CB-CG 3.98Å; K241-F254 HydrophobicContact CB-CZ 4.08Å; K241-F254 HydrophobicContact CD-CD1 3.81Å; K241-F254 HydrophobicContact CD-CD2 4.5Å; K241-F254 HydrophobicContact CD-CE1 3.5Å; K241-F254 VanDerWaalsContact CD-CE1 3.5Å; K241-F254 HydrophobicContact CD-CE2 4.23Å; K241-F254 HydrophobicContact CD-CG 4.32Å; K241-F254 HydrophobicContact CD-CZ 3.74Å; K241-F254 HydrophobicContact CG-CD1 3.93Å; K241-F254 HydrophobicContact CG-CD2 4.13Å; K241-F254 HydrophobicContact CG-CE1 4.08Å; K241-F254 HydrophobicContact CG-CE2 4.26Å; K241-F254 HydrophobicContact CG-CG 3.97Å; K241-F254 HydrophobicContact CG-CZ 4.25Å; K241-F265 HydrophobicContact CD-CB 3.94Å; K241-F265 HydrophobicContact CD-CD2 4.19Å; K241-F265 HydrophobicContact CD-CG 4.15Å; K241-F265 HydrophobicContact CG-CD2 3.98Å; K241-F265 HydrophobicContact CG-CE2 4.38Å; K241-F265 HydrophobicContact CG-CG 4.22Å
242	K	94	Very high	85.9	Confident	74 Å²	74	67.7 Å²	67.7	32%	0.322	37%	0.37	S	S	.	.			trans	-121.2	103.9	172.8	-166.7	173.1	179.1	-148.1	0	111.2	P240 G244 D271 G272 N273	P240-K242 PolarHBondContact O-N 3.04Å; K242-G244 PolarHBondContact O-N 2.73Å; K242-D271 WeakPolarHBondContact CD-O 3.06Å; K242-D271 WeakPolarHBondContact CE-O 3.4Å; K242-D271 PolarHBondContact NZ-O 3.33Å; K242-D271 IonicContact NZ-OD1 2.78Å; K242-D271 PolarHBondContact NZ-OD1 3.2Å; K242-G272 PolarHBondContact NZ-O 2.89Å; K242-N273 HydrophobicContact CB-CB 4.17Å; K242-N273 WeakPolarHBondContact CB-ND2 3.36Å; K242-N273 HydrophobicContact CD-CB 4.07Å
243	V	91.7	Very high	87	Confident	54 Å²	54	68.8 Å²	68.8	33%	0.327	37%	0.372	S	S	.	.			trans	-61.3	-29.9	178.2	175.7	0	0	0	0	111.7	F265 F267 G268	V243-F265 HydrophobicContact CG2-CD2 4.47Å; V243-F267 WeakPolarHBondContact O-CD2 3.42Å; V243-G268 PolarHBondContact O-N 2.95Å
244	G	89.3	Confident	88.3	Confident	24 Å²	24	65.4 Å²	65.4	25%	0.247	35%	0.347	C	S	.	.			trans	69.4	-169.1	-173.9	0	0	0	0	0	112.4	K242 Y270 D271	K242-G244 PolarHBondContact O-N 2.73Å; G244-Y270 VanDerWaalsContact CA-O 3.3Å; G244-Y270 WeakPolarHBondContact CA-O 3.18Å; G244-D271 WeakPolarHBondContact CA-O 3.07Å
245	K	86.2	Confident	88.9	Confident	116 Å²	116	64 Å²	64	50%	0.504	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	130.2	-179.3	-70.2	-179.5	-176.4	179	0	110.3	V247 G268 Y270 D271	K245-V247 PolarHBondContact O-N 3.27Å; K245-V247 VanDerWaalsContact O-N 3.1Å; K245-G268 CarbonylContact O-C 3.5Å; K245-G268 WeakPolarHBondContact O-CA 3.15Å; K245-Y270 HydrophobicContact CB-CD1 4.37Å; K245-Y270 HydrophobicContact CB-CE1 3.58Å; K245-Y270 HydrophobicContact CB-CE2 3.86Å; K245-Y270 WeakPolarHBondContact CB-OH 3.33Å; K245-Y270 HydrophobicContact CD-CE2 3.76Å; K245-Y270 WeakPolarHBondContact CD-OH 3.49Å; K245-Y270 HydrophobicContact CG-CE2 4.32Å; K245-Y270 PolarHBondContact N-O 3.13Å; K245-Y270 VanDerWaalsContact N-O 3.15Å; K245-Y270 WeakPolarHBondContact O-CE1 3.35Å; K245-D271 HydrophobicContact CG-CB 4.46Å
246	Q	77	Confident	89.4	Confident	154 Å²	154	63 Å²	63	72%	0.72	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.3	87.9	-170.8	-64.8	-175.3	1.8	0	0	112.8
247	V	81.4	Confident	89.2	Confident	101 Å²	101	66.7 Å²	66.7	61%	0.612	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.5	-32.6	171.4	169.8	0	0	0	0	111.6	K245 G268 Y270	K245-V247 PolarHBondContact O-N 3.27Å; K245-V247 VanDerWaalsContact O-N 3.1Å; V247-G268 PolarHBondContact N-O 2.87Å; V247-Y270 HydrophobicContact CB-CD1 4.3Å; V247-Y270 HydrophobicContact CB-CE1 3.73Å; V247-Y270 HydrophobicContact CG2-CD1 4.41Å; V247-Y270 HydrophobicContact CG2-CE1 3.4Å
248	S	79.4	Confident	88.8	Confident	69 Å²	69	75.8 Å²	75.8	48%	0.483	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	89.5	175.6	-55.8	0	0	0	0	109	V250 G268	S248-V250 WeakPolarHBondContact O-CG2 3.44Å; S248-V250 PolarHBondContact O-N 3.28Å; S248-G268 CarbonylContact C-O 3.58Å; S248-G268 PolarHBondContact N-O 3.46Å; S248-G268 CarbonylContact O-C 3.24Å
249	P	87	Confident	88.8	Confident	87 Å²	87	77.3 Å²	77.3	57%	0.565	41%	0.409	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.5	123.8	179.6	-23.1	34	0	0	0	111.3	F267	P249-F267 CarbonylContact C-O 2.83Å; P249-F267 VanDerWaalsContact CA-O 3.29Å; P249-F267 WeakPolarHBondContact CA-O 3.26Å
250	V	91.8	Very high	88.5	Confident	60 Å²	60	81.2 Å²	81.2	36%	0.364	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	135.8	175.7	-174.7	0	0	0	0	108.8	S248 R252 F267	S248-V250 WeakPolarHBondContact O-CG2 3.44Å; S248-V250 PolarHBondContact O-N 3.28Å; V250-R252 PolarHBondContact O-N 2.76Å; V250-F267 PolarHBondContact N-O 2.75Å; V250-F267 PolarHBondContact O-N 3.49Å
251	E	93.8	Very high	88.3	Confident	100 Å²	100	80 Å²	80	47%	0.467	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	129.4	173.8	-67.3	-57.2	137	0	0	111.1	Q264	E251-Q264 WeakPolarHBondContact OE2-CG 3.35Å; E251-Q264 PolarHBondContact OE2-NE2 2.84Å
252	R	95.4	Very high	88.2	Confident	59 Å²	59	75 Å²	75	22%	0.223	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	171.6	-175	-67.4	-65.6	-165.4	-137.5	-1.2	109.9	V250 Q264 F265 F267 N276 F277	V250-R252 PolarHBondContact O-N 2.76Å; R252-Q264 CarbonylContact O-C 3.39Å; R252-Q264 WeakPolarHBondContact O-CA 3.36Å; R252-F265 HydrophobicContact CB-CD1 3.91Å; R252-F265 HydrophobicContact CB-CE1 3.42Å; R252-F265 VanDerWaalsContact CB-CE1 3.42Å; R252-F265 HydrophobicContact CB-CZ 3.91Å; R252-F265 PolarHBondContact N-O 3.31Å; R252-F265 PolarHBondContact O-N 2.8Å; R252-F265 VanDerWaalsContact O-O 3.08Å; R252-F267 HydrophobicContact CB-CB 4.07Å; R252-F267 HydrophobicContact CG-CB 3.52Å; R252-F267 HydrophobicContact CG-CD1 4.34Å; R252-F267 HydrophobicContact CG-CG 4.28Å; R252-N276 WeakPolarHBondContact CB-OD1 3.49Å; R252-N276 WeakPolarHBondContact CD-OD1 3.15Å; R252-N276 WeakPolarHBondContact CG-OD1 3.44Å; R252-N276 PolarHBondContact NE-OD1 2.78Å; R252-F277 WeakPolarHBondContact CA-O 3.43Å; R252-F277 WeakPolarHBondContact CD-O 3.44Å
253	Y	95	Very high	88.2	Confident	40 Å²	40	74.4 Å²	74.4	16%	0.157	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	145.8	176.7	-65.3	-97.4	0	0	0	110.4	E263 Q264 N276 F277 Q280	Y253-E263 CarbonylContact C-O 3.52Å; Y253-E263 VanDerWaalsContact CA-O 3.31Å; Y253-E263 WeakPolarHBondContact CA-O 3.33Å; Y253-Q264 HydrophobicContact CD1-CB 4.1Å; Y253-Q264 HydrophobicContact CE1-CB 3.84Å; Y253-Q264 HydrophobicContact CE1-CG 4.23Å; Y253-N276 WeakPolarHBondContact O-CA 3.35Å; Y253-F277 PolarHBondContact N-O 3.48Å; Y253-F277 WeakPolarHBondContact O-CD2 3.2Å; Y253-F277 PolarHBondContact O-N 3.39Å; Y253-Q280 HydrophobicContact CD1-CB 3.78Å; Y253-Q280 HydrophobicContact CD1-CG 4.11Å; Y253-Q280 HydrophobicContact CD2-CB 4.45Å; Y253-Q280 VanDerWaalsContact CD2-N 3.26Å; Y253-Q280 HydrophobicContact CE1-CB 3.55Å; Y253-Q280 HydrophobicContact CE1-CG 4.03Å; Y253-Q280 HydrophobicContact CE2-CB 4.27Å; Y253-Q280 HydrophobicContact CG-CB 4.22Å
254	F	95.2	Very high	88.3	Confident	12 Å²	12	76.2 Å²	76.2	5%	0.053	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	147.8	172.5	79.5	-75.4	0	0	0	109	K241 N256 C262 E263 F265 N275	K241-F254 HydrophobicContact CB-CD1 4.33Å; K241-F254 HydrophobicContact CB-CD2 3.62Å; K241-F254 HydrophobicContact CB-CE1 4.39Å; K241-F254 HydrophobicContact CB-CE2 3.67Å; K241-F254 HydrophobicContact CB-CG 3.98Å; K241-F254 HydrophobicContact CB-CZ 4.08Å; K241-F254 HydrophobicContact CD-CD1 3.81Å; K241-F254 HydrophobicContact CD-CD2 4.5Å; K241-F254 HydrophobicContact CD-CE1 3.5Å; K241-F254 VanDerWaalsContact CD-CE1 3.5Å; K241-F254 HydrophobicContact CD-CE2 4.23Å; K241-F254 HydrophobicContact CD-CG 4.32Å; K241-F254 HydrophobicContact CD-CZ 3.74Å; K241-F254 HydrophobicContact CG-CD1 3.93Å; K241-F254 HydrophobicContact CG-CD2 4.13Å; K241-F254 HydrophobicContact CG-CE1 4.08Å; K241-F254 HydrophobicContact CG-CE2 4.26Å; K241-F254 HydrophobicContact CG-CG 3.97Å; K241-F254 HydrophobicContact CG-CZ 4.25Å; F254-N256 HydrophobicContact CD2-CB 4.47Å; F254-N256 HydrophobicContact CE2-CB 3.64Å; F254-N256 HydrophobicContact CZ-CB 3.95Å; F254-N256 PolarHBondContact O-N 2.03Å; F254-C262 CarbonylContact O-C 3.44Å; F254-C262 WeakPolarHBondContact O-CA 3.26Å; F254-E263 HydrophobicContact CD1-CB 4.22Å; F254-E263 VanDerWaalsContact CD1-O 3.26Å; F254-E263 WeakPolarHBondContact CD1-O 3.5Å; F254-E263 HydrophobicContact CE1-CB 3.53Å; F254-E263 HydrophobicContact CZ-CB 3.88Å; F254-E263 PolarHBondContact N-O 3.34Å; F254-E263 PolarHBondContact O-N 3.18Å; F254-F265 HydrophobicContact CB-CD1 4.05Å; F254-F265 HydrophobicContact CB-CE1 3.9Å; F254-F265 HydrophobicContact CD1-CB 4.05Å; F254-F265 AromaticContact CD1-CD1 3.68Å; F254-F265 HydrophobicContact CD1-CD1 3.68Å; F254-F265 HydrophobicContact CD1-CE1 4.38Å; F254-F265 HydrophobicContact CD1-CG 4.01Å; F254-F265 HydrophobicContact CE1-CB 4.29Å; F254-F265 HydrophobicContact CG-CD1 4.28Å; F254-N275 WeakPolarHBondContact CA-OD1 3.48Å; F254-N275 HydrophobicContact CB-CB 4.5Å; F254-N275 WeakPolarHBondContact CB-O 3.37Å
255	Y	92.4	Very high	88.5	Confident	22 Å²	22	75.8 Å²	75.8	9%	0.086	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	120.7	170.8	178.2	-101.2	0	0	0	110.1	P232 C237 N275 C283 C287 I288	P232-Y255 HydrophobicContact CB-CE1 4.46Å; P232-Y255 HydrophobicContact CG-CD1 3.75Å; P232-Y255 HydrophobicContact CG-CE1 3.19Å; C237-Y255 HydrophobicContact CB-CD1 4.18Å; C237-Y255 HydrophobicContact CB-CG 4.26Å; C237-Y255 VanDerWaalsContact O-CD1 3.29Å; C237-Y255 WeakPolarHBondContact O-CD1 3.29Å; Y255-N275 PolarHBondContact N-OD1 2.86Å; Y255-N275 PolarHBondContact O-ND2 3.32Å; Y255-C283 PolarHBondContact N-SG 2.71Å; Y255-C287 VanDerWaalsContact CB-SG 3.6Å; Y255-C287 HydrophobicContact CD1-CB 4.46Å; Y255-C287 HydrophobicContact CD2-CB 3.47Å; Y255-C287 VanDerWaalsContact CD2-CB 3.47Å; Y255-C287 HydrophobicContact CE2-CB 4.24Å; Y255-C287 HydrophobicContact CG-CB 3.58Å; Y255-I288 HydrophobicContact CD2-CD1 4.34Å; Y255-I288 HydrophobicContact CD2-CG1 3.8Å; Y255-I288 HydrophobicContact CE2-CD1 4.48Å; Y255-I288 HydrophobicContact CE2-CG1 3.68Å
256	N	91.1	Very high	88.9	Confident	33 Å²	33	72.7 Å²	72.7	18%	0.176	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	107.7	173.5	-177.9	-19	0	0	0	109.1	F254 K258 T259 K260 D261 E263	F254-N256 HydrophobicContact CD2-CB 4.47Å; F254-N256 HydrophobicContact CE2-CB 3.64Å; F254-N256 HydrophobicContact CZ-CB 3.95Å; F254-N256 PolarHBondContact O-N 2.03Å; N256-K258 PolarHBondContact O-N 3.13Å; N256-K258 VanDerWaalsContact OD1-CB 3.29Å; N256-K258 WeakPolarHBondContact OD1-CB 3.42Å; N256-K258 PolarHBondContact OD1-N 2.9Å; N256-T259 VanDerWaalsContact CB-OG1 3.24Å; N256-T259 WeakPolarHBondContact CB-OG1 3.43Å; N256-T259 VanDerWaalsContact CG-OG1 3.24Å; N256-T259 PolarHBondContact O-N 2.73Å; N256-T259 PolarHBondContact O-OG1 3.49Å; N256-T259 PolarHBondContact OD1-N 3.44Å; N256-K260 VanDerWaalsContact O-CA 3.3Å; N256-K260 WeakPolarHBondContact O-CA 3.4Å; N256-K260 PolarHBondContact O-N 3.34Å; N256-D261 PolarHBondContact N-O 3.19Å; N256-D261 PolarHBondContact O-N 3.21Å; N256-E263 HydrophobicContact CB-CG 4.2Å; N256-E263 WeakPolarHBondContact CB-OE1 3.41Å; N256-E263 PolarHBondContact ND2-OE1 2.93Å; N256-E263 PolarHBondContact ND2-OE2 2.01Å
257	S	83.8	Confident	89.7	Confident	87 Å²	87	66.2 Å²	66.2	61%	0.608	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-22.2	179.9	57.6	0	0	0	0	114.3
258	K	81.6	Confident	89.9	Confident	192 Å²	192	61.5 Å²	61.5	84%	0.835	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-42.1	178.4	-173.6	179.9	178.7	-178.7	0	111.9	N256	N256-K258 PolarHBondContact O-N 3.13Å; N256-K258 VanDerWaalsContact OD1-CB 3.29Å; N256-K258 WeakPolarHBondContact OD1-CB 3.42Å; N256-K258 PolarHBondContact OD1-N 2.9Å
259	T	86.4	Confident	90	Very high	75 Å²	75	60 Å²	60	46%	0.46	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-14.5	177.2	53.2	0	0	0	0	112.2	N256 D261 E263	N256-T259 VanDerWaalsContact CB-OG1 3.24Å; N256-T259 WeakPolarHBondContact CB-OG1 3.43Å; N256-T259 VanDerWaalsContact CG-OG1 3.24Å; N256-T259 PolarHBondContact O-N 2.73Å; N256-T259 PolarHBondContact O-OG1 3.49Å; N256-T259 PolarHBondContact OD1-N 3.44Å; T259-D261 PolarHBondContact O-N 2.97Å; T259-E263 WeakPolarHBondContact CB-OE1 3.47Å; T259-E263 VanDerWaalsContact CG2-OE1 3.27Å; T259-E263 WeakPolarHBondContact CG2-OE1 3.27Å; T259-E263 PolarHBondContact OG1-OE1 3.47Å
260	K	82.1	Confident	90.1	Very high	134 Å²	134	61.2 Å²	61.2	58%	0.583	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	57	35.1	-170.3	-57.7	-173.3	175.2	-170.6	0	112	N256	N256-K260 VanDerWaalsContact O-CA 3.3Å; N256-K260 WeakPolarHBondContact O-CA 3.4Å; N256-K260 PolarHBondContact O-N 3.34Å
261	D	86.9	Confident	89.9	Confident	76 Å²	76	62 Å²	62	41%	0.406	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	160.6	-173.8	-160.9	9.6	0	0	0	112.3	N256 T259	N256-D261 PolarHBondContact N-O 3.19Å; N256-D261 PolarHBondContact O-N 3.21Å; T259-D261 PolarHBondContact O-N 2.97Å
262	C	90.5	Very high	89.7	Confident	6 Å²	6	58.5 Å²	58.5	4%	0.041	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	105.2	179.5	-81.1	0	0	0	0	109.5	F254 C283 E284 I288	F254-C262 CarbonylContact O-C 3.44Å; F254-C262 WeakPolarHBondContact O-CA 3.26Å; C262-C283 HydrophobicContact CB-CB 3.71Å; C262-C283 WeakPolarHBondContact CB-SG 3.2Å; C262-C283 WeakPolarHBondContact SG-CB 3.3Å; C262-C283 CovalentContact SG-SG 2.03Å; C262-C283 PolarHBondContact SG-SG 2.74Å; C262-E284 HydrophobicContact CB-CG 4.15Å; C262-E284 PolarHBondContact SG-N 2.88Å; C262-I288 HydrophobicContact CB-CD1 3.83Å; C262-I288 WeakPolarHBondContact SG-CD1 3.37Å
263	E	94.3	Very high	89.5	Confident	62 Å²	62	57.3 Å²	57.3	29%	0.29	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	144.4	-175.9	-71.4	172.6	-156.2	0	0	111	Y253 F254 N256 T259	Y253-E263 CarbonylContact C-O 3.52Å; Y253-E263 VanDerWaalsContact CA-O 3.31Å; Y253-E263 WeakPolarHBondContact CA-O 3.33Å; F254-E263 HydrophobicContact CD1-CB 4.22Å; F254-E263 VanDerWaalsContact CD1-O 3.26Å; F254-E263 WeakPolarHBondContact CD1-O 3.5Å; F254-E263 HydrophobicContact CE1-CB 3.53Å; F254-E263 HydrophobicContact CZ-CB 3.88Å; F254-E263 PolarHBondContact N-O 3.34Å; F254-E263 PolarHBondContact O-N 3.18Å; N256-E263 HydrophobicContact CB-CG 4.2Å; N256-E263 WeakPolarHBondContact CB-OE1 3.41Å; N256-E263 PolarHBondContact ND2-OE1 2.93Å; N256-E263 PolarHBondContact ND2-OE2 2.01Å; T259-E263 WeakPolarHBondContact CB-OE1 3.47Å; T259-E263 VanDerWaalsContact CG2-OE1 3.27Å; T259-E263 WeakPolarHBondContact CG2-OE1 3.27Å; T259-E263 PolarHBondContact OG1-OE1 3.47Å
264	Q	93.7	Very high	89.4	Confident	92 Å²	92	61.2 Å²	61.2	43%	0.43	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	143.9	175.9	-172.2	175.1	-6.3	0	0	110.8	E251 R252 Y253	E251-Q264 WeakPolarHBondContact OE2-CG 3.35Å; E251-Q264 PolarHBondContact OE2-NE2 2.84Å; R252-Q264 CarbonylContact O-C 3.39Å; R252-Q264 WeakPolarHBondContact O-CA 3.36Å; Y253-Q264 HydrophobicContact CD1-CB 4.1Å; Y253-Q264 HydrophobicContact CE1-CB 3.84Å; Y253-Q264 HydrophobicContact CE1-CG 4.23Å
265	F	94.6	Very high	89.4	Confident	14 Å²	14	60.6 Å²	60.6	6%	0.061	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	157.1	171.5	80.5	-66.5	0	0	0	112	K241 V243 R252 F254 F267 N276	K241-F265 HydrophobicContact CD-CB 3.94Å; K241-F265 HydrophobicContact CD-CD2 4.19Å; K241-F265 HydrophobicContact CD-CG 4.15Å; K241-F265 HydrophobicContact CG-CD2 3.98Å; K241-F265 HydrophobicContact CG-CE2 4.38Å; K241-F265 HydrophobicContact CG-CG 4.22Å; V243-F265 HydrophobicContact CG2-CD2 4.47Å; R252-F265 HydrophobicContact CB-CD1 3.91Å; R252-F265 HydrophobicContact CB-CE1 3.42Å; R252-F265 VanDerWaalsContact CB-CE1 3.42Å; R252-F265 HydrophobicContact CB-CZ 3.91Å; R252-F265 PolarHBondContact N-O 3.31Å; R252-F265 PolarHBondContact O-N 2.8Å; R252-F265 VanDerWaalsContact O-O 3.08Å; F254-F265 HydrophobicContact CB-CD1 4.05Å; F254-F265 HydrophobicContact CB-CE1 3.9Å; F254-F265 HydrophobicContact CD1-CB 4.05Å; F254-F265 AromaticContact CD1-CD1 3.68Å; F254-F265 HydrophobicContact CD1-CD1 3.68Å; F254-F265 HydrophobicContact CD1-CE1 4.38Å; F254-F265 HydrophobicContact CD1-CG 4.01Å; F254-F265 HydrophobicContact CE1-CB 4.29Å; F254-F265 HydrophobicContact CG-CD1 4.28Å; F265-F267 HydrophobicContact CE2-CB 3.86Å; F265-F267 HydrophobicContact CE2-CD2 4.3Å; F265-F267 HydrophobicContact CZ-CB 4.04Å; F265-N276 HydrophobicContact CZ-CB 4.14Å
266	S	93.8	Very high	89.6	Confident	52 Å²	52	61 Å²	61	36%	0.364	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	112.5	173.9	-160.8	0	0	0	0	110.2
267	F	92.9	Very high	89.7	Confident	18 Å²	18	59.6 Å²	59.6	8%	0.079	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	130.1	177.5	173.9	-121.9	0	0	0	110.9	V243 P249 V250 R252 F265 G269 N276	V243-F267 WeakPolarHBondContact O-CD2 3.42Å; P249-F267 CarbonylContact C-O 2.83Å; P249-F267 VanDerWaalsContact CA-O 3.29Å; P249-F267 WeakPolarHBondContact CA-O 3.26Å; V250-F267 PolarHBondContact N-O 2.75Å; V250-F267 PolarHBondContact O-N 3.49Å; R252-F267 HydrophobicContact CB-CB 4.07Å; R252-F267 HydrophobicContact CG-CB 3.52Å; R252-F267 HydrophobicContact CG-CD1 4.34Å; R252-F267 HydrophobicContact CG-CG 4.28Å; F265-F267 HydrophobicContact CE2-CB 3.86Å; F265-F267 HydrophobicContact CE2-CD2 4.3Å; F265-F267 HydrophobicContact CZ-CB 4.04Å; F267-G269 WeakPolarHBondContact CE1-O 3.44Å; F267-G269 PolarHBondContact O-N 2.88Å; F267-G269 VanDerWaalsContact O-N 3.14Å; F267-N276 WeakPolarHBondContact CD1-ND2 3.4Å; F267-N276 WeakPolarHBondContact CD2-ND2 3.1Å; F267-N276 WeakPolarHBondContact CE2-ND2 3.39Å; F267-N276 WeakPolarHBondContact CG-ND2 3.38Å
268	G	86.5	Confident	90	Very high	2 Å²	2	62.3 Å²	62.3	2%	0.021	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	-8.9	-173.8	0	0	0	0	0	116.5	V243 K245 V247 S248	V243-G268 PolarHBondContact O-N 2.95Å; K245-G268 CarbonylContact O-C 3.5Å; K245-G268 WeakPolarHBondContact O-CA 3.15Å; V247-G268 PolarHBondContact N-O 2.87Å; S248-G268 CarbonylContact C-O 3.58Å; S248-G268 PolarHBondContact N-O 3.46Å; S248-G268 CarbonylContact O-C 3.24Å
269	G	81.2	Confident	90.4	Very high	38 Å²	38	56.5 Å²	56.5	39%	0.392	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	111.9	-24.7	173.1	0	0	0	0	0	114.8	F267	F267-G269 WeakPolarHBondContact CE1-O 3.44Å; F267-G269 PolarHBondContact O-N 2.88Å; F267-G269 VanDerWaalsContact O-N 3.14Å
270	Y	88.3	Confident	90.3	Very high	111 Å²	111	55 Å²	55	44%	0.435	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	173.2	175.6	69.9	-71.2	0	0	0	111.4	G244 K245 V247 G272	G244-Y270 VanDerWaalsContact CA-O 3.3Å; G244-Y270 WeakPolarHBondContact CA-O 3.18Å; K245-Y270 HydrophobicContact CB-CD1 4.37Å; K245-Y270 HydrophobicContact CB-CE1 3.58Å; K245-Y270 HydrophobicContact CB-CE2 3.86Å; K245-Y270 WeakPolarHBondContact CB-OH 3.33Å; K245-Y270 HydrophobicContact CD-CE2 3.76Å; K245-Y270 WeakPolarHBondContact CD-OH 3.49Å; K245-Y270 HydrophobicContact CG-CE2 4.32Å; K245-Y270 PolarHBondContact N-O 3.13Å; K245-Y270 VanDerWaalsContact N-O 3.15Å; K245-Y270 WeakPolarHBondContact O-CE1 3.35Å; V247-Y270 HydrophobicContact CB-CD1 4.3Å; V247-Y270 HydrophobicContact CB-CE1 3.73Å; V247-Y270 HydrophobicContact CG2-CD1 4.41Å; V247-Y270 HydrophobicContact CG2-CE1 3.4Å; Y270-G272 PolarHBondContact O-N 3.48Å
271	D	88.4	Confident	90.1	Very high	78 Å²	78	55.7 Å²	55.7	42%	0.417	28%	0.283	S	S	.	.	S	Bend	trans	58.1	34.2	-174.1	-166.1	18.3	0	0	0	112.4	K242 G244 K245	K242-D271 WeakPolarHBondContact CD-O 3.06Å; K242-D271 WeakPolarHBondContact CE-O 3.4Å; K242-D271 PolarHBondContact NZ-O 3.33Å; K242-D271 IonicContact NZ-OD1 2.78Å; K242-D271 PolarHBondContact NZ-OD1 3.2Å; G244-D271 WeakPolarHBondContact CA-O 3.07Å; K245-D271 HydrophobicContact CG-CB 4.46Å
272	G	89	Confident	90	Very high	26 Å²	26	54.8 Å²	54.8	27%	0.268	28%	0.277	S	S	.	.			trans	-80.6	-170.2	171.9	0	0	0	0	0	112.5	K242 Y270	K242-G272 PolarHBondContact NZ-O 2.89Å; Y270-G272 PolarHBondContact O-N 3.48Å
273	N	92.5	Very high	89.9	Confident	34 Å²	34	54.5 Å²	54.5	18%	0.182	28%	0.275	C	S	.	.			trans	-129.7	-175.8	164.3	68.3	4.9	0	0	0	108.5	Q239 P240 K242 N275 N276	Q239-N273 VanDerWaalsContact OE1-CB 3.23Å; P240-N273 PolarHBondContact O-ND2 3.36Å; P240-N273 PolarHBondContact O-OD1 3.41Å; K242-N273 HydrophobicContact CB-CB 4.17Å; K242-N273 WeakPolarHBondContact CB-ND2 3.36Å; K242-N273 HydrophobicContact CD-CB 4.07Å; N273-N275 VanDerWaalsContact C-N 3.32Å; N273-N275 PolarHBondContact OD1-N 3.44Å; N273-N276 WeakPolarHBondContact O-CB 3.11Å
274	E	92.9	Very high	89.5	Confident	121 Å²	121	54.3 Å²	54.3	57%	0.565	27%	0.274	S	S	*	.	S	Bend	trans	-79.4	-14.9	-172.7	-60.8	170.1	162.8	0	0	113.1	A236 Q239 N276	A236-E274 HydrophobicContact CB-CB 3.49Å; A236-E274 VanDerWaalsContact CB-CB 3.49Å; Q239-E274 PolarHBondContact NE2-OE2 2.74Å; E274-N276 PolarHBondContact O-N 2.81Å
275	N	94.8	Very high	88.7	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	28%	0.276	C	S	.	.	S	Bend	trans	-73.9	54.2	168.6	-157.8	7.3	0	0	0	111.1	A236 Q239 F254 Y255 N273 F277	A236-N275 WeakPolarHBondContact O-CB 3.19Å; A236-N275 PolarHBondContact O-N 2.71Å; Q239-N275 HydrophobicContact CB-CB 4.13Å; Q239-N275 WeakPolarHBondContact O-CB 3.25Å; Q239-N275 PolarHBondContact O-ND2 2.88Å; F254-N275 WeakPolarHBondContact CA-OD1 3.48Å; F254-N275 HydrophobicContact CB-CB 4.5Å; F254-N275 WeakPolarHBondContact CB-O 3.37Å; Y255-N275 PolarHBondContact N-OD1 2.86Å; Y255-N275 PolarHBondContact O-ND2 3.32Å; N273-N275 VanDerWaalsContact C-N 3.32Å; N273-N275 PolarHBondContact OD1-N 3.44Å; N275-F277 VanDerWaalsContact OD1-CE2 3.28Å; N275-F277 WeakPolarHBondContact OD1-CE2 3.4Å
276	N	95.8	Very high	88.1	Confident	30 Å²	30	58.3 Å²	58.3	16%	0.16	29%	0.29	C	S	.	.			trans	-150.2	86.2	-170.1	-176.9	-19.2	0	0	0	108.5	R252 Y253 F265 F267 N273 E274	R252-N276 WeakPolarHBondContact CB-OD1 3.49Å; R252-N276 WeakPolarHBondContact CD-OD1 3.15Å; R252-N276 WeakPolarHBondContact CG-OD1 3.44Å; R252-N276 PolarHBondContact NE-OD1 2.78Å; Y253-N276 WeakPolarHBondContact O-CA 3.35Å; F265-N276 HydrophobicContact CZ-CB 4.14Å; F267-N276 WeakPolarHBondContact CD1-ND2 3.4Å; F267-N276 WeakPolarHBondContact CD2-ND2 3.1Å; F267-N276 WeakPolarHBondContact CE2-ND2 3.39Å; F267-N276 WeakPolarHBondContact CG-ND2 3.38Å; N273-N276 WeakPolarHBondContact O-CB 3.11Å; E274-N276 PolarHBondContact O-N 2.81Å
277	F	94.6	Very high	87.7	Confident	3 Å²	3	56.3 Å²	56.3	1%	0.013	28%	0.275	C	S	.	.	B	Isolated β-bridge	trans	-99.2	146.3	-174.5	-54.7	-72.1	0	0	0	110.9	A236 R252 Y253 N275 T279 E282 C283 K286 C287	A236-F277 HydrophobicContact CB-CZ 4.28Å; R252-F277 WeakPolarHBondContact CA-O 3.43Å; R252-F277 WeakPolarHBondContact CD-O 3.44Å; Y253-F277 PolarHBondContact N-O 3.48Å; Y253-F277 WeakPolarHBondContact O-CD2 3.2Å; Y253-F277 PolarHBondContact O-N 3.39Å; N275-F277 VanDerWaalsContact OD1-CE2 3.28Å; N275-F277 WeakPolarHBondContact OD1-CE2 3.4Å; F277-T279 VanDerWaalsContact C-N 3.3Å; F277-T279 PolarHBondContact O-N 3.29Å; F277-E282 HydrophobicContact CB-CB 4.23Å; F277-E282 HydrophobicContact CB-CG 4.29Å; F277-E282 HydrophobicContact CD1-CG 3.95Å; F277-C283 HydrophobicContact CB-CB 3.84Å; F277-C283 HydrophobicContact CD2-CB 3.33Å; F277-C283 WeakPolarHBondContact CD2-SG 3.26Å; F277-C283 HydrophobicContact CE2-CB 4.06Å; F277-C283 HydrophobicContact CG-CB 3.71Å; F277-K286 HydrophobicContact CD1-CD 3.88Å; F277-K286 HydrophobicContact CE1-CB 4.16Å; F277-K286 HydrophobicContact CE1-CD 3.38Å; F277-K286 HydrophobicContact CE1-CG 4.4Å; F277-K286 HydrophobicContact CZ-CB 4.32Å; F277-K286 HydrophobicContact CZ-CD 4.3Å; F277-C287 WeakPolarHBondContact CE2-SG 3.42Å; F277-C287 WeakPolarHBondContact CZ-SG 3.17Å
278	K	89.9	Confident	87	Confident	144 Å²	144	58 Å²	58	63%	0.626	29%	0.285	S	S	*	.	S	Bend	trans	-72.4	-29.3	-177.6	-58.6	-174.1	-178.1	172.4	0	112.1	E282	K278-E282 PolarHBondContact N-OE2 3.47Å
279	T	88.3	Confident	85.9	Confident	70 Å²	70	60.9 Å²	60.9	43%	0.429	30%	0.302	S	S	.	.	S	Bend	trans	-137.6	154.1	-176.1	65.1	0	0	0	0	110.2	F277 R281 E282 C283	F277-T279 VanDerWaalsContact C-N 3.3Å; F277-T279 PolarHBondContact O-N 3.29Å; T279-R281 VanDerWaalsContact C-N 3.28Å; T279-R281 PolarHBondContact O-N 3.19Å; T279-E282 PolarHBondContact O-N 3.07Å; T279-E282 WeakPolarHBondContact OG1-CB 3.32Å; T279-E282 PolarHBondContact OG1-N 3.47Å; T279-E282 VanDerWaalsContact OG1-N 3.13Å; T279-C283 PolarHBondContact O-N 2.9Å
280	Q	85.7	Confident	84.2	Confident	44 Å²	44	70.2 Å²	70.2	21%	0.206	33%	0.326	C	S	.	.	H	α-helix	trans	-55.7	-46.1	174.2	-172.5	172.9	-18.4	0	0	111.1	Y253 E282 C283 E284	Y253-Q280 HydrophobicContact CD1-CB 3.78Å; Y253-Q280 HydrophobicContact CD1-CG 4.11Å; Y253-Q280 HydrophobicContact CD2-CB 4.45Å; Y253-Q280 VanDerWaalsContact CD2-N 3.26Å; Y253-Q280 HydrophobicContact CE1-CB 3.55Å; Y253-Q280 HydrophobicContact CE1-CG 4.03Å; Y253-Q280 HydrophobicContact CE2-CB 4.27Å; Y253-Q280 HydrophobicContact CG-CB 4.22Å; Q280-E282 VanDerWaalsContact C-N 3.32Å; Q280-E282 PolarHBondContact O-N 2.03Å; Q280-C283 CarbonylContact O-C 3.58Å; Q280-C283 WeakPolarHBondContact O-CA 3.48Å; Q280-C283 WeakPolarHBondContact O-CB 3.26Å; Q280-C283 PolarHBondContact O-N 3.04Å; Q280-E284 HydrophobicContact CG-CG 4.33Å; Q280-E284 WeakPolarHBondContact CG-OE1 3.37Å; Q280-E284 PolarHBondContact NE2-OE1 3.44Å; Q280-E284 PolarHBondContact O-N 3.06Å
281	R	76.7	Confident	82	Confident	149 Å²	149	72.5 Å²	72.5	56%	0.562	33%	0.333	S	S	*	.	H	α-helix	trans	-56.8	-41.9	177.1	-178.5	174.5	175.5	150	-1.9	113	T279 C283 K285 E385	T279-R281 VanDerWaalsContact C-N 3.28Å; T279-R281 PolarHBondContact O-N 3.19Å; R281-C283 VanDerWaalsContact C-N 3.32Å; R281-K285 WeakPolarHBondContact O-CB 3.44Å; R281-K285 PolarHBondContact O-N 3.39Å; R281-E385 IonicContact CZ-OE1 2.64Å; R281-E385 IonicContact NH1-OE1 2.82Å; R281-E385 PolarHBondContact NH1-OE1 2.81Å; R281-E385 IonicContact NH1-OE2 2.77Å
282	E	85	Confident	80.2	Confident	57 Å²	57	71.7 Å²	71.7	27%	0.266	33%	0.328	S	S	.	.	H	α-helix	trans	-63.5	-41.2	176.8	-174.4	-169.9	175.9	0	0	111.3	F277 K278 T279 Q280 K286	F277-E282 HydrophobicContact CB-CB 4.23Å; F277-E282 HydrophobicContact CB-CG 4.29Å; F277-E282 HydrophobicContact CD1-CG 3.95Å; K278-E282 PolarHBondContact N-OE2 3.47Å; T279-E282 PolarHBondContact O-N 3.07Å; T279-E282 WeakPolarHBondContact OG1-CB 3.32Å; T279-E282 PolarHBondContact OG1-N 3.47Å; T279-E282 VanDerWaalsContact OG1-N 3.13Å; Q280-E282 VanDerWaalsContact C-N 3.32Å; Q280-E282 PolarHBondContact O-N 2.03Å; E282-K286 HydrophobicContact CG-CD 4.2Å; E282-K286 WeakPolarHBondContact O-CB 3.26Å; E282-K286 WeakPolarHBondContact O-CG 3.06Å; E282-K286 PolarHBondContact O-N 3.32Å; E282-K286 VanDerWaalsContact O-N 3.14Å; E282-K286 IonicContact OE1-NZ 3.63Å; E282-K286 PolarHBondContact OE1-NZ 3.45Å
283	C	89.1	Confident	79.1	Confident	0 Å²	0	72.6 Å²	72.6	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-63.8	-53.8	174.6	-177.5	0	0	0	0	111.1	Y255 C262 F277 T279 Q280 R281 K285 K286 C287	Y255-C283 PolarHBondContact N-SG 2.71Å; C262-C283 HydrophobicContact CB-CB 3.71Å; C262-C283 WeakPolarHBondContact CB-SG 3.2Å; C262-C283 WeakPolarHBondContact SG-CB 3.3Å; C262-C283 CovalentContact SG-SG 2.03Å; C262-C283 PolarHBondContact SG-SG 2.74Å; F277-C283 HydrophobicContact CB-CB 3.84Å; F277-C283 HydrophobicContact CD2-CB 3.33Å; F277-C283 WeakPolarHBondContact CD2-SG 3.26Å; F277-C283 HydrophobicContact CE2-CB 4.06Å; F277-C283 HydrophobicContact CG-CB 3.71Å; T279-C283 PolarHBondContact O-N 2.9Å; Q280-C283 CarbonylContact O-C 3.58Å; Q280-C283 WeakPolarHBondContact O-CA 3.48Å; Q280-C283 WeakPolarHBondContact O-CB 3.26Å; Q280-C283 PolarHBondContact O-N 3.04Å; R281-C283 VanDerWaalsContact C-N 3.32Å; C283-K285 VanDerWaalsContact C-N 3.34Å; C283-K285 PolarHBondContact O-N 2.85Å; C283-K286 CarbonylContact O-C 3.53Å; C283-K286 PolarHBondContact O-N 3.38Å; C283-C287 WeakPolarHBondContact O-CA 3.49Å; C283-C287 WeakPolarHBondContact O-CB 2.98Å; C283-C287 PolarHBondContact O-N 3.39Å; C283-C287 PolarHBondContact O-SG 3.48Å
284	E	84.7	Confident	78.2	Confident	58 Å²	58	71.5 Å²	71.5	27%	0.271	32%	0.323	S	S	.	.	H	α-helix	trans	-57.1	-47.6	-179.2	-77.8	164.6	174	0	0	111.3	C262 Q280 K286 C287 I288 T289	C262-E284 HydrophobicContact CB-CG 4.15Å; C262-E284 PolarHBondContact SG-N 2.88Å; Q280-E284 HydrophobicContact CG-CG 4.33Å; Q280-E284 WeakPolarHBondContact CG-OE1 3.37Å; Q280-E284 PolarHBondContact NE2-OE1 3.44Å; Q280-E284 PolarHBondContact O-N 3.06Å; E284-K286 VanDerWaalsContact C-N 3.26Å; E284-K286 PolarHBondContact O-N 3.46Å; E284-C287 PolarHBondContact O-N 2.9Å; E284-I288 HydrophobicContact CB-CD1 4.44Å; E284-I288 HydrophobicContact CG-CD1 3.74Å; E284-I288 WeakPolarHBondContact O-CA 3.38Å; E284-I288 PolarHBondContact O-N 3.33Å; E284-T289 PolarHBondContact O-N 3.35Å; E284-T289 PolarHBondContact O-OG1 3.48Å
285	K	77.3	Confident	77.9	Confident	111 Å²	111	65.8 Å²	65.8	48%	0.483	30%	0.297	S	S	.	.	H	α-helix	trans	-61.7	-29.6	177.3	178	169.6	-179.7	178.3	0	113.5	R281 C283 T289 I292	R281-K285 WeakPolarHBondContact O-CB 3.44Å; R281-K285 PolarHBondContact O-N 3.39Å; C283-K285 VanDerWaalsContact C-N 3.34Å; C283-K285 PolarHBondContact O-N 2.85Å; K285-T289 VanDerWaalsContact CA-OG1 3.3Å; K285-T289 WeakPolarHBondContact CA-OG1 3.28Å; K285-T289 PolarHBondContact O-OG1 3.4Å; K285-I292 HydrophobicContact CD-CD1 4.06Å; K285-I292 HydrophobicContact CG-CD1 3.55Å; K285-I292 HydrophobicContact CG-CG1 3.94Å
286	K	83.5	Confident	77.2	Confident	79 Å²	79	70 Å²	70	34%	0.343	32%	0.319	S	S	.	.	H	α-helix	trans	-91.9	-28.4	178.7	-75.9	177.8	176	173.2	0	112.7	N234 C237 F277 E282 C283 E284	N234-K286 WeakPolarHBondContact CB-O 3.35Å; C237-K286 VanDerWaalsContact SG-C 3.56Å; C237-K286 PolarHBondContact SG-O 2.89Å; C237-K286 VanDerWaalsContact SG-O 3.41Å; F277-K286 HydrophobicContact CD1-CD 3.88Å; F277-K286 HydrophobicContact CE1-CB 4.16Å; F277-K286 HydrophobicContact CE1-CD 3.38Å; F277-K286 HydrophobicContact CE1-CG 4.4Å; F277-K286 HydrophobicContact CZ-CB 4.32Å; F277-K286 HydrophobicContact CZ-CD 4.3Å; E282-K286 HydrophobicContact CG-CD 4.2Å; E282-K286 WeakPolarHBondContact O-CB 3.26Å; E282-K286 WeakPolarHBondContact O-CG 3.06Å; E282-K286 PolarHBondContact O-N 3.32Å; E282-K286 VanDerWaalsContact O-N 3.14Å; E282-K286 IonicContact OE1-NZ 3.63Å; E282-K286 PolarHBondContact OE1-NZ 3.45Å; C283-K286 CarbonylContact O-C 3.53Å; C283-K286 PolarHBondContact O-N 3.38Å; E284-K286 VanDerWaalsContact C-N 3.26Å; E284-K286 PolarHBondContact O-N 3.46Å
287	C	85	Confident	76.5	Confident	9 Å²	9	71 Å²	71	6%	0.061	32%	0.323	C	S	.	.	H	α-helix	trans	-122.1	-29.6	-162.3	-52.5	0	0	0	0	115.3	C237 Y255 F277 C283 E284	C237-C287 HydrophobicContact CB-CB 3.54Å; C237-C287 WeakPolarHBondContact CB-SG 2.99Å; C237-C287 WeakPolarHBondContact SG-CA 3.47Å; C237-C287 WeakPolarHBondContact SG-CB 2.91Å; C237-C287 CovalentContact SG-SG 2.01Å; C237-C287 PolarHBondContact SG-SG 2.8Å; Y255-C287 VanDerWaalsContact CB-SG 3.6Å; Y255-C287 HydrophobicContact CD1-CB 4.46Å; Y255-C287 HydrophobicContact CD2-CB 3.47Å; Y255-C287 VanDerWaalsContact CD2-CB 3.47Å; Y255-C287 HydrophobicContact CE2-CB 4.24Å; Y255-C287 HydrophobicContact CG-CB 3.58Å; F277-C287 WeakPolarHBondContact CE2-SG 3.42Å; F277-C287 WeakPolarHBondContact CZ-SG 3.17Å; C283-C287 WeakPolarHBondContact O-CA 3.49Å; C283-C287 WeakPolarHBondContact O-CB 2.98Å; C283-C287 PolarHBondContact O-N 3.39Å; C283-C287 PolarHBondContact O-SG 3.48Å; E284-C287 PolarHBondContact O-N 2.9Å
288	I	78.6	Confident	76.1	Confident	55 Å²	55	75 Å²	75	28%	0.282	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.4	-37.4	-173.2	-65.8	166.4	0	0	0	111.2	Y255 C262 E284 W290	Y255-I288 HydrophobicContact CD2-CD1 4.34Å; Y255-I288 HydrophobicContact CD2-CG1 3.8Å; Y255-I288 HydrophobicContact CE2-CD1 4.48Å; Y255-I288 HydrophobicContact CE2-CG1 3.68Å; C262-I288 HydrophobicContact CB-CD1 3.83Å; C262-I288 WeakPolarHBondContact SG-CD1 3.37Å; E284-I288 HydrophobicContact CB-CD1 4.44Å; E284-I288 HydrophobicContact CG-CD1 3.74Å; E284-I288 WeakPolarHBondContact O-CA 3.38Å; E284-I288 PolarHBondContact O-N 3.33Å; I288-W290 PolarHBondContact O-N 3.18Å
289	T	62.1	Low	76.1	Confident	62 Å²	62	73.4 Å²	73.4	38%	0.38	34%	0.343	S	S	.	.	S	Bend	trans	-64.4	110.8	177.7	52.1	0	0	0	0	109	E284 K285 R291	E284-T289 PolarHBondContact O-N 3.35Å; E284-T289 PolarHBondContact O-OG1 3.48Å; K285-T289 VanDerWaalsContact CA-OG1 3.3Å; K285-T289 WeakPolarHBondContact CA-OG1 3.28Å; K285-T289 PolarHBondContact O-OG1 3.4Å; T289-R291 VanDerWaalsContact C-N 3.26Å; T289-R291 PolarHBondContact O-N 3.21Å
290	W	46.8	Very low	76.2	Confident	234 Å²	234	73.8 Å²	73.8	89%	0.886	34%	0.34	S	S	*	.	S	Bend	trans	-59.7	88.9	171.9	-82.7	69.4	0	0	0	109.2	I288	I288-W290 PolarHBondContact O-N 3.18Å
291	R	42.2	Very low	76.4	Confident	158 Å²	158	75.9 Å²	75.9	60%	0.596	35%	0.351	S	S	*	.			trans	57	112	-171.2	-53.6	-177	-175.1	-135.6	-2.8	111.2	T289 T293 R344	T289-R291 VanDerWaalsContact C-N 3.26Å; T289-R291 PolarHBondContact O-N 3.21Å; R291-T293 PolarHBondContact O-N 3.34Å; R291-R344 VanDerWaalsContact NH1-NH2 3.18Å
292	I	50.9	Low	76.8	Confident	61 Å²	61	69.5 Å²	69.5	31%	0.313	33%	0.332	S	S	.	.			trans	-52.8	107.9	137.4	-58.9	161.8	0	0	0	102.8	K285 D296	K285-I292 HydrophobicContact CD-CD1 4.06Å; K285-I292 HydrophobicContact CG-CD1 3.55Å; K285-I292 HydrophobicContact CG-CG1 3.94Å; I292-D296 HydrophobicContact CG2-CB 3.67Å
293	T	64.5	Low	76.6	Confident	45 Å²	45	73.5 Å²	73.5	28%	0.276	36%	0.355	S	S	.	.			trans	-61.8	148.3	178.8	60.3	0	0	0	0	106	R291 C295 D296	R291-T293 PolarHBondContact O-N 3.34Å; T293-C295 PolarHBondContact O-N 3.11Å; T293-C295 VanDerWaalsContact OG1-CB 3.24Å; T293-C295 WeakPolarHBondContact OG1-CB 2.98Å; T293-D296 PolarHBondContact N-OD2 3.46Å; T293-D296 PolarHBondContact O-N 2.97Å; T293-D296 VanDerWaalsContact OG1-CG 3.31Å; T293-D296 PolarHBondContact OG1-N 2.99Å; T293-D296 PolarHBondContact OG1-OD2 3.06Å
294	P	74.9	Confident	76.5	Confident	11 Å²	11	76.1 Å²	76.1	7%	0.071	37%	0.373	C	S	.	.	G	3₁₀ helix	trans	-39	-35.8	166.6	-32.8	35.9	0	0	0	112.2	D296 Q297 E332 N333 F335	P294-D296 VanDerWaalsContact C-N 3.34Å; P294-D296 PolarHBondContact O-N 3.31Å; P294-Q297 WeakPolarHBondContact O-CB 2.99Å; P294-Q297 WeakPolarHBondContact O-CG 3.47Å; P294-Q297 PolarHBondContact O-N 2.85Å; P294-E332 HydrophobicContact CB-CB 3.62Å; P294-E332 WeakPolarHBondContact CB-O 3.32Å; P294-E332 HydrophobicContact CG-CB 4.03Å; P294-N333 WeakPolarHBondContact O-CB 3.28Å; P294-F335 HydrophobicContact CB-CZ 4.05Å
295	C	84.8	Confident	76.4	Confident	1 Å²	1	81.9 Å²	81.9	1%	0.007	40%	0.404	C	S	.	.	G	3₁₀ helix	trans	-65.1	-23.8	-177	-36.7	0	0	0	0	115.5	T293 Q297 Y313 N333 C345	T293-C295 PolarHBondContact O-N 3.11Å; T293-C295 VanDerWaalsContact OG1-CB 3.24Å; T293-C295 WeakPolarHBondContact OG1-CB 2.98Å; C295-Q297 VanDerWaalsContact C-N 3.29Å; C295-Y313 HydrophobicContact CB-CD1 3.7Å; C295-Y313 HydrophobicContact CB-CG 3.82Å; C295-Y313 WeakPolarHBondContact O-CD1 3.49Å; C295-N333 PolarHBondContact O-ND2 2.97Å; C295-C345 HydrophobicContact CB-CB 3.48Å; C295-C345 VanDerWaalsContact CB-CB 3.48Å; C295-C345 WeakPolarHBondContact CB-SG 3.31Å; C295-C345 WeakPolarHBondContact SG-CA 3.08Å; C295-C345 WeakPolarHBondContact SG-CB 3.38Å; C295-C345 CovalentContact SG-SG 2.01Å; C295-C345 PolarHBondContact SG-SG 2.82Å
296	D	80.4	Confident	76.3	Confident	88 Å²	88	82.5 Å²	82.5	47%	0.471	41%	0.409	S	S	.	.	G	3₁₀ helix	trans	-83.3	-8.1	177.4	-60.1	-54	0	0	0	112.6	I292 T293 P294	I292-D296 HydrophobicContact CG2-CB 3.67Å; T293-D296 PolarHBondContact N-OD2 3.46Å; T293-D296 PolarHBondContact O-N 2.97Å; T293-D296 VanDerWaalsContact OG1-CG 3.31Å; T293-D296 PolarHBondContact OG1-N 2.99Å; T293-D296 PolarHBondContact OG1-OD2 3.06Å; P294-D296 VanDerWaalsContact C-N 3.34Å; P294-D296 PolarHBondContact O-N 3.31Å
297	Q	81.1	Confident	76.3	Confident	51 Å²	51	84 Å²	84	24%	0.238	43%	0.425	C	S	.	.	S	Bend	trans	-79.4	151.3	177.2	-54.3	173.5	4.4	0	0	109.9	P294 C295 N331 N333	P294-Q297 WeakPolarHBondContact O-CB 2.99Å; P294-Q297 WeakPolarHBondContact O-CG 3.47Å; P294-Q297 PolarHBondContact O-N 2.85Å; C295-Q297 VanDerWaalsContact C-N 3.29Å; Q297-N331 PolarHBondContact OE1-OD1 2.78Å; Q297-N333 HydrophobicContact CB-CB 4.13Å; Q297-N333 PolarHBondContact O-ND2 2.78Å
298	P	86.9	Confident	76.5	Confident	89 Å²	89	86.2 Å²	86.2	58%	0.578	44%	0.438	S	S	*	.	P	Polyproline II helix	trans	-68.4	163.5	177.5	30.1	-35.9	0	0	0	111.4	E300 N331	P298-E300 PolarHBondContact O-N 3.2Å; P298-N331 PolarHBondContact O-ND2 2.95Å; P298-N331 PolarHBondContact O-OD1 3Å
299	K	89.7	Confident	77.2	Confident	110 Å²	110	88 Å²	88	48%	0.478	45%	0.449	S	S	.	.	P	Polyproline II helix	trans	-66.7	129.5	165.7	70.8	-170.5	174.7	-161.2	0	110.3	F312 F323	K299-F312 HydrophobicContact CB-CB 4.2Å; K299-F312 HydrophobicContact CB-CD1 3.88Å; K299-F312 HydrophobicContact CB-CD2 3.61Å; K299-F312 HydrophobicContact CB-CE1 4.18Å; K299-F312 HydrophobicContact CB-CE2 3.91Å; K299-F312 HydrophobicContact CB-CG 3.61Å; K299-F312 HydrophobicContact CB-CZ 4.21Å; K299-F312 HydrophobicContact CD-CD1 4.13Å; K299-F312 HydrophobicContact CD-CE1 3.62Å; K299-F312 HydrophobicContact CD-CE2 4.02Å; K299-F312 HydrophobicContact CD-CZ 3.58Å; K299-F312 HydrophobicContact CG-CE2 4.33Å; K299-F312 HydrophobicContact CG-CZ 4.37Å; K299-F323 HydrophobicContact CB-CD2 4.36Å; K299-F323 HydrophobicContact CB-CG 4.41Å; K299-F323 HydrophobicContact CD-CB 4.35Å
300	E	90.1	Very high	78.7	Confident	78 Å²	78	87.7 Å²	87.7	36%	0.364	44%	0.44	S	S	.	.			trans	-116.9	109	174.2	-84.1	176.9	-151.2	0	0	110.4	P298 G302 F323 Y325 N331	P298-E300 PolarHBondContact O-N 3.2Å; E300-G302 VanDerWaalsContact C-N 3.27Å; E300-G302 PolarHBondContact O-N 2.72Å; E300-F323 VanDerWaalsContact O-CE2 3.29Å; E300-F323 WeakPolarHBondContact O-CE2 3.01Å; E300-Y325 WeakPolarHBondContact O-CD2 3.45Å; E300-N331 WeakPolarHBondContact CG-ND2 3.36Å; E300-N331 PolarHBondContact OE1-ND2 3.47Å; E300-N331 PolarHBondContact OE2-N 3.28Å
301	I	89.7	Confident	80.9	Confident	88 Å²	88	78.5 Å²	78.5	45%	0.451	41%	0.406	S	S	.	.			trans	-67.3	-31.2	178.3	-64.5	172.6	0	0	0	110.6	F323 I324 Y325 T326	I301-F323 HydrophobicContact CG1-CD2 4.38Å; I301-I324 WeakPolarHBondContact CG2-O 3.5Å; I301-Y325 WeakPolarHBondContact O-CD2 3.44Å; I301-T326 HydrophobicContact CG2-CG2 3.62Å; I301-T326 WeakPolarHBondContact O-CB 3.29Å; I301-T326 WeakPolarHBondContact O-CG2 3.37Å; I301-T326 PolarHBondContact O-N 2.67Å; I301-T326 PolarHBondContact O-OG1 3.19Å
302	G	85.7	Confident	83.4	Confident	15 Å²	15	71.5 Å²	71.5	16%	0.155	38%	0.38	C	S	.	.			trans	73.5	174.1	-170.4	0	0	0	0	0	113.5	E300 T326 C328	E300-G302 VanDerWaalsContact C-N 3.27Å; E300-G302 PolarHBondContact O-N 2.72Å; G302-T326 VanDerWaalsContact CA-OG1 3.26Å; G302-T326 WeakPolarHBondContact CA-OG1 3.35Å; G302-T326 PolarHBondContact O-OG1 2.82Å; G302-C328 VanDerWaalsContact CA-O 3.24Å; G302-C328 WeakPolarHBondContact CA-O 3.36Å
303	N	80.9	Confident	85.2	Confident	140 Å²	140	69.6 Å²	69.6	75%	0.749	37%	0.37	S	S	*	.	S	Bend	trans	-116.2	20.3	-176.3	-60.8	-52	0	0	0	114.5	T326 E329	N303-T326 PolarHBondContact N-OG1 2.85Å; N303-E329 PolarHBondContact ND2-OE2 2.87Å
304	C	87.5	Confident	86.2	Confident	55 Å²	55	68.5 Å²	68.5	37%	0.372	36%	0.362	S	S	.	.	S	Bend	trans	-88	178.2	-180	-84.3	0	0	0	0	112.9	T326 C328	C304-T326 CarbonylContact C-O 3.5Å; C304-T326 WeakPolarHBondContact CB-O 3.2Å; C304-T326 PolarHBondContact N-OG1 3.3Å; C304-T326 VanDerWaalsContact O-CB 3.27Å; C304-T326 WeakPolarHBondContact O-CB 3.45Å; C304-C328 HydrophobicContact CB-CB 3.88Å; C304-C328 WeakPolarHBondContact CB-SG 2.98Å; C304-C328 WeakPolarHBondContact SG-CB 2.86Å; C304-C328 CovalentContact SG-SG 2.01Å; C304-C328 PolarHBondContact SG-SG 2.87Å
305	L	81.3	Confident	86.3	Confident	179 Å²	179	71.7 Å²	71.7	94%	0.937	38%	0.381	S	S	*	.	S	Bend	trans	-97.1	-8.1	-176.5	-62.8	177.9	0	0	0	113.8
306	E	75.5	Confident	85.8	Confident	124 Å²	124	80.1 Å²	80.1	58%	0.579	42%	0.421	S	S	*	.			trans	-75.5	161.4	174.6	-56.2	-168.9	162.2	0	0	109.2	T326	E306-T326 CarbonylContact C-O 3.49Å; E306-T326 WeakPolarHBondContact CA-O 3.16Å; E306-T326 WeakPolarHBondContact CB-O 3.09Å; E306-T326 PolarHBondContact N-O 2.84Å; E306-T326 VanDerWaalsContact N-O 3.14Å; E306-T326 CarbonylContact O-C 3.59Å; E306-T326 VanDerWaalsContact O-C 3.29Å; E306-T326 WeakPolarHBondContact O-CA 3.43Å
307	T	84.7	Confident	85.6	Confident	112 Å²	112	78.8 Å²	78.8	69%	0.687	42%	0.416	S	S	*	.			trans	-138.3	112.2	171.8	55.3	0	0	0	0	108.2	I324 Y325	T307-I324 HydrophobicContact CG2-CG2 4.12Å; T307-Y325 WeakPolarHBondContact CA-O 3.24Å
308	V	89	Confident	85.3	Confident	54 Å²	54	79.7 Å²	79.7	33%	0.327	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	130.7	-176.7	-171.8	0	0	0	0	108.4	R310 Y325	V308-R310 PolarHBondContact O-N 3.01Å; V308-Y325 PolarHBondContact N-O 2.03Å; V308-Y325 PolarHBondContact O-N 3.35Å
309	N	92.6	Very high	85	Confident	94 Å²	94	82.1 Å²	82.1	50%	0.503	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	123.9	172.3	-66.6	-12.6	0	0	0	109	M322 I324	N309-M322 HydrophobicContact CB-CG 4.38Å; N309-M322 HydrophobicContact CB-SD 4.31Å; N309-I324 WeakPolarHBondContact OD1-CD1 3.48Å
310	R	93.7	Very high	85	Confident	55 Å²	55	77.7 Å²	77.7	21%	0.208	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	168.5	177.2	-65.2	-64	-170.1	133.1	-15.3	109.3	V308 M322 F323 Y325 N334 F335 N336	V308-R310 PolarHBondContact O-N 3.01Å; R310-M322 CarbonylContact O-C 3.57Å; R310-M322 VanDerWaalsContact O-CA 3.26Å; R310-M322 WeakPolarHBondContact O-CA 3.38Å; R310-M322 WeakPolarHBondContact O-CG 2.98Å; R310-F323 HydrophobicContact CB-CD1 3.95Å; R310-F323 HydrophobicContact CB-CE1 3.42Å; R310-F323 VanDerWaalsContact CB-CE1 3.42Å; R310-F323 HydrophobicContact CB-CZ 3.78Å; R310-F323 PolarHBondContact N-O 2.78Å; R310-F323 PolarHBondContact O-N 2.9Å; R310-F323 VanDerWaalsContact O-O 3.1Å; R310-Y325 VanDerWaalsContact CG-CB 3.43Å; R310-Y325 HydrophobicContact CG-CD1 4.11Å; R310-Y325 HydrophobicContact CG-CG 4.11Å; R310-N334 WeakPolarHBondContact CB-OD1 3.24Å; R310-N334 WeakPolarHBondContact CD-OD1 3.13Å; R310-N334 WeakPolarHBondContact CG-OD1 3.23Å; R310-N334 PolarHBondContact NH1-OD1 3.15Å; R310-F335 WeakPolarHBondContact CA-O 3.16Å; R310-F335 WeakPolarHBondContact CD-O 3.34Å; R310-N336 PolarHBondContact NH1-OD1 3.05Å; R310-N336 PolarHBondContact NH2-OD1 3.2Å
311	F	93.6	Very high	85	Confident	40 Å²	40	76.9 Å²	76.9	18%	0.175	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	142.6	176.7	-60.6	-94.1	0	0	0	109.7	E321 M322 F335 T337 I338 C341	F311-E321 CarbonylContact C-O 3.55Å; F311-E321 VanDerWaalsContact CA-O 3.26Å; F311-E321 WeakPolarHBondContact CA-O 3.34Å; F311-M322 HydrophobicContact CD1-CB 4.05Å; F311-M322 HydrophobicContact CE1-CB 3.85Å; F311-M322 HydrophobicContact CE1-CG 4.23Å; F311-M322 HydrophobicContact CZ-CG 4.45Å; F311-F335 HydrophobicContact CB-CB 4.3Å; F311-F335 PolarHBondContact N-O 3.47Å; F311-F335 WeakPolarHBondContact O-CD2 3.07Å; F311-F335 PolarHBondContact O-N 3.38Å; F311-T337 VanDerWaalsContact CD2-C 3.4Å; F311-I338 HydrophobicContact CD1-CB 3.78Å; F311-I338 HydrophobicContact CD1-CD1 4.45Å; F311-I338 HydrophobicContact CD1-CG1 4.1Å; F311-I338 HydrophobicContact CE1-CB 3.74Å; F311-I338 HydrophobicContact CE1-CD1 4.33Å; F311-I338 HydrophobicContact CE1-CG1 4.28Å; F311-I338 HydrophobicContact CE2-CB 4.47Å; F311-I338 HydrophobicContact CG-CB 4.18Å; F311-I338 HydrophobicContact CZ-CB 4.1Å; F311-C341 HydrophobicContact CB-CB 4.1Å
312	F	93.5	Very high	85.2	Confident	11 Å²	11	78.1 Å²	78.1	5%	0.048	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	149.4	173.7	80.8	-74.9	0	0	0	109	K299 N314 C320 E321 F323 N333	K299-F312 HydrophobicContact CB-CB 4.2Å; K299-F312 HydrophobicContact CB-CD1 3.88Å; K299-F312 HydrophobicContact CB-CD2 3.61Å; K299-F312 HydrophobicContact CB-CE1 4.18Å; K299-F312 HydrophobicContact CB-CE2 3.91Å; K299-F312 HydrophobicContact CB-CG 3.61Å; K299-F312 HydrophobicContact CB-CZ 4.21Å; K299-F312 HydrophobicContact CD-CD1 4.13Å; K299-F312 HydrophobicContact CD-CE1 3.62Å; K299-F312 HydrophobicContact CD-CE2 4.02Å; K299-F312 HydrophobicContact CD-CZ 3.58Å; K299-F312 HydrophobicContact CG-CE2 4.33Å; K299-F312 HydrophobicContact CG-CZ 4.37Å; F312-N314 HydrophobicContact CD2-CB 4.39Å; F312-N314 HydrophobicContact CE2-CB 3.55Å; F312-N314 HydrophobicContact CZ-CB 3.73Å; F312-N314 PolarHBondContact O-N 3.14Å; F312-C320 CarbonylContact O-C 3.43Å; F312-C320 WeakPolarHBondContact O-CA 3.4Å; F312-E321 HydrophobicContact CD1-CB 4.28Å; F312-E321 VanDerWaalsContact CD1-O 3.28Å; F312-E321 WeakPolarHBondContact CD1-O 3.49Å; F312-E321 HydrophobicContact CE1-CB 3.68Å; F312-E321 HydrophobicContact CZ-CB 4.17Å; F312-E321 PolarHBondContact N-O 3.46Å; F312-E321 PolarHBondContact O-N 3.28Å; F312-F323 HydrophobicContact CB-CD1 3.89Å; F312-F323 HydrophobicContact CB-CE1 3.86Å; F312-F323 HydrophobicContact CD1-CB 3.96Å; F312-F323 AromaticContact CD1-CD1 3.67Å; F312-F323 HydrophobicContact CD1-CD1 3.67Å; F312-F323 HydrophobicContact CD1-CE1 4.48Å; F312-F323 HydrophobicContact CD1-CG 4.04Å; F312-F323 HydrophobicContact CE1-CB 4.23Å; F312-F323 HydrophobicContact CG-CD1 4.18Å; F312-N333 WeakPolarHBondContact CA-O 3.34Å; F312-N333 WeakPolarHBondContact CA-OD1 3.32Å; F312-N333 HydrophobicContact CB-CB 4.4Å; F312-N333 WeakPolarHBondContact CB-O 3.46Å
313	Y	88.4	Confident	85.6	Confident	22 Å²	22	78 Å²	78	9%	0.086	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	115.6	170.5	-174.7	-103.5	0	0	0	109.6	C295 T315 S318 N333 C345	C295-Y313 HydrophobicContact CB-CD1 3.7Å; C295-Y313 HydrophobicContact CB-CG 3.82Å; C295-Y313 WeakPolarHBondContact O-CD1 3.49Å; Y313-T315 HydrophobicContact CD1-CG2 3.97Å; Y313-T315 HydrophobicContact CE1-CG2 4.02Å; Y313-S318 WeakPolarHBondContact OH-CA 3.27Å; Y313-N333 PolarHBondContact N-ND2 2.7Å; Y313-N333 PolarHBondContact N-OD1 3Å; Y313-N333 PolarHBondContact O-ND2 3.06Å; Y313-C345 HydrophobicContact CD2-CB 3.56Å; Y313-C345 HydrophobicContact CE2-CB 4.3Å; Y313-C345 WeakPolarHBondContact CE2-O 3.28Å; Y313-C345 HydrophobicContact CG-CB 3.68Å
314	N	86.5	Confident	85.9	Confident	21 Å²	21	75.1 Å²	75.1	11%	0.112	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	110.9	174	-176.8	-17.6	0	0	0	108.8	F312 E316 T317 S318 K319 E321	F312-N314 HydrophobicContact CD2-CB 4.39Å; F312-N314 HydrophobicContact CE2-CB 3.55Å; F312-N314 HydrophobicContact CZ-CB 3.73Å; F312-N314 PolarHBondContact O-N 3.14Å; N314-E316 VanDerWaalsContact C-N 3.28Å; N314-E316 PolarHBondContact O-N 2.77Å; N314-E316 WeakPolarHBondContact OD1-CB 3.2Å; N314-E316 PolarHBondContact OD1-N 3.29Å; N314-T317 WeakPolarHBondContact CB-OG1 3.43Å; N314-T317 PolarHBondContact O-N 3.05Å; N314-T317 PolarHBondContact OD1-N 2.82Å; N314-S318 VanDerWaalsContact O-CA 3.27Å; N314-S318 WeakPolarHBondContact O-CA 3.24Å; N314-S318 PolarHBondContact O-N 2.86Å; N314-K319 PolarHBondContact N-O 2.99Å; N314-K319 PolarHBondContact O-N 2.8Å; N314-E321 HydrophobicContact CB-CG 4.18Å; N314-E321 PolarHBondContact ND2-OE1 2.9Å; N314-E321 PolarHBondContact ND2-OE2 3.32Å
315	T	76.9	Confident	86.1	Confident	79 Å²	79	73.9 Å²	73.9	49%	0.485	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-27.8	-179.7	52.3	0	0	0	0	112.7	Y313	Y313-T315 HydrophobicContact CD1-CG2 3.97Å; Y313-T315 HydrophobicContact CE1-CG2 4.02Å
316	E	74	Confident	86.4	Confident	178 Å²	178	66.1 Å²	66.1	83%	0.832	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-37	177.1	-59.8	-177.9	168	0	0	111.7	N314	N314-E316 VanDerWaalsContact C-N 3.28Å; N314-E316 PolarHBondContact O-N 2.77Å; N314-E316 WeakPolarHBondContact OD1-CB 3.2Å; N314-E316 PolarHBondContact OD1-N 3.29Å
317	T	76.7	Confident	86.8	Confident	59 Å²	59	61.6 Å²	61.6	36%	0.362	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.6	-10.8	179.2	64.5	0	0	0	0	113.3	N314 K319 E321	N314-T317 WeakPolarHBondContact CB-OG1 3.43Å; N314-T317 PolarHBondContact O-N 3.05Å; N314-T317 PolarHBondContact OD1-N 2.82Å; T317-K319 PolarHBondContact O-N 2.85Å; T317-K319 PolarHBondContact OG1-N 3.26Å; T317-E321 WeakPolarHBondContact CB-OE1 3.2Å; T317-E321 VanDerWaalsContact CG2-OE1 3.23Å; T317-E321 WeakPolarHBondContact CG2-OE1 3.35Å; T317-E321 PolarHBondContact OG1-OE1 3.46Å
318	S	73.8	Confident	86.6	Confident	71 Å²	71	57.9 Å²	57.9	50%	0.497	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.9	40.2	-168.7	-53.2	0	0	0	0	112.4	Y313 N314	Y313-S318 WeakPolarHBondContact OH-CA 3.27Å; N314-S318 VanDerWaalsContact O-CA 3.27Å; N314-S318 WeakPolarHBondContact O-CA 3.24Å; N314-S318 PolarHBondContact O-N 2.86Å
319	K	81.6	Confident	86.1	Confident	139 Å²	139	61.3 Å²	61.3	60%	0.604	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.9	150.3	-177.8	-71.6	175.6	-176.7	177.6	0	111.7	N314 T317 E321	N314-K319 PolarHBondContact N-O 2.99Å; N314-K319 PolarHBondContact O-N 2.8Å; T317-K319 PolarHBondContact O-N 2.85Å; T317-K319 PolarHBondContact OG1-N 3.26Å; K319-E321 HydrophobicContact CB-CG 4.5Å
320	C	88.5	Confident	85.5	Confident	17 Å²	17	58.3 Å²	58.3	12%	0.115	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	120.5	165.3	-72.7	0	0	0	0	110.5	F312 I338 C341 E342	F312-C320 CarbonylContact O-C 3.43Å; F312-C320 WeakPolarHBondContact O-CA 3.4Å; C320-I338 HydrophobicContact CB-CG1 4.2Å; C320-C341 HydrophobicContact CB-CB 3.67Å; C320-C341 WeakPolarHBondContact CB-SG 3.09Å; C320-C341 WeakPolarHBondContact SG-CB 3.34Å; C320-C341 CovalentContact SG-SG 2.03Å; C320-C341 PolarHBondContact SG-SG 3.42Å; C320-E342 HydrophobicContact CB-CG 4.01Å; C320-E342 PolarHBondContact SG-N 3.08Å
321	E	90.7	Very high	85.1	Confident	62 Å²	62	57 Å²	57	29%	0.29	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	145.6	-177.4	-64.9	-179.7	-179.6	0	0	110.3	F311 F312 N314 T317 K319	F311-E321 CarbonylContact C-O 3.55Å; F311-E321 VanDerWaalsContact CA-O 3.26Å; F311-E321 WeakPolarHBondContact CA-O 3.34Å; F312-E321 HydrophobicContact CD1-CB 4.28Å; F312-E321 VanDerWaalsContact CD1-O 3.28Å; F312-E321 WeakPolarHBondContact CD1-O 3.49Å; F312-E321 HydrophobicContact CE1-CB 3.68Å; F312-E321 HydrophobicContact CZ-CB 4.17Å; F312-E321 PolarHBondContact N-O 3.46Å; F312-E321 PolarHBondContact O-N 3.28Å; N314-E321 HydrophobicContact CB-CG 4.18Å; N314-E321 PolarHBondContact ND2-OE1 2.9Å; N314-E321 PolarHBondContact ND2-OE2 3.32Å; T317-E321 WeakPolarHBondContact CB-OE1 3.2Å; T317-E321 VanDerWaalsContact CG2-OE1 3.23Å; T317-E321 WeakPolarHBondContact CG2-OE1 3.35Å; T317-E321 PolarHBondContact OG1-OE1 3.46Å; K319-E321 HydrophobicContact CB-CG 4.5Å
322	M	94.3	Very high	84.8	Confident	113 Å²	113	61.2 Å²	61.2	56%	0.557	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.5	141.9	174.6	-170.4	-140.9	-59.9	0	0	110.3	N309 R310 F311	N309-M322 HydrophobicContact CB-CG 4.38Å; N309-M322 HydrophobicContact CB-SD 4.31Å; R310-M322 CarbonylContact O-C 3.57Å; R310-M322 VanDerWaalsContact O-CA 3.26Å; R310-M322 WeakPolarHBondContact O-CA 3.38Å; R310-M322 WeakPolarHBondContact O-CG 2.98Å; F311-M322 HydrophobicContact CD1-CB 4.05Å; F311-M322 HydrophobicContact CE1-CB 3.85Å; F311-M322 HydrophobicContact CE1-CG 4.23Å; F311-M322 HydrophobicContact CZ-CG 4.45Å
323	F	92.7	Very high	84.8	Confident	13 Å²	13	60.7 Å²	60.7	6%	0.057	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	161.3	166.4	78.7	-71.6	0	0	0	111.2	K299 E300 I301 R310 F312 Y325 N334	K299-F323 HydrophobicContact CB-CD2 4.36Å; K299-F323 HydrophobicContact CB-CG 4.41Å; K299-F323 HydrophobicContact CD-CB 4.35Å; E300-F323 VanDerWaalsContact O-CE2 3.29Å; E300-F323 WeakPolarHBondContact O-CE2 3.01Å; I301-F323 HydrophobicContact CG1-CD2 4.38Å; R310-F323 HydrophobicContact CB-CD1 3.95Å; R310-F323 HydrophobicContact CB-CE1 3.42Å; R310-F323 VanDerWaalsContact CB-CE1 3.42Å; R310-F323 HydrophobicContact CB-CZ 3.78Å; R310-F323 PolarHBondContact N-O 2.78Å; R310-F323 PolarHBondContact O-N 2.9Å; R310-F323 VanDerWaalsContact O-O 3.1Å; F312-F323 HydrophobicContact CB-CD1 3.89Å; F312-F323 HydrophobicContact CB-CE1 3.86Å; F312-F323 HydrophobicContact CD1-CB 3.96Å; F312-F323 AromaticContact CD1-CD1 3.67Å; F312-F323 HydrophobicContact CD1-CD1 3.67Å; F312-F323 HydrophobicContact CD1-CE1 4.48Å; F312-F323 HydrophobicContact CD1-CG 4.04Å; F312-F323 HydrophobicContact CE1-CB 4.23Å; F312-F323 HydrophobicContact CG-CD1 4.18Å; F323-Y325 HydrophobicContact CE2-CD2 4.34Å; F323-N334 HydrophobicContact CZ-CB 4.14Å
324	I	88.9	Confident	85	Confident	79 Å²	79	60.8 Å²	60.8	41%	0.405	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	119.4	174	-56.1	-61.9	0	0	0	108.3	I301 T307 N309	I301-I324 WeakPolarHBondContact CG2-O 3.5Å; T307-I324 HydrophobicContact CG2-CG2 4.12Å; N309-I324 WeakPolarHBondContact OD1-CD1 3.48Å
325	Y	91.6	Very high	85.3	Confident	29 Å²	29	60.7 Å²	60.7	11%	0.114	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	138	172.6	177.1	-123.1	0	0	0	110.2	E300 I301 T307 V308 R310 F323 G327 C328 G330 N334	E300-Y325 WeakPolarHBondContact O-CD2 3.45Å; I301-Y325 WeakPolarHBondContact O-CD2 3.44Å; T307-Y325 WeakPolarHBondContact CA-O 3.24Å; V308-Y325 PolarHBondContact N-O 2.03Å; V308-Y325 PolarHBondContact O-N 3.35Å; R310-Y325 VanDerWaalsContact CG-CB 3.43Å; R310-Y325 HydrophobicContact CG-CD1 4.11Å; R310-Y325 HydrophobicContact CG-CG 4.11Å; F323-Y325 HydrophobicContact CE2-CD2 4.34Å; Y325-G327 VanDerWaalsContact C-N 3.29Å; Y325-G327 VanDerWaalsContact CE1-CA 3.44Å; Y325-G327 VanDerWaalsContact CZ-C 3.5Å; Y325-G327 PolarHBondContact O-N 3.48Å; Y325-C328 WeakPolarHBondContact CE2-O 3.34Å; Y325-C328 VanDerWaalsContact CZ-N 3.34Å; Y325-C328 WeakPolarHBondContact OH-CA 3.4Å; Y325-C328 PolarHBondContact OH-N 2.81Å; Y325-C328 PolarHBondContact OH-O 2.88Å; Y325-G330 PolarHBondContact OH-N 3.24Å; Y325-N334 WeakPolarHBondContact CD1-ND2 3.26Å; Y325-N334 WeakPolarHBondContact CD2-ND2 3.36Å; Y325-N334 WeakPolarHBondContact CE2-ND2 3.24Å; Y325-N334 VanDerWaalsContact CG-ND2 3.26Å
326	T	87.6	Confident	86	Confident	16 Å²	16	61.2 Å²	61.2	10%	0.098	32%	0.324	C	S	.	.			trans	-88.1	5.4	-172	59.7	0	0	0	0	114.9	I301 G302 N303 C304 E306	I301-T326 HydrophobicContact CG2-CG2 3.62Å; I301-T326 WeakPolarHBondContact O-CB 3.29Å; I301-T326 WeakPolarHBondContact O-CG2 3.37Å; I301-T326 PolarHBondContact O-N 2.67Å; I301-T326 PolarHBondContact O-OG1 3.19Å; G302-T326 VanDerWaalsContact CA-OG1 3.26Å; G302-T326 WeakPolarHBondContact CA-OG1 3.35Å; G302-T326 PolarHBondContact O-OG1 2.82Å; N303-T326 PolarHBondContact N-OG1 2.85Å; C304-T326 CarbonylContact C-O 3.5Å; C304-T326 WeakPolarHBondContact CB-O 3.2Å; C304-T326 PolarHBondContact N-OG1 3.3Å; C304-T326 VanDerWaalsContact O-CB 3.27Å; C304-T326 WeakPolarHBondContact O-CB 3.45Å; E306-T326 CarbonylContact C-O 3.49Å; E306-T326 WeakPolarHBondContact CA-O 3.16Å; E306-T326 WeakPolarHBondContact CB-O 3.09Å; E306-T326 PolarHBondContact N-O 2.84Å; E306-T326 VanDerWaalsContact N-O 3.14Å; E306-T326 CarbonylContact O-C 3.59Å; E306-T326 VanDerWaalsContact O-C 3.29Å; E306-T326 WeakPolarHBondContact O-CA 3.43Å
327	G	82.7	Confident	86.7	Confident	30 Å²	30	55.2 Å²	55.2	31%	0.309	30%	0.3	S	S	.	.	S	Bend	trans	95.8	-15.1	177.2	0	0	0	0	0	114.9	Y325	Y325-G327 VanDerWaalsContact C-N 3.29Å; Y325-G327 VanDerWaalsContact CE1-CA 3.44Å; Y325-G327 VanDerWaalsContact CZ-C 3.5Å; Y325-G327 PolarHBondContact O-N 3.48Å
328	C	80.4	Confident	87.3	Confident	34 Å²	34	55.6 Å²	55.6	23%	0.23	30%	0.299	C	S	.	.	S	Bend	trans	-145.2	172	176.7	78.4	0	0	0	0	112.6	G302 C304 Y325 G330	G302-C328 VanDerWaalsContact CA-O 3.24Å; G302-C328 WeakPolarHBondContact CA-O 3.36Å; C304-C328 HydrophobicContact CB-CB 3.88Å; C304-C328 WeakPolarHBondContact CB-SG 2.98Å; C304-C328 WeakPolarHBondContact SG-CB 2.86Å; C304-C328 CovalentContact SG-SG 2.01Å; C304-C328 PolarHBondContact SG-SG 2.87Å; Y325-C328 WeakPolarHBondContact CE2-O 3.34Å; Y325-C328 VanDerWaalsContact CZ-N 3.34Å; Y325-C328 WeakPolarHBondContact OH-CA 3.4Å; Y325-C328 PolarHBondContact OH-N 2.81Å; Y325-C328 PolarHBondContact OH-O 2.88Å; C328-G330 VanDerWaalsContact C-N 3.31Å; C328-G330 PolarHBondContact O-N 2.84Å
329	E	80.2	Confident	87.6	Confident	126 Å²	126	59.1 Å²	59.1	59%	0.589	31%	0.308	S	S	*	.	S	Bend	trans	53.6	42.3	175.4	-61.7	-174.6	167	0	0	114	N303	N303-E329 PolarHBondContact ND2-OE2 2.87Å
330	G	79.7	Confident	87.8	Confident	31 Å²	31	56.6 Å²	56.6	32%	0.32	30%	0.298	S	S	.	.			trans	-105.7	162	171.2	0	0	0	0	0	112.1	Y325 C328	Y325-G330 PolarHBondContact OH-N 3.24Å; C328-G330 VanDerWaalsContact C-N 3.31Å; C328-G330 PolarHBondContact O-N 2.84Å
331	N	84.6	Confident	87.8	Confident	28 Å²	28	55.8 Å²	55.8	15%	0.15	29%	0.293	C	S	.	.			trans	-100.7	-175.3	174.5	69.9	33.7	0	0	0	111.5	Q297 P298 E300 N333 N334	Q297-N331 PolarHBondContact OE1-OD1 2.78Å; P298-N331 PolarHBondContact O-ND2 2.95Å; P298-N331 PolarHBondContact O-OD1 3Å; E300-N331 WeakPolarHBondContact CG-ND2 3.36Å; E300-N331 PolarHBondContact OE1-ND2 3.47Å; E300-N331 PolarHBondContact OE2-N 3.28Å; N331-N333 PolarHBondContact O-N 3.32Å; N331-N333 WeakPolarHBondContact OD1-CB 3.1Å; N331-N333 PolarHBondContact OD1-N 3.46Å; N331-N334 WeakPolarHBondContact O-CB 3.2Å
332	E	88.1	Confident	87.5	Confident	128 Å²	128	57.5 Å²	57.5	60%	0.598	30%	0.301	S	S	*	.	S	Bend	trans	-72.9	-13.8	-174.3	-60.6	-171.4	157.4	0	0	113.1	P294 N334	P294-E332 HydrophobicContact CB-CB 3.62Å; P294-E332 WeakPolarHBondContact CB-O 3.32Å; P294-E332 HydrophobicContact CG-CB 4.03Å; E332-N334 PolarHBondContact O-N 2.93Å
333	N	91.6	Very high	86.8	Confident	0 Å²	0	61 Å²	61	0%	0	31%	0.313	C	S	.	.	S	Bend	trans	-75.3	46.5	171.5	-152.1	3.6	0	0	0	112	P294 C295 Q297 F312 Y313 N331 F335	P294-N333 WeakPolarHBondContact O-CB 3.28Å; C295-N333 PolarHBondContact O-ND2 2.97Å; Q297-N333 HydrophobicContact CB-CB 4.13Å; Q297-N333 PolarHBondContact O-ND2 2.78Å; F312-N333 WeakPolarHBondContact CA-O 3.34Å; F312-N333 WeakPolarHBondContact CA-OD1 3.32Å; F312-N333 HydrophobicContact CB-CB 4.4Å; F312-N333 WeakPolarHBondContact CB-O 3.46Å; Y313-N333 PolarHBondContact N-ND2 2.7Å; Y313-N333 PolarHBondContact N-OD1 3Å; Y313-N333 PolarHBondContact O-ND2 3.06Å; N331-N333 PolarHBondContact O-N 3.32Å; N331-N333 WeakPolarHBondContact OD1-CB 3.1Å; N331-N333 PolarHBondContact OD1-N 3.46Å; N333-F335 WeakPolarHBondContact OD1-CE2 3.39Å
334	N	93.1	Very high	86.1	Confident	23 Å²	23	66.9 Å²	66.9	12%	0.123	34%	0.335	C	S	.	.			trans	-140.5	88.3	-171.5	-176	-26.8	0	0	0	109.5	R310 F323 Y325 N331 E332	R310-N334 WeakPolarHBondContact CB-OD1 3.24Å; R310-N334 WeakPolarHBondContact CD-OD1 3.13Å; R310-N334 WeakPolarHBondContact CG-OD1 3.23Å; R310-N334 PolarHBondContact NH1-OD1 3.15Å; F323-N334 HydrophobicContact CZ-CB 4.14Å; Y325-N334 WeakPolarHBondContact CD1-ND2 3.26Å; Y325-N334 WeakPolarHBondContact CD2-ND2 3.36Å; Y325-N334 WeakPolarHBondContact CE2-ND2 3.24Å; Y325-N334 VanDerWaalsContact CG-ND2 3.26Å; N331-N334 WeakPolarHBondContact O-CB 3.2Å; E332-N334 PolarHBondContact O-N 2.93Å
335	F	93.2	Very high	85.7	Confident	20 Å²	20	63.4 Å²	63.4	9%	0.088	32%	0.317	C	S	.	.	B	Isolated β-bridge	trans	-98.5	146.4	-175.3	-57.8	-77.6	0	0	0	111.8	P294 R310 F311 N333 E340 C341 R344 C345	P294-F335 HydrophobicContact CB-CZ 4.05Å; R310-F335 WeakPolarHBondContact CA-O 3.16Å; R310-F335 WeakPolarHBondContact CD-O 3.34Å; F311-F335 HydrophobicContact CB-CB 4.3Å; F311-F335 PolarHBondContact N-O 3.47Å; F311-F335 WeakPolarHBondContact O-CD2 3.07Å; F311-F335 PolarHBondContact O-N 3.38Å; N333-F335 WeakPolarHBondContact OD1-CE2 3.39Å; F335-E340 HydrophobicContact CB-CB 4.25Å; F335-E340 HydrophobicContact CD1-CB 4.25Å; F335-C341 HydrophobicContact CB-CB 3.8Å; F335-C341 HydrophobicContact CD1-CB 4.48Å; F335-C341 HydrophobicContact CD2-CB 3.38Å; F335-C341 VanDerWaalsContact CD2-SG 3.53Å; F335-C341 HydrophobicContact CE2-CB 4.08Å; F335-C341 HydrophobicContact CG-CB 3.62Å; F335-R344 HydrophobicContact CE1-CB 3.78Å; F335-R344 HydrophobicContact CE1-CG 3.75Å; F335-R344 HydrophobicContact CZ-CB 4.08Å; F335-R344 HydrophobicContact CZ-CG 3.98Å; F335-C345 WeakPolarHBondContact CE2-SG 3.35Å; F335-C345 WeakPolarHBondContact CZ-SG 3.28Å
336	N	90.9	Very high	84.4	Confident	89 Å²	89	68 Å²	68	48%	0.476	34%	0.344	S	S	.	.	S	Bend	trans	-74.8	-34.3	179.1	-58.4	-56.8	0	0	0	111.5	R310 E340	R310-N336 PolarHBondContact NH1-OD1 3.05Å; R310-N336 PolarHBondContact NH2-OD1 3.2Å; N336-E340 WeakPolarHBondContact CB-OE2 3.12Å; N336-E340 PolarHBondContact N-OE2 2.01Å; N336-E340 VanDerWaalsContact N-OE2 3.11Å; N336-E340 PolarHBondContact ND2-OE2 3.24Å
337	T	89.4	Confident	82.8	Confident	53 Å²	53	70.1 Å²	70.1	33%	0.325	36%	0.358	S	S	.	.	S	Bend	trans	-127.9	154.7	-178.9	70.8	0	0	0	0	111	F311 E339 E340 C341	F311-T337 VanDerWaalsContact CD2-C 3.4Å; T337-E339 VanDerWaalsContact C-N 3.25Å; T337-E339 PolarHBondContact O-N 3.3Å; T337-E340 PolarHBondContact O-N 3.02Å; T337-E340 WeakPolarHBondContact OG1-CB 3.43Å; T337-E340 VanDerWaalsContact OG1-CG 3.28Å; T337-E340 WeakPolarHBondContact OG1-CG 3.36Å; T337-E340 PolarHBondContact OG1-N 2.74Å; T337-C341 PolarHBondContact O-N 3.14Å
338	I	89	Confident	81.6	Confident	67 Å²	67	74 Å²	74	34%	0.344	37%	0.37	S	S	.	.	H	α-helix	trans	-61.3	-37.9	173.2	-167.2	168.1	0	0	0	111.1	F311 C320 E340 C341 E342	F311-I338 HydrophobicContact CD1-CB 3.78Å; F311-I338 HydrophobicContact CD1-CD1 4.45Å; F311-I338 HydrophobicContact CD1-CG1 4.1Å; F311-I338 HydrophobicContact CE1-CB 3.74Å; F311-I338 HydrophobicContact CE1-CD1 4.33Å; F311-I338 HydrophobicContact CE1-CG1 4.28Å; F311-I338 HydrophobicContact CE2-CB 4.47Å; F311-I338 HydrophobicContact CG-CB 4.18Å; F311-I338 HydrophobicContact CZ-CB 4.1Å; C320-I338 HydrophobicContact CB-CG1 4.2Å; I338-E340 PolarHBondContact O-N 2.83Å; I338-C341 WeakPolarHBondContact O-CB 3.37Å; I338-C341 PolarHBondContact O-N 3.3Å; I338-E342 HydrophobicContact CG1-CG 4.15Å; I338-E342 WeakPolarHBondContact O-CB 3.07Å; I338-E342 WeakPolarHBondContact O-CG 3.12Å; I338-E342 PolarHBondContact O-N 2.82Å
339	E	81.1	Confident	81.1	Confident	144 Å²	144	74.9 Å²	74.9	67%	0.673	37%	0.373	S	S	*	.	H	α-helix	trans	-64.1	-37.3	178.3	-65.4	170.4	177.3	0	0	112.4	T337 K343	T337-E339 VanDerWaalsContact C-N 3.25Å; T337-E339 PolarHBondContact O-N 3.3Å; E339-K343 WeakPolarHBondContact O-CB 3.48Å; E339-K343 PolarHBondContact O-N 2.89Å
340	E	86	Confident	80.8	Confident	86 Å²	86	69.2 Å²	69.2	40%	0.402	35%	0.347	S	S	.	.	H	α-helix	trans	-64.1	-45.8	173.1	-80.1	173.7	-179.9	0	0	111.1	F335 N336 T337 I338 R344	F335-E340 HydrophobicContact CB-CB 4.25Å; F335-E340 HydrophobicContact CD1-CB 4.25Å; N336-E340 WeakPolarHBondContact CB-OE2 3.12Å; N336-E340 PolarHBondContact N-OE2 2.01Å; N336-E340 VanDerWaalsContact N-OE2 3.11Å; N336-E340 PolarHBondContact ND2-OE2 3.24Å; T337-E340 PolarHBondContact O-N 3.02Å; T337-E340 WeakPolarHBondContact OG1-CB 3.43Å; T337-E340 VanDerWaalsContact OG1-CG 3.28Å; T337-E340 WeakPolarHBondContact OG1-CG 3.36Å; T337-E340 PolarHBondContact OG1-N 2.74Å; I338-E340 PolarHBondContact O-N 2.83Å; E340-R344 WeakPolarHBondContact O-CB 3.35Å; E340-R344 PolarHBondContact O-N 3.24Å
341	C	87.1	Confident	81.1	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-61.1	-54.5	176.2	-178.1	0	0	0	0	110.5	F311 C320 F335 T337 I338 K343 R344 C345	F311-C341 HydrophobicContact CB-CB 4.1Å; C320-C341 HydrophobicContact CB-CB 3.67Å; C320-C341 WeakPolarHBondContact CB-SG 3.09Å; C320-C341 WeakPolarHBondContact SG-CB 3.34Å; C320-C341 CovalentContact SG-SG 2.03Å; C320-C341 PolarHBondContact SG-SG 3.42Å; F335-C341 HydrophobicContact CB-CB 3.8Å; F335-C341 HydrophobicContact CD1-CB 4.48Å; F335-C341 HydrophobicContact CD2-CB 3.38Å; F335-C341 VanDerWaalsContact CD2-SG 3.53Å; F335-C341 HydrophobicContact CE2-CB 4.08Å; F335-C341 HydrophobicContact CG-CB 3.62Å; T337-C341 PolarHBondContact O-N 3.14Å; I338-C341 WeakPolarHBondContact O-CB 3.37Å; I338-C341 PolarHBondContact O-N 3.3Å; C341-K343 VanDerWaalsContact C-N 3.32Å; C341-K343 PolarHBondContact O-N 3.3Å; C341-R344 PolarHBondContact O-N 3.23Å; C341-R344 VanDerWaalsContact O-N 3.13Å; C341-C345 WeakPolarHBondContact O-CA 3.37Å; C341-C345 WeakPolarHBondContact O-CB 3.46Å; C341-C345 PolarHBondContact O-N 2.96Å; C341-C345 PolarHBondContact O-SG 2.74Å
342	E	85.3	Confident	81	Confident	99 Å²	99	71.3 Å²	71.3	46%	0.463	35%	0.352	S	S	.	.	H	α-helix	trans	-60	-42.1	-178.4	-72.8	177.3	165.9	0	0	111	C320 I338 R344 D346	C320-E342 HydrophobicContact CB-CG 4.01Å; C320-E342 PolarHBondContact SG-N 3.08Å; I338-E342 HydrophobicContact CG1-CG 4.15Å; I338-E342 WeakPolarHBondContact O-CB 3.07Å; I338-E342 WeakPolarHBondContact O-CG 3.12Å; I338-E342 PolarHBondContact O-N 2.82Å; E342-R344 PolarHBondContact O-N 3.29Å; E342-D346 VanDerWaalsContact O-CA 3.23Å; E342-D346 WeakPolarHBondContact O-CA 3.14Å; E342-D346 WeakPolarHBondContact O-CB 3.34Å; E342-D346 PolarHBondContact O-N 2.78Å
343	K	78.7	Confident	80.5	Confident	185 Å²	185	66.7 Å²	66.7	80%	0.804	33%	0.33	S	S	*	.	H	α-helix	trans	-68.1	-35.6	177.4	-177	179.3	179.3	-178.8	0	113.2	E339 C341	E339-K343 WeakPolarHBondContact O-CB 3.48Å; E339-K343 PolarHBondContact O-N 2.89Å; C341-K343 VanDerWaalsContact C-N 3.32Å; C341-K343 PolarHBondContact O-N 3.3Å
344	R	79.6	Confident	80	Confident	138 Å²	138	71.6 Å²	71.6	52%	0.521	36%	0.362	S	S	.	.	H	α-helix	trans	-84.3	-31.6	-176.4	-170	66.4	169.3	170.1	-4.7	112.4	R291 F335 E340 C341 E342	R291-R344 VanDerWaalsContact NH1-NH2 3.18Å; F335-R344 HydrophobicContact CE1-CB 3.78Å; F335-R344 HydrophobicContact CE1-CG 3.75Å; F335-R344 HydrophobicContact CZ-CB 4.08Å; F335-R344 HydrophobicContact CZ-CG 3.98Å; E340-R344 WeakPolarHBondContact O-CB 3.35Å; E340-R344 PolarHBondContact O-N 3.24Å; C341-R344 PolarHBondContact O-N 3.23Å; C341-R344 VanDerWaalsContact O-N 3.13Å; E342-R344 PolarHBondContact O-N 3.29Å
345	C	79.6	Confident	79.5	Confident	6 Å²	6	76 Å²	76	4%	0.041	38%	0.38	C	S	.	.	H	α-helix	trans	-114.3	6.8	-171.8	-57.9	0	0	0	0	113.4	C295 Y313 F335 C341 P347	C295-C345 HydrophobicContact CB-CB 3.48Å; C295-C345 VanDerWaalsContact CB-CB 3.48Å; C295-C345 WeakPolarHBondContact CB-SG 3.31Å; C295-C345 WeakPolarHBondContact SG-CA 3.08Å; C295-C345 WeakPolarHBondContact SG-CB 3.38Å; C295-C345 CovalentContact SG-SG 2.01Å; C295-C345 PolarHBondContact SG-SG 2.82Å; Y313-C345 HydrophobicContact CD2-CB 3.56Å; Y313-C345 HydrophobicContact CE2-CB 4.3Å; Y313-C345 WeakPolarHBondContact CE2-O 3.28Å; Y313-C345 HydrophobicContact CG-CB 3.68Å; F335-C345 WeakPolarHBondContact CE2-SG 3.35Å; F335-C345 WeakPolarHBondContact CZ-SG 3.28Å; C341-C345 WeakPolarHBondContact O-CA 3.37Å; C341-C345 WeakPolarHBondContact O-CB 3.46Å; C341-C345 PolarHBondContact O-N 2.96Å; C341-C345 PolarHBondContact O-SG 2.74Å; C345-P347 WeakPolarHBondContact O-CD 3.28Å
346	D	64	Low	78.7	Confident	124 Å²	124	78.6 Å²	78.6	66%	0.663	39%	0.394	S	S	*	.			trans	-49.6	112.1	173.2	-147.5	-0.2	0	0	0	106	E342 I348	E342-D346 VanDerWaalsContact O-CA 3.23Å; E342-D346 WeakPolarHBondContact O-CA 3.14Å; E342-D346 WeakPolarHBondContact O-CB 3.34Å; E342-D346 PolarHBondContact O-N 2.78Å; D346-I348 PolarHBondContact O-N 3.34Å
347	P	55.3	Low	78	Confident	62 Å²	62	77.1 Å²	77.1	40%	0.403	39%	0.388	S	S	.	.			trans	-55.5	124.1	-177.6	14.8	-24.6	0	0	0	106.5	C345 D349	C345-P347 WeakPolarHBondContact O-CD 3.28Å; P347-D349 PolarHBondContact O-N 2.8Å
348	I	57.9	Low	77	Confident	111 Å²	111	76.6 Å²	76.6	57%	0.569	39%	0.393	S	S	*	.			trans	-47.6	116.5	169.3	-61.4	174	0	0	0	104.4	D346 A350 D352 Q353	D346-I348 PolarHBondContact O-N 3.34Å; I348-A350 PolarHBondContact O-N 2.73Å; I348-A350 VanDerWaalsContact O-N 3.16Å; I348-D352 HydrophobicContact CG2-CB 3.92Å; I348-Q353 HydrophobicContact CB-CG 4.02Å; I348-Q353 HydrophobicContact CG2-CB 4.49Å; I348-Q353 HydrophobicContact CG2-CG 3.64Å; I348-Q353 PolarHBondContact O-NE2 3.34Å; I348-Q353 VanDerWaalsContact O-NE2 3.1Å
349	D	68.6	Low	75.6	Confident	53 Å²	53	80.4 Å²	80.4	28%	0.283	40%	0.403	S	S	.	.			trans	-45.8	131.7	-176.4	-171.1	-40	0	0	0	106.4	P347 C351 D352 Q353 K404	P347-D349 PolarHBondContact O-N 2.8Å; D349-C351 CarbonylContact O-C 3.51Å; D349-C351 PolarHBondContact O-N 3.41Å; D349-C351 WeakPolarHBondContact OD1-CB 3.46Å; D349-C351 PolarHBondContact OD1-N 2.96Å; D349-C351 VanDerWaalsContact OD1-N 3.08Å; D349-C351 PolarHBondContact OD1-SG 3.28Å; D349-D352 HydrophobicContact CB-CB 4.21Å; D349-D352 WeakPolarHBondContact O-CA 3.05Å; D349-D352 PolarHBondContact O-N 3.41Å; D349-Q353 PolarHBondContact O-N 2.94Å; D349-K404 IonicContact OD1-NZ 3.58Å; D349-K404 PolarHBondContact OD1-NZ 2.9Å; D349-K404 IonicContact OD2-NZ 3.54Å; D349-K404 PolarHBondContact OD2-NZ 3.27Å
350	A	75	Confident	74.9	Confident	6 Å²	6	78.5 Å²	78.5	5%	0.05	40%	0.397	C	S	.	.	T	Hydrogen-bonded Turn	trans	-43.2	-35	178.6	0	0	0	0	0	111.7	I348 D388 N389	I348-A350 PolarHBondContact O-N 2.73Å; I348-A350 VanDerWaalsContact O-N 3.16Å; A350-D388 HydrophobicContact CB-CB 3.41Å; A350-D388 VanDerWaalsContact CB-CB 3.41Å; A350-N389 WeakPolarHBondContact O-CA 3.42Å; A350-N389 WeakPolarHBondContact O-CB 3.41Å; A350-N389 VanDerWaalsContact O-CG 3.28Å; A350-N389 PolarHBondContact O-N 2.94Å
351	C	86	Confident	74	Confident	4 Å²	4	80 Å²	80	3%	0.027	41%	0.407	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76	-24.9	179.5	-49.5	0	0	0	0	114.4	D349 Y369 C401	D349-C351 CarbonylContact O-C 3.51Å; D349-C351 PolarHBondContact O-N 3.41Å; D349-C351 WeakPolarHBondContact OD1-CB 3.46Å; D349-C351 PolarHBondContact OD1-N 2.96Å; D349-C351 VanDerWaalsContact OD1-N 3.08Å; D349-C351 PolarHBondContact OD1-SG 3.28Å; C351-Y369 HydrophobicContact CB-CD1 3.69Å; C351-Y369 HydrophobicContact CB-CE1 4.22Å; C351-Y369 HydrophobicContact CB-CG 4.2Å; C351-Y369 VanDerWaalsContact O-CD1 3.3Å; C351-Y369 WeakPolarHBondContact O-CD1 3.15Å; C351-C401 VanDerWaalsContact CA-SG 3.57Å; C351-C401 HydrophobicContact CB-CB 3.62Å; C351-C401 WeakPolarHBondContact CB-SG 3.33Å; C351-C401 WeakPolarHBondContact SG-CA 3.3Å; C351-C401 WeakPolarHBondContact SG-CB 3.41Å; C351-C401 CovalentContact SG-SG 2.03Å; C351-C401 PolarHBondContact SG-SG 3.43Å
352	D	81.5	Confident	73.3	Confident	100 Å²	100	84.7 Å²	84.7	54%	0.535	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-11.7	177.9	-67.4	-29.6	0	0	0	112.9	I348 D349	I348-D352 HydrophobicContact CG2-CB 3.92Å; D349-D352 HydrophobicContact CB-CB 4.21Å; D349-D352 WeakPolarHBondContact O-CA 3.05Å; D349-D352 PolarHBondContact O-N 3.41Å
353	Q	78.8	Confident	73.1	Confident	31 Å²	31	83.8 Å²	83.8	15%	0.145	43%	0.434	C	S	.	.	S	Bend	trans	-67	146.5	173.2	-60.7	176	20.4	0	0	110.5	I348 D349 D388 N389	I348-Q353 HydrophobicContact CB-CG 4.02Å; I348-Q353 HydrophobicContact CG2-CB 4.49Å; I348-Q353 HydrophobicContact CG2-CG 3.64Å; I348-Q353 PolarHBondContact O-NE2 3.34Å; I348-Q353 VanDerWaalsContact O-NE2 3.1Å; D349-Q353 PolarHBondContact O-N 2.94Å; Q353-D388 PolarHBondContact NE2-OD2 3.49Å; Q353-N389 HydrophobicContact CB-CB 4.11Å; Q353-N389 PolarHBondContact O-ND2 2.86Å
354	P	79.9	Confident	73.5	Confident	103 Å²	103	77.4 Å²	77.4	67%	0.669	41%	0.411	S	S	*	.	P	Polyproline II helix	trans	-69.3	161.8	178.4	29.5	-35.8	0	0	0	112	L356 N387	P354-L356 PolarHBondContact O-N 2.9Å; P354-N387 PolarHBondContact O-ND2 2.93Å
355	K	82.5	Confident	74.1	Confident	116 Å²	116	76 Å²	76	50%	0.504	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-65.3	124.6	169.1	72.6	-173.1	-179.1	-173.8	0	110.6	F368	K355-F368 HydrophobicContact CB-CB 4.16Å; K355-F368 HydrophobicContact CB-CD1 3.83Å; K355-F368 HydrophobicContact CB-CD2 3.57Å; K355-F368 HydrophobicContact CB-CE1 4.12Å; K355-F368 HydrophobicContact CB-CE2 3.87Å; K355-F368 HydrophobicContact CB-CG 3.56Å; K355-F368 HydrophobicContact CB-CZ 4.16Å; K355-F368 HydrophobicContact CD-CD1 4.13Å; K355-F368 HydrophobicContact CD-CD2 4.47Å; K355-F368 HydrophobicContact CD-CE1 3.6Å; K355-F368 HydrophobicContact CD-CE2 3.96Å; K355-F368 HydrophobicContact CD-CZ 3.52Å; K355-F368 HydrophobicContact CG-CE2 4.36Å; K355-F368 HydrophobicContact CG-CZ 4.38Å
356	L	77.1	Confident	74.8	Confident	74 Å²	74	78 Å²	78	39%	0.387	42%	0.417	S	S	.	.			trans	-104.2	97.9	177.6	-177.9	64	0	0	0	110.3	P354 F379 F381 E385 N387	P354-L356 PolarHBondContact O-N 2.9Å; L356-F379 VanDerWaalsContact O-CE2 3.29Å; L356-F379 WeakPolarHBondContact O-CE2 3.45Å; L356-F381 WeakPolarHBondContact O-CD2 3.31Å; L356-E385 WeakPolarHBondContact CD2-O 3.26Å; L356-N387 HydrophobicContact CB-CB 4.47Å; L356-N387 HydrophobicContact CD2-CB 4.21Å
357	V	76.2	Confident	76.3	Confident	58 Å²	58	74.3 Å²	74.3	35%	0.352	39%	0.394	S	S	.	.			trans	-69.2	-41	178.3	175.9	0	0	0	0	111.1	F379 I380 G382	V357-F379 HydrophobicContact CG2-CD2 4.2Å; V357-I380 WeakPolarHBondContact CG1-O 3Å; V357-G382 PolarHBondContact O-N 2.89Å
358	G	68.4	Low	78.1	Confident	41 Å²	41	71.9 Å²	71.9	42%	0.423	38%	0.377	S	S	.	.			trans	65.2	178.5	-172.7	0	0	0	0	0	113.3
359	R	58.6	Low	79.8	Confident	147 Å²	147	67.4 Å²	67.4	56%	0.555	35%	0.353	S	S	*	.			trans	-75.9	126	174.6	-175.2	176.6	178.4	173	-0.2	109.8	L361 G382	R359-L361 VanDerWaalsContact C-N 3.31Å; R359-L361 HydrophobicContact CG-CG 4.33Å; R359-L361 PolarHBondContact O-N 2.62Å; R359-G382 CarbonylContact O-C 3.43Å; R359-G382 WeakPolarHBondContact O-CA 3.29Å; R359-G382 VanDerWaalsContact O-O 3.07Å
360	I	67.2	Low	80.8	Confident	104 Å²	104	66 Å²	66	53%	0.533	35%	0.346	S	S	.	.			trans	-73.4	80.6	-176.1	-50.1	176.1	0	0	0	110.5	P363	I360-P363 HydrophobicContact CG2-CB 3.69Å; I360-P363 HydrophobicContact CG2-CG 4.03Å
361	L	67.2	Low	81.3	Confident	119 Å²	119	68.1 Å²	68.1	62%	0.623	36%	0.36	S	S	*	.	S	Bend	trans	-95.5	-39	169.9	-65.8	177.3	0	0	0	110.7	R359 G382	R359-L361 VanDerWaalsContact C-N 3.31Å; R359-L361 HydrophobicContact CG-CG 4.33Å; R359-L361 PolarHBondContact O-N 2.62Å; L361-G382 PolarHBondContact N-O 3.14Å
362	D	71.4	Confident	81	Confident	98 Å²	98	76.3 Å²	76.3	52%	0.524	40%	0.398	S	S	.	.	S	Bend	trans	-133.2	88.9	175	-171.3	13.9	0	0	0	109.4	V364 F381 G382 G383	D362-V364 PolarHBondContact O-N 2.95Å; D362-F381 VanDerWaalsContact O-O 3.1Å; D362-G382 PolarHBondContact N-O 2.01Å; D362-G382 CarbonylContact O-C 3.52Å; D362-G382 VanDerWaalsContact O-C 3.24Å; D362-G383 PolarHBondContact O-N 2.75Å
363	P	82	Confident	81.4	Confident	79 Å²	79	74.4 Å²	74.4	51%	0.513	39%	0.39	S	S	.	.			trans	-67.1	114.6	-176.5	23.5	-29.7	0	0	0	111.6	I360 I380 F381	I360-P363 HydrophobicContact CG2-CB 3.69Å; I360-P363 HydrophobicContact CG2-CG 4.03Å; P363-I380 HydrophobicContact CB-CG2 3.61Å; P363-F381 CarbonylContact C-O 3.55Å; P363-F381 WeakPolarHBondContact CA-O 3.5Å
364	V	86.8	Confident	81.7	Confident	51 Å²	51	78.7 Å²	78.7	31%	0.309	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	131	175.8	-177.5	0	0	0	0	109.3	D362 R366 F381	D362-V364 PolarHBondContact O-N 2.95Å; V364-R366 HydrophobicContact CG1-CG 4.47Å; V364-R366 PolarHBondContact O-N 2.91Å; V364-F381 PolarHBondContact N-O 3.45Å; V364-F381 PolarHBondContact O-N 3.08Å
365	E	92.1	Very high	82.3	Confident	110 Å²	110	82 Å²	82	51%	0.514	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	129	171.5	-173	179.9	107.3	0	0	110.1	Y367 A378 I380	E365-Y367 PolarHBondContact OE1-OH 3.1Å; E365-A378 HydrophobicContact CG-CB 4.41Å; E365-I380 HydrophobicContact CB-CD1 4.49Å
366	R	94.1	Very high	82.9	Confident	47 Å²	47	77 Å²	77	18%	0.177	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	169.3	179.4	-66.4	-64.4	-170.9	112.3	-0.2	109.4	V364 A378 F379 F381 N390 F391	V364-R366 HydrophobicContact CG1-CG 4.47Å; V364-R366 PolarHBondContact O-N 2.91Å; R366-A378 CarbonylContact O-C 3.47Å; R366-A378 VanDerWaalsContact O-CA 3.3Å; R366-A378 WeakPolarHBondContact O-CA 3.37Å; R366-F379 HydrophobicContact CB-CD1 4.04Å; R366-F379 HydrophobicContact CB-CE1 3.49Å; R366-F379 VanDerWaalsContact CB-CE1 3.49Å; R366-F379 HydrophobicContact CB-CZ 3.8Å; R366-F379 PolarHBondContact N-O 2.9Å; R366-F379 WeakPolarHBondContact O-CD1 3.36Å; R366-F379 PolarHBondContact O-N 2.77Å; R366-F379 VanDerWaalsContact O-O 3.1Å; R366-F381 HydrophobicContact CB-CB 4.12Å; R366-F381 HydrophobicContact CG-CB 3.57Å; R366-F381 HydrophobicContact CG-CD1 4.3Å; R366-F381 HydrophobicContact CG-CG 4.23Å; R366-N390 WeakPolarHBondContact CB-OD1 3.19Å; R366-N390 VanDerWaalsContact CD-OD1 3.24Å; R366-N390 WeakPolarHBondContact CD-OD1 2.99Å; R366-N390 WeakPolarHBondContact CG-OD1 2.99Å; R366-N390 PolarHBondContact NH1-OD1 3.48Å; R366-F391 WeakPolarHBondContact CA-O 3.36Å; R366-F391 WeakPolarHBondContact CD-O 3.3Å
367	Y	95.4	Very high	83.7	Confident	46 Å²	46	76.3 Å²	76.3	18%	0.18	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	141	179.8	-65.2	-96.1	0	0	0	109.9	E365 E377 A378 F391 K394	E365-Y367 PolarHBondContact OE1-OH 3.1Å; Y367-E377 WeakPolarHBondContact CA-O 3.49Å; Y367-A378 HydrophobicContact CD1-CB 4.06Å; Y367-A378 HydrophobicContact CE1-CB 3.72Å; Y367-F391 PolarHBondContact N-O 3.36Å; Y367-F391 WeakPolarHBondContact O-CB 2.94Å; Y367-F391 WeakPolarHBondContact O-CD2 3.5Å; Y367-F391 PolarHBondContact O-N 3.02Å; Y367-K394 HydrophobicContact CD1-CB 3.65Å; Y367-K394 HydrophobicContact CD1-CG 4.02Å; Y367-K394 HydrophobicContact CE1-CB 3.66Å; Y367-K394 HydrophobicContact CE1-CD 4.36Å; Y367-K394 HydrophobicContact CE1-CG 4.18Å; Y367-K394 HydrophobicContact CG-CB 4.11Å
368	F	93.7	Very high	84.6	Confident	12 Å²	12	76.2 Å²	76.2	5%	0.053	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	149.8	172.8	79.9	-77.7	0	0	0	109.5	K355 N370 C376 E377 F379 N389	K355-F368 HydrophobicContact CB-CB 4.16Å; K355-F368 HydrophobicContact CB-CD1 3.83Å; K355-F368 HydrophobicContact CB-CD2 3.57Å; K355-F368 HydrophobicContact CB-CE1 4.12Å; K355-F368 HydrophobicContact CB-CE2 3.87Å; K355-F368 HydrophobicContact CB-CG 3.56Å; K355-F368 HydrophobicContact CB-CZ 4.16Å; K355-F368 HydrophobicContact CD-CD1 4.13Å; K355-F368 HydrophobicContact CD-CD2 4.47Å; K355-F368 HydrophobicContact CD-CE1 3.6Å; K355-F368 HydrophobicContact CD-CE2 3.96Å; K355-F368 HydrophobicContact CD-CZ 3.52Å; K355-F368 HydrophobicContact CG-CE2 4.36Å; K355-F368 HydrophobicContact CG-CZ 4.38Å; F368-N370 HydrophobicContact CD2-CB 4.42Å; F368-N370 HydrophobicContact CE2-CB 3.61Å; F368-N370 HydrophobicContact CZ-CB 3.94Å; F368-N370 PolarHBondContact O-N 2.84Å; F368-C376 CarbonylContact O-C 3.56Å; F368-C376 VanDerWaalsContact O-CA 3.32Å; F368-C376 WeakPolarHBondContact O-CA 3.02Å; F368-E377 HydrophobicContact CD1-CB 4.27Å; F368-E377 VanDerWaalsContact CD1-O 3.25Å; F368-E377 WeakPolarHBondContact CD1-O 2.99Å; F368-E377 HydrophobicContact CE1-CB 3.63Å; F368-E377 HydrophobicContact CZ-CB 3.99Å; F368-E377 PolarHBondContact N-O 3.09Å; F368-E377 PolarHBondContact O-N 2.88Å; F368-F379 HydrophobicContact CB-CD1 4.07Å; F368-F379 HydrophobicContact CB-CE1 3.91Å; F368-F379 HydrophobicContact CD1-CB 4.13Å; F368-F379 AromaticContact CD1-CD1 3.64Å; F368-F379 HydrophobicContact CD1-CD1 3.64Å; F368-F379 HydrophobicContact CD1-CE1 4.34Å; F368-F379 HydrophobicContact CD1-CG 4.09Å; F368-F379 HydrophobicContact CE1-CB 4.34Å; F368-F379 HydrophobicContact CG-CD1 4.29Å; F368-N389 WeakPolarHBondContact CA-O 3.3Å; F368-N389 HydrophobicContact CB-CB 4.49Å; F368-N389 WeakPolarHBondContact CB-O 3.37Å
369	Y	92.8	Very high	85.7	Confident	16 Å²	16	75.1 Å²	75.1	6%	0.063	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	115.7	170.9	-179.1	-105.2	0	0	0	109.9	C351 S371 K374 N389 C397 C401 V402	C351-Y369 HydrophobicContact CB-CD1 3.69Å; C351-Y369 HydrophobicContact CB-CE1 4.22Å; C351-Y369 HydrophobicContact CB-CG 4.2Å; C351-Y369 VanDerWaalsContact O-CD1 3.3Å; C351-Y369 WeakPolarHBondContact O-CD1 3.15Å; Y369-S371 PolarHBondContact O-N 2.73Å; Y369-K374 VanDerWaalsContact OH-CD 3.3Å; Y369-K374 WeakPolarHBondContact OH-CD 3.39Å; Y369-N389 PolarHBondContact N-OD1 3.2Å; Y369-N389 PolarHBondContact O-ND2 3.06Å; Y369-C397 PolarHBondContact N-SG 2.72Å; Y369-C401 HydrophobicContact CD1-CB 4.05Å; Y369-C401 HydrophobicContact CD2-CB 3.45Å; Y369-C401 VanDerWaalsContact CD2-CB 3.45Å; Y369-C401 HydrophobicContact CE2-CB 4.09Å; Y369-C401 HydrophobicContact CG-CB 3.41Å; Y369-C401 VanDerWaalsContact CG-CB 3.41Å; Y369-V402 HydrophobicContact CD2-CG2 3.94Å; Y369-V402 HydrophobicContact CE2-CG2 3.82Å
370	N	91.1	Very high	87.1	Confident	23 Å²	23	72 Å²	72	12%	0.123	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	110.9	172.6	-177.3	-27.8	0	0	0	108.9	F368 E372 T373 K374 R375 E377	F368-N370 HydrophobicContact CD2-CB 4.42Å; F368-N370 HydrophobicContact CE2-CB 3.61Å; F368-N370 HydrophobicContact CZ-CB 3.94Å; F368-N370 PolarHBondContact O-N 2.84Å; N370-E372 VanDerWaalsContact C-N 3.29Å; N370-E372 PolarHBondContact O-N 3.33Å; N370-E372 WeakPolarHBondContact OD1-CA 3.42Å; N370-E372 WeakPolarHBondContact OD1-CB 3.48Å; N370-E372 PolarHBondContact OD1-N 3.41Å; N370-T373 VanDerWaalsContact CB-OG1 3.26Å; N370-T373 WeakPolarHBondContact CB-OG1 3.09Å; N370-T373 PolarHBondContact O-N 3.2Å; N370-T373 PolarHBondContact OD1-N 3.39Å; N370-T373 VanDerWaalsContact OD1-N 3.09Å; N370-K374 VanDerWaalsContact O-CA 3.25Å; N370-K374 WeakPolarHBondContact O-CA 3.4Å; N370-K374 PolarHBondContact O-N 2.8Å; N370-R375 WeakPolarHBondContact CB-O 3.49Å; N370-R375 PolarHBondContact N-O 3.23Å; N370-R375 PolarHBondContact O-N 3.19Å; N370-E377 HydrophobicContact CB-CG 4.26Å; N370-E377 VanDerWaalsContact ND2-CD 3.3Å; N370-E377 PolarHBondContact ND2-OE1 2.83Å; N370-E377 VanDerWaalsContact ND2-OE1 3.12Å; N370-E377 PolarHBondContact ND2-OE2 3.06Å
371	S	84.2	Confident	87.9	Confident	51 Å²	51	67.2 Å²	67.2	36%	0.357	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-20.8	-177.9	62.5	0	0	0	0	113.7	Y369 K374	Y369-S371 PolarHBondContact O-N 2.73Å; S371-K374 WeakPolarHBondContact O-CD 3.42Å; S371-K374 WeakPolarHBondContact O-CE 3.31Å; S371-K374 PolarHBondContact O-NZ 2.92Å
372	E	80.6	Confident	88.4	Confident	176 Å²	176	61.6 Å²	61.6	82%	0.822	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-46.7	174.2	-59.1	-177.6	166.3	0	0	111	N370	N370-E372 VanDerWaalsContact C-N 3.29Å; N370-E372 PolarHBondContact O-N 3.33Å; N370-E372 WeakPolarHBondContact OD1-CA 3.42Å; N370-E372 WeakPolarHBondContact OD1-CB 3.48Å; N370-E372 PolarHBondContact OD1-N 3.41Å
373	T	89.7	Confident	87.9	Confident	60 Å²	60	58 Å²	58	37%	0.368	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-12	-178.7	67	0	0	0	0	113.2	N370 R375 E377	N370-T373 VanDerWaalsContact CB-OG1 3.26Å; N370-T373 WeakPolarHBondContact CB-OG1 3.09Å; N370-T373 PolarHBondContact O-N 3.2Å; N370-T373 PolarHBondContact OD1-N 3.39Å; N370-T373 VanDerWaalsContact OD1-N 3.09Å; T373-R375 VanDerWaalsContact C-N 3.28Å; T373-R375 PolarHBondContact O-N 2.76Å; T373-E377 WeakPolarHBondContact CB-OE1 3.44Å; T373-E377 WeakPolarHBondContact CG2-OE1 3.15Å; T373-E377 PolarHBondContact OG1-OE1 2.81Å
374	K	85.4	Confident	87.1	Confident	122 Å²	122	60.9 Å²	60.9	53%	0.53	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.4	38.4	-173.9	-55.7	-63.6	-177.6	-157.4	0	112.5	Y369 N370 S371	Y369-K374 VanDerWaalsContact OH-CD 3.3Å; Y369-K374 WeakPolarHBondContact OH-CD 3.39Å; N370-K374 VanDerWaalsContact O-CA 3.25Å; N370-K374 WeakPolarHBondContact O-CA 3.4Å; N370-K374 PolarHBondContact O-N 2.8Å; S371-K374 WeakPolarHBondContact O-CD 3.42Å; S371-K374 WeakPolarHBondContact O-CE 3.31Å; S371-K374 PolarHBondContact O-NZ 2.92Å
375	R	91	Very high	86.2	Confident	173 Å²	173	64 Å²	64	65%	0.653	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.8	152.5	-175.3	-69.6	174.7	-179.4	-171.4	-1	111.7	N370 T373	N370-R375 WeakPolarHBondContact CB-O 3.49Å; N370-R375 PolarHBondContact N-O 3.23Å; N370-R375 PolarHBondContact O-N 3.19Å; T373-R375 VanDerWaalsContact C-N 3.28Å; T373-R375 PolarHBondContact O-N 2.76Å
376	C	94.9	Very high	85.3	Confident	11 Å²	11	62.2 Å²	62.2	7%	0.074	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	118.3	166.9	-69.3	0	0	0	0	110	F368 K394 C397 E398	F368-C376 CarbonylContact O-C 3.56Å; F368-C376 VanDerWaalsContact O-CA 3.32Å; F368-C376 WeakPolarHBondContact O-CA 3.02Å; C376-K394 HydrophobicContact CB-CG 4.23Å; C376-C397 HydrophobicContact CB-CB 3.66Å; C376-C397 WeakPolarHBondContact CB-SG 3.47Å; C376-C397 WeakPolarHBondContact SG-CB 3.07Å; C376-C397 PolarHBondContact SG-O 3.49Å; C376-C397 CovalentContact SG-SG 2.03Å; C376-C397 PolarHBondContact SG-SG 3.22Å; C376-E398 HydrophobicContact CB-CG 3.96Å; C376-E398 PolarHBondContact SG-N 3.3Å; C376-E398 VanDerWaalsContact SG-N 3.36Å
377	E	95	Very high	84.4	Confident	59 Å²	59	61.6 Å²	61.6	28%	0.276	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	140.1	-176.7	-70.1	173.5	-166.3	0	0	109.7	Y367 F368 N370 T373	Y367-E377 WeakPolarHBondContact CA-O 3.49Å; F368-E377 HydrophobicContact CD1-CB 4.27Å; F368-E377 VanDerWaalsContact CD1-O 3.25Å; F368-E377 WeakPolarHBondContact CD1-O 2.99Å; F368-E377 HydrophobicContact CE1-CB 3.63Å; F368-E377 HydrophobicContact CZ-CB 3.99Å; F368-E377 PolarHBondContact N-O 3.09Å; F368-E377 PolarHBondContact O-N 2.88Å; N370-E377 HydrophobicContact CB-CG 4.26Å; N370-E377 VanDerWaalsContact ND2-CD 3.3Å; N370-E377 PolarHBondContact ND2-OE1 2.83Å; N370-E377 VanDerWaalsContact ND2-OE1 3.12Å; N370-E377 PolarHBondContact ND2-OE2 3.06Å; T373-E377 WeakPolarHBondContact CB-OE1 3.44Å; T373-E377 WeakPolarHBondContact CG2-OE1 3.15Å; T373-E377 PolarHBondContact OG1-OE1 2.81Å
378	A	94.9	Very high	84	Confident	56 Å²	56	63.7 Å²	63.7	46%	0.463	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	147.1	174.8	0	0	0	0	0	110.8	E365 R366 Y367	E365-A378 HydrophobicContact CG-CB 4.41Å; R366-A378 CarbonylContact O-C 3.47Å; R366-A378 VanDerWaalsContact O-CA 3.3Å; R366-A378 WeakPolarHBondContact O-CA 3.37Å; Y367-A378 HydrophobicContact CD1-CB 4.06Å; Y367-A378 HydrophobicContact CE1-CB 3.72Å
379	F	91.9	Very high	83.8	Confident	17 Å²	17	63.2 Å²	63.2	8%	0.075	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	161	171.2	78.2	-73.1	0	0	0	110.7	L356 V357 R366 F368 F381 N390	L356-F379 VanDerWaalsContact O-CE2 3.29Å; L356-F379 WeakPolarHBondContact O-CE2 3.45Å; V357-F379 HydrophobicContact CG2-CD2 4.2Å; R366-F379 HydrophobicContact CB-CD1 4.04Å; R366-F379 HydrophobicContact CB-CE1 3.49Å; R366-F379 VanDerWaalsContact CB-CE1 3.49Å; R366-F379 HydrophobicContact CB-CZ 3.8Å; R366-F379 PolarHBondContact N-O 2.9Å; R366-F379 WeakPolarHBondContact O-CD1 3.36Å; R366-F379 PolarHBondContact O-N 2.77Å; R366-F379 VanDerWaalsContact O-O 3.1Å; F368-F379 HydrophobicContact CB-CD1 4.07Å; F368-F379 HydrophobicContact CB-CE1 3.91Å; F368-F379 HydrophobicContact CD1-CB 4.13Å; F368-F379 AromaticContact CD1-CD1 3.64Å; F368-F379 HydrophobicContact CD1-CD1 3.64Å; F368-F379 HydrophobicContact CD1-CE1 4.34Å; F368-F379 HydrophobicContact CD1-CG 4.09Å; F368-F379 HydrophobicContact CE1-CB 4.34Å; F368-F379 HydrophobicContact CG-CD1 4.29Å; F379-F381 HydrophobicContact CE2-CB 3.88Å; F379-F381 HydrophobicContact CE2-CD2 4.31Å; F379-F381 HydrophobicContact CZ-CB 4.23Å; F379-N390 HydrophobicContact CZ-CB 4.26Å
380	I	87.9	Confident	83.7	Confident	81 Å²	81	63 Å²	63	42%	0.415	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	121.4	174.7	-55.6	-56.6	0	0	0	108.7	V357 P363 E365	V357-I380 WeakPolarHBondContact CG1-O 3Å; P363-I380 HydrophobicContact CB-CG2 3.61Å; E365-I380 HydrophobicContact CB-CD1 4.49Å
381	F	84.2	Confident	83.9	Confident	5 Å²	5	62.2 Å²	62.2	2%	0.022	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	137.2	176.1	176.5	-120.2	0	0	0	110.8	L356 D362 P363 V364 R366 F379 G383 H384 P386 N390	L356-F381 WeakPolarHBondContact O-CD2 3.31Å; D362-F381 VanDerWaalsContact O-O 3.1Å; P363-F381 CarbonylContact C-O 3.55Å; P363-F381 WeakPolarHBondContact CA-O 3.5Å; V364-F381 PolarHBondContact N-O 3.45Å; V364-F381 PolarHBondContact O-N 3.08Å; R366-F381 HydrophobicContact CB-CB 4.12Å; R366-F381 HydrophobicContact CG-CB 3.57Å; R366-F381 HydrophobicContact CG-CD1 4.3Å; R366-F381 HydrophobicContact CG-CG 4.23Å; F379-F381 HydrophobicContact CE2-CB 3.88Å; F379-F381 HydrophobicContact CE2-CD2 4.31Å; F379-F381 HydrophobicContact CZ-CB 4.23Å; F381-G383 PolarHBondContact O-N 3.1Å; F381-H384 VanDerWaalsContact CZ-O 3.31Å; F381-H384 WeakPolarHBondContact CZ-O 3.36Å; F381-P386 HydrophobicContact CE1-CB 4.31Å; F381-P386 HydrophobicContact CE2-CB 4.38Å; F381-P386 HydrophobicContact CZ-CB 3.89Å; F381-P386 HydrophobicContact CZ-CG 4.46Å; F381-N390 WeakPolarHBondContact CD2-ND2 3.49Å; F381-N390 WeakPolarHBondContact CE2-ND2 3.24Å; F381-N390 VanDerWaalsContact CG-ND2 3.25Å; F381-N390 WeakPolarHBondContact CG-ND2 3.27Å
382	G	76.8	Confident	84.2	Confident	1 Å²	1	66.7 Å²	66.7	1%	0.01	33%	0.333	C	S	.	.			trans	-82.1	0.2	-172.3	0	0	0	0	0	117.1	V357 R359 L361 D362	V357-G382 PolarHBondContact O-N 2.89Å; R359-G382 CarbonylContact O-C 3.43Å; R359-G382 WeakPolarHBondContact O-CA 3.29Å; R359-G382 VanDerWaalsContact O-O 3.07Å; L361-G382 PolarHBondContact N-O 3.14Å; D362-G382 PolarHBondContact N-O 2.01Å; D362-G382 CarbonylContact O-C 3.52Å; D362-G382 VanDerWaalsContact O-C 3.24Å
383	G	62.1	Low	84.9	Confident	23 Å²	23	61.3 Å²	61.3	24%	0.237	31%	0.312	C	S	.	.	S	Bend	trans	102.7	-1.8	164.5	0	0	0	0	0	117.5	D362 F381	D362-G383 PolarHBondContact O-N 2.75Å; F381-G383 PolarHBondContact O-N 3.1Å
384	H	63.6	Low	85	Confident	139 Å²	139	62.5 Å²	62.5	64%	0.644	31%	0.312	S	S	*	.	S	Bend	trans	-137.6	135.9	177.4	-68.8	-70	0	0	0	113.2	F381	F381-H384 VanDerWaalsContact CZ-O 3.31Å; F381-H384 WeakPolarHBondContact CZ-O 3.36Å
385	E	68	Low	85.2	Confident	116 Å²	116	62.6 Å²	62.6	54%	0.542	32%	0.315	S	S	.	.			trans	51.5	73.9	176.1	-61.5	-171.8	179.8	0	0	114.8	R281 L356	R281-E385 IonicContact CZ-OE1 2.64Å; R281-E385 IonicContact NH1-OE1 2.82Å; R281-E385 PolarHBondContact NH1-OE1 2.81Å; R281-E385 IonicContact NH1-OE2 2.77Å; L356-E385 WeakPolarHBondContact CD2-O 3.26Å
386	P	73.4	Confident	85.2	Confident	73 Å²	73	58.2 Å²	58.2	47%	0.474	30%	0.302	S	S	.	.			trans	-65.3	146	174.4	29.4	-34.7	0	0	0	111.1	F381 N390	F381-P386 HydrophobicContact CE1-CB 4.31Å; F381-P386 HydrophobicContact CE2-CB 4.38Å; F381-P386 HydrophobicContact CZ-CB 3.89Å; F381-P386 HydrophobicContact CZ-CG 4.46Å; P386-N390 HydrophobicContact CB-CB 3.71Å; P386-N390 WeakPolarHBondContact CB-ND2 3.44Å
387	N	76.3	Confident	85.1	Confident	33 Å²	33	57.7 Å²	57.7	18%	0.176	30%	0.298	C	S	.	.			trans	-82.7	176.9	160.9	72	-12.7	0	0	0	110.3	P354 L356 N389 N390	P354-N387 PolarHBondContact O-ND2 2.93Å; L356-N387 HydrophobicContact CB-CB 4.47Å; L356-N387 HydrophobicContact CD2-CB 4.21Å; N387-N389 PolarHBondContact O-N 3.44Å; N387-N390 VanDerWaalsContact O-CB 3.26Å; N387-N390 WeakPolarHBondContact O-CB 3.43Å; N387-N390 PolarHBondContact O-N 2.82Å
388	D	85.6	Confident	84.9	Confident	91 Å²	91	58.3 Å²	58.3	49%	0.487	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-15.6	-174.5	-60.4	-51	0	0	0	113.1	A350 Q353 N390 F391	A350-D388 HydrophobicContact CB-CB 3.41Å; A350-D388 VanDerWaalsContact CB-CB 3.41Å; Q353-D388 PolarHBondContact NE2-OD2 3.49Å; D388-N390 PolarHBondContact O-N 2.75Å; D388-F391 WeakPolarHBondContact O-CE1 3.48Å; D388-F391 VanDerWaalsContact O-CZ 3.27Å; D388-F391 WeakPolarHBondContact O-CZ 2.81Å
389	N	90.3	Very high	84.3	Confident	1 Å²	1	63 Å²	63	1%	0.005	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	33.6	171.6	-149.3	2.3	0	0	0	113	A350 Q353 F368 Y369 N387 F391	A350-N389 WeakPolarHBondContact O-CA 3.42Å; A350-N389 WeakPolarHBondContact O-CB 3.41Å; A350-N389 VanDerWaalsContact O-CG 3.28Å; A350-N389 PolarHBondContact O-N 2.94Å; Q353-N389 HydrophobicContact CB-CB 4.11Å; Q353-N389 PolarHBondContact O-ND2 2.86Å; F368-N389 WeakPolarHBondContact CA-O 3.3Å; F368-N389 HydrophobicContact CB-CB 4.49Å; F368-N389 WeakPolarHBondContact CB-O 3.37Å; Y369-N389 PolarHBondContact N-OD1 3.2Å; Y369-N389 PolarHBondContact O-ND2 3.06Å; N387-N389 PolarHBondContact O-N 3.44Å; N389-F391 WeakPolarHBondContact OD1-CE2 3.02Å
390	N	91.6	Very high	83.9	Confident	13 Å²	13	68.4 Å²	68.4	7%	0.07	33%	0.333	C	S	.	.			trans	-129.4	85.9	-177.8	-175.8	-36.5	0	0	0	110	R366 F379 F381 P386 N387 D388	R366-N390 WeakPolarHBondContact CB-OD1 3.19Å; R366-N390 VanDerWaalsContact CD-OD1 3.24Å; R366-N390 WeakPolarHBondContact CD-OD1 2.99Å; R366-N390 WeakPolarHBondContact CG-OD1 2.99Å; R366-N390 PolarHBondContact NH1-OD1 3.48Å; F379-N390 HydrophobicContact CZ-CB 4.26Å; F381-N390 WeakPolarHBondContact CD2-ND2 3.49Å; F381-N390 WeakPolarHBondContact CE2-ND2 3.24Å; F381-N390 VanDerWaalsContact CG-ND2 3.25Å; F381-N390 WeakPolarHBondContact CG-ND2 3.27Å; P386-N390 HydrophobicContact CB-CB 3.71Å; P386-N390 WeakPolarHBondContact CB-ND2 3.44Å; N387-N390 VanDerWaalsContact O-CB 3.26Å; N387-N390 WeakPolarHBondContact O-CB 3.43Å; N387-N390 PolarHBondContact O-N 2.82Å; D388-N390 PolarHBondContact O-N 2.75Å
391	F	93.7	Very high	83.9	Confident	6 Å²	6	64.7 Å²	64.7	3%	0.026	32%	0.315	C	S	.	.	B	Isolated β-bridge	trans	-90.6	144.6	-177.2	-55.1	-70	0	0	0	111.1	R366 Y367 D388 N389 T393 E396 C397 R400	R366-F391 WeakPolarHBondContact CA-O 3.36Å; R366-F391 WeakPolarHBondContact CD-O 3.3Å; Y367-F391 PolarHBondContact N-O 3.36Å; Y367-F391 WeakPolarHBondContact O-CB 2.94Å; Y367-F391 WeakPolarHBondContact O-CD2 3.5Å; Y367-F391 PolarHBondContact O-N 3.02Å; D388-F391 WeakPolarHBondContact O-CE1 3.48Å; D388-F391 VanDerWaalsContact O-CZ 3.27Å; D388-F391 WeakPolarHBondContact O-CZ 2.81Å; N389-F391 WeakPolarHBondContact OD1-CE2 3.02Å; F391-T393 VanDerWaalsContact C-N 3.32Å; F391-E396 HydrophobicContact CB-CB 4.37Å; F391-E396 HydrophobicContact CB-CG 4.34Å; F391-E396 HydrophobicContact CD1-CG 3.81Å; F391-E396 HydrophobicContact CG-CG 4.46Å; F391-C397 HydrophobicContact CB-CB 3.81Å; F391-C397 HydrophobicContact CD2-CB 3.26Å; F391-C397 WeakPolarHBondContact CD2-SG 3.38Å; F391-C397 HydrophobicContact CE2-CB 3.96Å; F391-C397 HydrophobicContact CG-CB 3.6Å; F391-R400 HydrophobicContact CE1-CB 4.22Å; F391-R400 HydrophobicContact CE1-CG 4.21Å; F391-R400 HydrophobicContact CZ-CB 4.33Å; F391-R400 HydrophobicContact CZ-CG 4.24Å
392	K	91.6	Very high	83.8	Confident	145 Å²	145	66 Å²	66	63%	0.63	32%	0.323	S	S	*	.	S	Bend	trans	-74.1	-30.4	177.9	-67.5	176.2	-177.5	173.3	0	111.5	E396	K392-E396 PolarHBondContact N-OE2 3.33Å
393	T	94.1	Very high	83.4	Confident	62 Å²	62	68.8 Å²	68.8	38%	0.38	34%	0.342	S	S	.	.	S	Bend	trans	-131.1	155.2	-177.2	64.7	0	0	0	0	110.5	F391 E395 E396 C397	F391-T393 VanDerWaalsContact C-N 3.32Å; T393-E395 VanDerWaalsContact C-N 3.27Å; T393-E395 PolarHBondContact O-N 3.02Å; T393-E396 WeakPolarHBondContact OG1-CB 3.39Å; T393-E396 PolarHBondContact OG1-N 3.15Å; T393-C397 PolarHBondContact O-N 2.91Å
394	K	93.6	Very high	83.5	Confident	85 Å²	85	73.2 Å²	73.2	37%	0.37	36%	0.355	S	S	.	.	H	α-helix	trans	-63.7	-38.7	175.5	-173.3	177.5	164.9	-169.7	0	110.8	Y367 C376 C397 E398	Y367-K394 HydrophobicContact CD1-CB 3.65Å; Y367-K394 HydrophobicContact CD1-CG 4.02Å; Y367-K394 HydrophobicContact CE1-CB 3.66Å; Y367-K394 HydrophobicContact CE1-CD 4.36Å; Y367-K394 HydrophobicContact CE1-CG 4.18Å; Y367-K394 HydrophobicContact CG-CB 4.11Å; C376-K394 HydrophobicContact CB-CG 4.23Å; K394-C397 WeakPolarHBondContact O-CB 3.27Å; K394-C397 PolarHBondContact O-N 3.37Å; K394-E398 WeakPolarHBondContact CE-OE1 3.4Å; K394-E398 HydrophobicContact CG-CG 4.25Å; K394-E398 IonicContact NZ-OE1 2.77Å; K394-E398 WeakPolarHBondContact O-CG 3.26Å; K394-E398 PolarHBondContact O-N 2.64Å
395	E	88.3	Confident	83.3	Confident	124 Å²	124	70.2 Å²	70.2	58%	0.579	35%	0.349	S	S	*	.	H	α-helix	trans	-63.6	-43.2	-178.9	-65.3	68.6	-151.8	0	0	111.4	T393 C397 E398 E399	T393-E395 VanDerWaalsContact C-N 3.27Å; T393-E395 PolarHBondContact O-N 3.02Å; E395-C397 VanDerWaalsContact C-N 3.32Å; E395-C397 PolarHBondContact O-N 3.46Å; E395-E398 PolarHBondContact O-N 2.88Å; E395-E399 VanDerWaalsContact O-CB 3.32Å; E395-E399 WeakPolarHBondContact O-CB 3.05Å; E395-E399 PolarHBondContact O-N 3.26Å
396	E	91.3	Very high	83.5	Confident	81 Å²	81	68.5 Å²	68.5	38%	0.379	34%	0.343	S	S	.	.	H	α-helix	trans	-60	-43	174.1	-177.6	-173	-175.1	0	0	111.4	F391 K392 T393 R400	F391-E396 HydrophobicContact CB-CB 4.37Å; F391-E396 HydrophobicContact CB-CG 4.34Å; F391-E396 HydrophobicContact CD1-CG 3.81Å; F391-E396 HydrophobicContact CG-CG 4.46Å; K392-E396 PolarHBondContact N-OE2 3.33Å; T393-E396 WeakPolarHBondContact OG1-CB 3.39Å; T393-E396 PolarHBondContact OG1-N 3.15Å; E396-R400 WeakPolarHBondContact O-CB 3.11Å; E396-R400 PolarHBondContact O-N 3.33Å
397	C	93.1	Very high	83.8	Confident	0 Å²	0	69 Å²	69	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-64.2	-46.5	174.7	179.5	0	0	0	0	111.8	Y369 C376 F391 T393 K394 E395 R400 C401	Y369-C397 PolarHBondContact N-SG 2.72Å; C376-C397 HydrophobicContact CB-CB 3.66Å; C376-C397 WeakPolarHBondContact CB-SG 3.47Å; C376-C397 WeakPolarHBondContact SG-CB 3.07Å; C376-C397 PolarHBondContact SG-O 3.49Å; C376-C397 CovalentContact SG-SG 2.03Å; C376-C397 PolarHBondContact SG-SG 3.22Å; F391-C397 HydrophobicContact CB-CB 3.81Å; F391-C397 HydrophobicContact CD2-CB 3.26Å; F391-C397 WeakPolarHBondContact CD2-SG 3.38Å; F391-C397 HydrophobicContact CE2-CB 3.96Å; F391-C397 HydrophobicContact CG-CB 3.6Å; T393-C397 PolarHBondContact O-N 2.91Å; K394-C397 WeakPolarHBondContact O-CB 3.27Å; K394-C397 PolarHBondContact O-N 3.37Å; E395-C397 VanDerWaalsContact C-N 3.32Å; E395-C397 PolarHBondContact O-N 3.46Å; C397-R400 PolarHBondContact O-N 2.74Å; C397-C401 WeakPolarHBondContact O-CA 3.47Å; C397-C401 WeakPolarHBondContact O-CB 3.42Å; C397-C401 PolarHBondContact O-N 3.14Å
398	E	89.8	Confident	84.3	Confident	72 Å²	72	68.5 Å²	68.5	34%	0.336	34%	0.34	S	S	.	.	I	π-helix	trans	-67	-42.7	-177.1	-73.4	-175.3	157.5	0	0	111.5	C376 K394 E395 R400 V402 S403	C376-E398 HydrophobicContact CB-CG 3.96Å; C376-E398 PolarHBondContact SG-N 3.3Å; C376-E398 VanDerWaalsContact SG-N 3.36Å; K394-E398 WeakPolarHBondContact CE-OE1 3.4Å; K394-E398 HydrophobicContact CG-CG 4.25Å; K394-E398 IonicContact NZ-OE1 2.77Å; K394-E398 WeakPolarHBondContact O-CG 3.26Å; K394-E398 PolarHBondContact O-N 2.64Å; E395-E398 PolarHBondContact O-N 2.88Å; E398-R400 VanDerWaalsContact C-N 3.33Å; E398-R400 PolarHBondContact O-N 3.25Å; E398-V402 HydrophobicContact CB-CB 4.24Å; E398-V402 HydrophobicContact CB-CG2 4.27Å; E398-V402 HydrophobicContact CG-CB 4.43Å; E398-V402 HydrophobicContact CG-CG2 4Å; E398-V402 CarbonylContact O-C 3.54Å; E398-V402 WeakPolarHBondContact O-CA 3.5Å; E398-V402 WeakPolarHBondContact O-CB 3.15Å; E398-V402 PolarHBondContact O-N 2.82Å; E398-S403 PolarHBondContact O-N 3.43Å
399	E	83.4	Confident	84.7	Confident	154 Å²	154	64.4 Å²	64.4	72%	0.72	32%	0.319	S	S	*	.	I	π-helix	trans	-61.8	-42.5	174.3	-173.6	-179.7	-170	0	0	111	E395 S403	E395-E399 VanDerWaalsContact O-CB 3.32Å; E395-E399 WeakPolarHBondContact O-CB 3.05Å; E395-E399 PolarHBondContact O-N 3.26Å; E399-S403 WeakPolarHBondContact O-CB 3.45Å; E399-S403 PolarHBondContact O-OG 3.11Å
400	R	83.8	Confident	84.8	Confident	132 Å²	132	68.6 Å²	68.6	50%	0.498	34%	0.344	S	S	.	.	I	π-helix	trans	-77.7	-34.4	-177.5	-172.7	148.6	170.3	128.2	-0.7	113.8	F391 E396 C397 E398 K404	F391-R400 HydrophobicContact CE1-CB 4.22Å; F391-R400 HydrophobicContact CE1-CG 4.21Å; F391-R400 HydrophobicContact CZ-CB 4.33Å; F391-R400 HydrophobicContact CZ-CG 4.24Å; E396-R400 WeakPolarHBondContact O-CB 3.11Å; E396-R400 PolarHBondContact O-N 3.33Å; C397-R400 PolarHBondContact O-N 2.74Å; E398-R400 VanDerWaalsContact C-N 3.33Å; E398-R400 PolarHBondContact O-N 3.25Å; R400-K404 VanDerWaalsContact O-CD 3.3Å; R400-K404 WeakPolarHBondContact O-CD 3.32Å; R400-K404 WeakPolarHBondContact O-CE 3.15Å; R400-K404 WeakPolarHBondContact O-CG 3.32Å
401	C	87	Confident	84.8	Confident	3 Å²	3	70.1 Å²	70.1	2%	0.02	35%	0.352	C	S	.	.	I	π-helix	trans	-119.2	-42.8	-167.1	-61.8	0	0	0	0	114.7	C351 Y369 C397	C351-C401 VanDerWaalsContact CA-SG 3.57Å; C351-C401 HydrophobicContact CB-CB 3.62Å; C351-C401 WeakPolarHBondContact CB-SG 3.33Å; C351-C401 WeakPolarHBondContact SG-CA 3.3Å; C351-C401 WeakPolarHBondContact SG-CB 3.41Å; C351-C401 CovalentContact SG-SG 2.03Å; C351-C401 PolarHBondContact SG-SG 3.43Å; Y369-C401 HydrophobicContact CD1-CB 4.05Å; Y369-C401 HydrophobicContact CD2-CB 3.45Å; Y369-C401 VanDerWaalsContact CD2-CB 3.45Å; Y369-C401 HydrophobicContact CE2-CB 4.09Å; Y369-C401 HydrophobicContact CG-CB 3.41Å; Y369-C401 VanDerWaalsContact CG-CB 3.41Å; C397-C401 WeakPolarHBondContact O-CA 3.47Å; C397-C401 WeakPolarHBondContact O-CB 3.42Å; C397-C401 PolarHBondContact O-N 3.14Å
402	V	82.5	Confident	84.8	Confident	33 Å²	33	74.3 Å²	74.3	20%	0.2	38%	0.38	C	S	.	.	I	π-helix	trans	-76.9	-39.7	-179.5	179.8	0	0	0	0	110.4	Y369 E398 K404 S405	Y369-V402 HydrophobicContact CD2-CG2 3.94Å; Y369-V402 HydrophobicContact CE2-CG2 3.82Å; E398-V402 HydrophobicContact CB-CB 4.24Å; E398-V402 HydrophobicContact CB-CG2 4.27Å; E398-V402 HydrophobicContact CG-CB 4.43Å; E398-V402 HydrophobicContact CG-CG2 4Å; E398-V402 CarbonylContact O-C 3.54Å; E398-V402 WeakPolarHBondContact O-CA 3.5Å; E398-V402 WeakPolarHBondContact O-CB 3.15Å; E398-V402 PolarHBondContact O-N 2.82Å; V402-K404 PolarHBondContact O-N 3.2Å; V402-S405 WeakPolarHBondContact O-CB 3.45Å; V402-S405 PolarHBondContact O-N 2.7Å; V402-S405 PolarHBondContact O-OG 3.21Å
403	S	67.7	Low	84.9	Confident	58 Å²	58	72.5 Å²	72.5	41%	0.406	37%	0.372	S	S	.	.	G	3₁₀ helix	trans	-59.9	-31.7	179.6	84.6	0	0	0	0	112.9	E398 E399 S405 I406	E398-S403 PolarHBondContact O-N 3.43Å; E399-S403 WeakPolarHBondContact O-CB 3.45Å; E399-S403 PolarHBondContact O-OG 3.11Å; S403-S405 PolarHBondContact O-N 3.22Å; S403-I406 PolarHBondContact O-N 3.28Å; S403-I406 VanDerWaalsContact O-N 3.16Å
404	K	64.6	Low	84.9	Confident	117 Å²	117	70.4 Å²	70.4	51%	0.509	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-61.8	-29.3	175.1	-71.4	-178.4	178.3	177.7	0	112.9	D349 R400 V402 I406	D349-K404 IonicContact OD1-NZ 3.58Å; D349-K404 PolarHBondContact OD1-NZ 2.9Å; D349-K404 IonicContact OD2-NZ 3.54Å; D349-K404 PolarHBondContact OD2-NZ 3.27Å; R400-K404 VanDerWaalsContact O-CD 3.3Å; R400-K404 WeakPolarHBondContact O-CD 3.32Å; R400-K404 WeakPolarHBondContact O-CE 3.15Å; R400-K404 WeakPolarHBondContact O-CG 3.32Å; V402-K404 PolarHBondContact O-N 3.2Å; K404-I406 VanDerWaalsContact C-N 3.3Å
405	S	59.2	Low	84.9	Confident	75 Å²	75	69.1 Å²	69.1	52%	0.524	36%	0.362	S	S	.	.	G	3₁₀ helix	trans	-76	-20.2	179.3	75.5	0	0	0	0	113.1	V402 S403 N407	V402-S405 WeakPolarHBondContact O-CB 3.45Å; V402-S405 PolarHBondContact O-N 2.7Å; V402-S405 PolarHBondContact O-OG 3.21Å; S403-S405 PolarHBondContact O-N 3.22Å; S405-N407 PolarHBondContact O-N 3.31Å
406	I	72	Confident	85	Confident	81 Å²	81	64.4 Å²	64.4	42%	0.415	35%	0.346	S	S	.	.	S	Bend	trans	-83.4	111.5	176.4	-60.4	171.7	0	0	0	106.8	S403 K404 P408 L411	S403-I406 PolarHBondContact O-N 3.28Å; S403-I406 VanDerWaalsContact O-N 3.16Å; K404-I406 VanDerWaalsContact C-N 3.3Å; I406-P408 WeakPolarHBondContact O-CD 3.43Å; I406-L411 HydrophobicContact CG2-CD1 4.29Å; I406-L411 HydrophobicContact CG2-CD2 3.87Å; I406-L411 HydrophobicContact CG2-CG 4.18Å
407	N	81.1	Confident	84.9	Confident	84 Å²	84	70.7 Å²	70.7	45%	0.449	37%	0.366	S	S	.	.			trans	-55.3	113.9	174.1	-178.3	-10.8	0	0	0	108.8	S405 C409 T410	S405-N407 PolarHBondContact O-N 3.31Å; N407-C409 PolarHBondContact O-N 2.79Å; N407-C409 WeakPolarHBondContact OD1-CB 3.4Å; N407-C409 PolarHBondContact OD1-N 3.31Å; N407-C409 PolarHBondContact OD1-SG 3.46Å; N407-T410 HydrophobicContact CB-CG2 4.05Å; N407-T410 PolarHBondContact O-N 3.42Å; N407-T410 PolarHBondContact O-OG1 3.45Å
408	P	87	Confident	84.8	Confident	22 Å²	22	73.5 Å²	73.5	14%	0.143	39%	0.385	C	S	.	.	G	3₁₀ helix	trans	-54.2	-33.5	-179.3	-28.2	37.3	0	0	0	112.1	I406 T410 L411 A446 N447 F449	I406-P408 WeakPolarHBondContact O-CD 3.43Å; P408-T410 PolarHBondContact O-N 2.05Å; P408-T410 VanDerWaalsContact O-N 3.12Å; P408-L411 WeakPolarHBondContact O-CB 3.21Å; P408-L411 PolarHBondContact O-N 2.98Å; P408-L411 VanDerWaalsContact O-N 3.11Å; P408-A446 HydrophobicContact CB-CB 3.73Å; P408-A446 HydrophobicContact CG-CB 3.93Å; P408-N447 WeakPolarHBondContact O-CB 3.06Å; P408-N447 VanDerWaalsContact O-CG 3.31Å; P408-F449 HydrophobicContact CB-CZ 4.37Å
409	C	93.2	Very high	84.6	Confident	5 Å²	5	74.5 Å²	74.5	3%	0.034	41%	0.406	C	S	.	.	G	3₁₀ helix	trans	-70.7	-6.4	-176.2	-45.1	0	0	0	0	113.6	N407 Y427 V429 C459	N407-C409 PolarHBondContact O-N 2.79Å; N407-C409 WeakPolarHBondContact OD1-CB 3.4Å; N407-C409 PolarHBondContact OD1-N 3.31Å; N407-C409 PolarHBondContact OD1-SG 3.46Å; C409-Y427 HydrophobicContact CB-CD1 3.93Å; C409-Y427 HydrophobicContact CB-CG 4.05Å; C409-Y427 WeakPolarHBondContact O-CD1 3.49Å; C409-V429 WeakPolarHBondContact O-CG1 3.29Å; C409-C459 HydrophobicContact CB-CB 3.71Å; C409-C459 WeakPolarHBondContact CB-SG 3.17Å; C409-C459 WeakPolarHBondContact SG-CA 3.18Å; C409-C459 WeakPolarHBondContact SG-CB 3.12Å; C409-C459 CovalentContact SG-SG 2.02Å; C409-C459 PolarHBondContact SG-SG 3.41Å
410	T	91.7	Very high	84.4	Confident	88 Å²	88	68.9 Å²	68.9	54%	0.54	39%	0.386	S	S	.	.	G	3₁₀ helix	trans	-96.5	-7.7	173.7	63.3	0	0	0	0	113.1	N407 P408	N407-T410 HydrophobicContact CB-CG2 4.05Å; N407-T410 PolarHBondContact O-N 3.42Å; N407-T410 PolarHBondContact O-OG1 3.45Å; P408-T410 PolarHBondContact O-N 2.05Å; P408-T410 VanDerWaalsContact O-N 3.12Å
411	L	92.1	Very high	84.6	Confident	46 Å²	46	71.5 Å²	71.5	24%	0.241	40%	0.397	C	S	.	.	S	Bend	trans	-82.3	150.6	-179.1	-57.5	172.8	0	0	0	111.2	I406 P408 N445 A446 N447	I406-L411 HydrophobicContact CG2-CD1 4.29Å; I406-L411 HydrophobicContact CG2-CD2 3.87Å; I406-L411 HydrophobicContact CG2-CG 4.18Å; P408-L411 WeakPolarHBondContact O-CB 3.21Å; P408-L411 PolarHBondContact O-N 2.98Å; P408-L411 VanDerWaalsContact O-N 3.11Å; L411-N445 HydrophobicContact CD1-CB 4.1Å; L411-A446 HydrophobicContact CD1-CB 4.1Å; L411-N447 HydrophobicContact CB-CB 4.05Å; L411-N447 PolarHBondContact O-ND2 3.35Å
412	P	93.3	Very high	84.6	Confident	93 Å²	93	75.8 Å²	75.8	60%	0.604	42%	0.415	S	S	*	.	P	Polyproline II helix	trans	-70.7	162.3	173.7	30.3	-35.6	0	0	0	111.5	A414 N445	P412-A414 PolarHBondContact O-N 2.82Å; P412-N445 PolarHBondContact O-ND2 2.85Å; P412-N445 PolarHBondContact O-OD1 2.72Å
413	K	93.5	Very high	84.8	Confident	108 Å²	108	78.1 Å²	78.1	47%	0.47	42%	0.424	S	S	.	.	P	Polyproline II helix	trans	-61.5	137.4	167.1	66.4	-174.3	175.2	-168.5	0	110.8	P415 F426 F437	K413-P415 WeakPolarHBondContact O-CD 3.22Å; K413-F426 HydrophobicContact CB-CB 4.27Å; K413-F426 HydrophobicContact CB-CD1 3.78Å; K413-F426 HydrophobicContact CB-CD2 3.71Å; K413-F426 HydrophobicContact CB-CE1 4.03Å; K413-F426 HydrophobicContact CB-CE2 3.94Å; K413-F426 HydrophobicContact CB-CG 3.63Å; K413-F426 HydrophobicContact CB-CZ 4.12Å; K413-F426 HydrophobicContact CD-CD1 4.2Å; K413-F426 HydrophobicContact CD-CE1 3.66Å; K413-F426 HydrophobicContact CD-CE2 4.3Å; K413-F426 HydrophobicContact CD-CZ 3.73Å; K413-F426 HydrophobicContact CG-CE1 4.38Å; K413-F426 HydrophobicContact CG-CE2 4.34Å; K413-F426 HydrophobicContact CG-CZ 4.26Å; K413-F437 HydrophobicContact CB-CB 4.5Å; K413-F437 HydrophobicContact CB-CD1 4.49Å; K413-F437 HydrophobicContact CB-CD2 4.15Å; K413-F437 HydrophobicContact CB-CG 4.13Å; K413-F437 HydrophobicContact CD-CB 4.06Å
414	A	94.6	Very high	86.1	Confident	18 Å²	18	78.1 Å²	78.1	15%	0.149	42%	0.415	C	S	.	.			trans	-123.4	89.3	179	0	0	0	0	0	110.6	P412 G416 F437 Y439 N445	P412-A414 PolarHBondContact O-N 2.82Å; A414-G416 VanDerWaalsContact C-N 3.27Å; A414-G416 PolarHBondContact O-N 2.9Å; A414-F437 WeakPolarHBondContact O-CE2 3.07Å; A414-Y439 WeakPolarHBondContact O-CD2 3.38Å; A414-N445 HydrophobicContact CB-CB 4.35Å
415	P	93.7	Very high	87.5	Confident	58 Å²	58	73.9 Å²	73.9	38%	0.377	40%	0.397	S	S	.	.			trans	-60.5	-34.9	177.1	-25.6	35.6	0	0	0	113.2	K413 F437 V438 T440	K413-P415 WeakPolarHBondContact O-CD 3.22Å; P415-F437 HydrophobicContact CG-CD2 4.38Å; P415-V438 WeakPolarHBondContact CA-O 3.49Å; P415-V438 WeakPolarHBondContact CB-O 3.41Å; P415-T440 WeakPolarHBondContact O-CA 3.33Å; P415-T440 VanDerWaalsContact O-CB 3.26Å; P415-T440 WeakPolarHBondContact O-CB 3.34Å; P415-T440 VanDerWaalsContact O-CG2 3.3Å; P415-T440 WeakPolarHBondContact O-CG2 3.3Å; P415-T440 PolarHBondContact O-N 2.88Å; P415-T440 PolarHBondContact O-OG1 2.66Å
416	G	91.1	Very high	89.2	Confident	24 Å²	24	70.8 Å²	70.8	25%	0.247	37%	0.374	C	S	.	.			trans	74.5	-177.3	-172.3	0	0	0	0	0	114.4	A414 T440 C442	A414-G416 VanDerWaalsContact C-N 3.27Å; A414-G416 PolarHBondContact O-N 2.9Å; G416-T440 VanDerWaalsContact CA-OG1 3.3Å; G416-T440 WeakPolarHBondContact CA-OG1 3.37Å; G416-T440 WeakPolarHBondContact O-CG2 2.89Å; G416-T440 PolarHBondContact O-OG1 2.95Å; G416-C442 WeakPolarHBondContact CA-O 3.49Å
417	R	89	Confident	90.3	Very high	213 Å²	213	69.1 Å²	69.1	80%	0.804	36%	0.363	S	S	*	.	S	Bend	trans	-119.5	11.4	-173.1	-59.9	175.8	-152.2	-107.8	2.8	115	T440 E443	R417-T440 PolarHBondContact N-OG1 3.12Å; R417-T440 VanDerWaalsContact N-OG1 3.15Å; R417-E443 WeakPolarHBondContact CD-OE2 3.3Å; R417-E443 WeakPolarHBondContact CG-OE2 3.43Å; R417-E443 IonicContact NE-OE2 2.6Å; R417-E443 PolarHBondContact NE-OE2 2.89Å
418	C	90.5	Very high	90.8	Very high	59 Å²	59	66.2 Å²	66.2	40%	0.399	35%	0.347	S	S	.	.	S	Bend	trans	-80.9	178.1	-178.8	-80.7	0	0	0	0	112.6	T440 C442	C418-T440 CarbonylContact C-O 3.52Å; C418-T440 WeakPolarHBondContact CB-O 3.34Å; C418-T440 PolarHBondContact N-OG1 2.85Å; C418-T440 VanDerWaalsContact O-CB 3.31Å; C418-T440 WeakPolarHBondContact O-CB 3.38Å; C418-C442 HydrophobicContact CB-CB 3.94Å; C418-C442 WeakPolarHBondContact CB-SG 3.5Å; C418-C442 WeakPolarHBondContact SG-CB 3.38Å; C418-C442 CovalentContact SG-SG 2.01Å; C418-C442 PolarHBondContact SG-SG 3.1Å
419	A	85	Confident	90.8	Very high	94 Å²	94	68.8 Å²	68.8	78%	0.777	36%	0.363	S	S	*	.	S	Bend	trans	-97.5	1.3	-173.8	0	0	0	0	0	114.6
420	A	80.7	Confident	90.5	Very high	36 Å²	36	75.5 Å²	75.5	30%	0.298	40%	0.398	S	S	.	.			trans	-88	167.8	176.9	0	0	0	0	0	110.9	F422 T440	A420-F422 HydrophobicContact CB-CD2 4.05Å; A420-F422 HydrophobicContact CB-CE2 3.36Å; A420-F422 HydrophobicContact CB-CZ 3.87Å; A420-T440 WeakPolarHBondContact CA-O 3.14Å; A420-T440 WeakPolarHBondContact CB-O 3.36Å; A420-T440 PolarHBondContact N-O 3.34Å; A420-T440 CarbonylContact O-C 3.56Å; A420-T440 WeakPolarHBondContact O-CA 3.15Å
421	Y	87.1	Confident	90.3	Very high	187 Å²	187	74.3 Å²	74.3	73%	0.733	39%	0.391	S	S	*	.			trans	-138	101.9	178.1	-68.6	-92.3	0	0	0	109	V438	Y421-V438 HydrophobicContact CD1-CG1 3.54Å; Y421-V438 HydrophobicContact CE1-CG1 4.27Å; Y421-V438 HydrophobicContact CG-CG1 4.43Å
422	F	87.7	Confident	90.1	Very high	92 Å²	92	79.2 Å²	79.2	40%	0.404	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	128.9	177	-57.8	-75.8	0	0	0	109.6	A420 R424 Y439	A420-F422 HydrophobicContact CB-CD2 4.05Å; A420-F422 HydrophobicContact CB-CE2 3.36Å; A420-F422 HydrophobicContact CB-CZ 3.87Å; F422-R424 HydrophobicContact CB-CG 4.3Å; F422-R424 PolarHBondContact O-N 3.17Å; F422-Y439 HydrophobicContact CB-CD1 4.33Å; F422-Y439 AromaticContact CD2-CD1 3.98Å; F422-Y439 HydrophobicContact CD2-CD1 3.98Å; F422-Y439 PolarHBondContact N-O 2.03Å; F422-Y439 PolarHBondContact O-N 2.89Å
423	Q	86.6	Confident	89.9	Confident	83 Å²	83	79.8 Å²	79.8	39%	0.388	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	126.1	167.5	-179	178.3	-16	0	0	108.9	F425 M436	Q423-F425 HydrophobicContact CG-CE2 4.49Å; Q423-M436 HydrophobicContact CG-CG 3.78Å; Q423-M436 HydrophobicContact CG-SD 4.38Å
424	R	94	Very high	89.8	Confident	57 Å²	57	75.2 Å²	75.2	22%	0.215	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	166.1	178.8	-62.4	-65.7	174.9	82.3	-1.9	110.3	F422 M436 F437 Y439 N448 F449	F422-R424 HydrophobicContact CB-CG 4.3Å; F422-R424 PolarHBondContact O-N 3.17Å; R424-M436 CarbonylContact O-C 3.5Å; R424-M436 VanDerWaalsContact O-CA 3.31Å; R424-M436 WeakPolarHBondContact O-CA 3.37Å; R424-F437 HydrophobicContact CB-CD1 3.99Å; R424-F437 HydrophobicContact CB-CE1 3.47Å; R424-F437 VanDerWaalsContact CB-CE1 3.47Å; R424-F437 HydrophobicContact CB-CZ 3.84Å; R424-F437 PolarHBondContact N-O 3.44Å; R424-F437 PolarHBondContact O-N 2.04Å; R424-F437 VanDerWaalsContact O-O 3.08Å; R424-Y439 HydrophobicContact CG-CD1 4.42Å; R424-Y439 HydrophobicContact CG-CG 4.32Å; R424-Y439 VanDerWaalsContact NH1-CD1 3.34Å; R424-N448 VanDerWaalsContact CB-OD1 3.31Å; R424-N448 WeakPolarHBondContact CB-OD1 3.15Å; R424-N448 WeakPolarHBondContact CD-OD1 3.28Å; R424-N448 WeakPolarHBondContact CG-OD1 3.01Å; R424-N448 PolarHBondContact NH1-OD1 3.37Å; R424-F449 CarbonylContact C-O 3.34Å; R424-F449 VanDerWaalsContact CA-O 3.23Å; R424-F449 WeakPolarHBondContact CA-O 3.19Å; R424-F449 WeakPolarHBondContact CB-O 3.11Å; R424-F449 WeakPolarHBondContact CD-O 3.42Å
425	F	94.1	Very high	89.6	Confident	28 Å²	28	77.2 Å²	77.2	12%	0.123	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	145.3	177.7	-61.3	-95.2	0	0	0	109.9	Q423 E435 M436 F449 T451 I452 C455	Q423-F425 HydrophobicContact CG-CE2 4.49Å; F425-E435 CarbonylContact C-O 3.56Å; F425-E435 VanDerWaalsContact CA-O 3.25Å; F425-E435 WeakPolarHBondContact CA-O 3.21Å; F425-M436 HydrophobicContact CD1-CB 4.01Å; F425-M436 HydrophobicContact CE1-CB 3.85Å; F425-M436 HydrophobicContact CE1-CG 4.34Å; F425-F449 HydrophobicContact CB-CB 4.35Å; F425-F449 PolarHBondContact N-O 2.99Å; F425-F449 WeakPolarHBondContact O-CD2 3.48Å; F425-F449 PolarHBondContact O-N 2.66Å; F425-T451 VanDerWaalsContact CD2-C 3.44Å; F425-I452 HydrophobicContact CD1-CB 3.81Å; F425-I452 HydrophobicContact CD1-CD1 4.4Å; F425-I452 HydrophobicContact CD1-CG1 3.98Å; F425-I452 HydrophobicContact CD2-CB 4.46Å; F425-I452 HydrophobicContact CE1-CB 3.75Å; F425-I452 HydrophobicContact CE1-CD1 4.27Å; F425-I452 HydrophobicContact CE1-CG1 4.17Å; F425-I452 HydrophobicContact CE2-CB 4.42Å; F425-I452 HydrophobicContact CG-CB 4.16Å; F425-I452 HydrophobicContact CZ-CB 4.07Å; F425-C455 HydrophobicContact CB-CB 4.12Å
426	F	95.3	Very high	89.4	Confident	11 Å²	11	78.3 Å²	78.3	5%	0.048	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	147.7	174.7	81.5	-74.3	0	0	0	109	K413 N428 C434 E435 F437 N447	K413-F426 HydrophobicContact CB-CB 4.27Å; K413-F426 HydrophobicContact CB-CD1 3.78Å; K413-F426 HydrophobicContact CB-CD2 3.71Å; K413-F426 HydrophobicContact CB-CE1 4.03Å; K413-F426 HydrophobicContact CB-CE2 3.94Å; K413-F426 HydrophobicContact CB-CG 3.63Å; K413-F426 HydrophobicContact CB-CZ 4.12Å; K413-F426 HydrophobicContact CD-CD1 4.2Å; K413-F426 HydrophobicContact CD-CE1 3.66Å; K413-F426 HydrophobicContact CD-CE2 4.3Å; K413-F426 HydrophobicContact CD-CZ 3.73Å; K413-F426 HydrophobicContact CG-CE1 4.38Å; K413-F426 HydrophobicContact CG-CE2 4.34Å; K413-F426 HydrophobicContact CG-CZ 4.26Å; F426-N428 HydrophobicContact CD2-CB 4.47Å; F426-N428 HydrophobicContact CE2-CB 3.66Å; F426-N428 HydrophobicContact CZ-CB 3.78Å; F426-N428 PolarHBondContact O-N 3.42Å; F426-C434 CarbonylContact O-C 3.5Å; F426-C434 WeakPolarHBondContact O-CA 3.21Å; F426-E435 HydrophobicContact CD1-CB 4.19Å; F426-E435 VanDerWaalsContact CD1-O 3.23Å; F426-E435 WeakPolarHBondContact CD1-O 3.24Å; F426-E435 HydrophobicContact CE1-CB 3.6Å; F426-E435 HydrophobicContact CZ-CB 4.14Å; F426-E435 PolarHBondContact N-O 3.09Å; F426-E435 PolarHBondContact O-N 2.85Å; F426-F437 HydrophobicContact CB-CD1 3.98Å; F426-F437 HydrophobicContact CB-CE1 3.92Å; F426-F437 HydrophobicContact CD1-CB 4.14Å; F426-F437 AromaticContact CD1-CD1 3.76Å; F426-F437 HydrophobicContact CD1-CD1 3.76Å; F426-F437 HydrophobicContact CD1-CG 4.2Å; F426-F437 HydrophobicContact CE1-CB 4.4Å; F426-F437 HydrophobicContact CG-CD1 4.26Å; F426-N447 WeakPolarHBondContact CA-OD1 3.47Å; F426-N447 HydrophobicContact CB-CB 4.32Å; F426-N447 WeakPolarHBondContact CB-O 3.48Å
427	Y	94.7	Very high	89.4	Confident	45 Å²	45	77.6 Å²	77.6	18%	0.176	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	117.4	170.6	-179.7	-92.7	0	0	0	109.8	C409 V429 N447 C459 V461	C409-Y427 HydrophobicContact CB-CD1 3.93Å; C409-Y427 HydrophobicContact CB-CG 4.05Å; C409-Y427 WeakPolarHBondContact O-CD1 3.49Å; Y427-V429 HydrophobicContact CD1-CG1 4.11Å; Y427-V429 HydrophobicContact CE1-CG1 4.01Å; Y427-N447 PolarHBondContact N-ND2 3.27Å; Y427-N447 PolarHBondContact N-OD1 2.78Å; Y427-N447 PolarHBondContact O-ND2 3.49Å; Y427-C459 WeakPolarHBondContact CB-SG 3.38Å; Y427-C459 HydrophobicContact CD2-CB 3.59Å; Y427-C459 HydrophobicContact CE2-CB 4.29Å; Y427-C459 HydrophobicContact CG-CB 3.86Å; Y427-V461 HydrophobicContact CD2-CG2 3.72Å; Y427-V461 HydrophobicContact CE2-CG2 3.74Å
428	N	91.5	Very high	89.4	Confident	24 Å²	24	70.6 Å²	70.6	13%	0.128	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	113.8	174.1	-176.3	-24.9	0	0	0	109	F426 D430 T431 K432 R433 E435	F426-N428 HydrophobicContact CD2-CB 4.47Å; F426-N428 HydrophobicContact CE2-CB 3.66Å; F426-N428 HydrophobicContact CZ-CB 3.78Å; F426-N428 PolarHBondContact O-N 3.42Å; N428-D430 PolarHBondContact O-N 2.89Å; N428-D430 WeakPolarHBondContact OD1-CB 3.41Å; N428-D430 PolarHBondContact OD1-N 3.35Å; N428-T431 WeakPolarHBondContact CB-OG1 3.34Å; N428-T431 PolarHBondContact O-N 3.32Å; N428-T431 PolarHBondContact OD1-N 3.47Å; N428-K432 VanDerWaalsContact O-CA 3.24Å; N428-K432 WeakPolarHBondContact O-CA 3.29Å; N428-K432 PolarHBondContact O-N 2.96Å; N428-R433 PolarHBondContact N-O 3.25Å; N428-R433 PolarHBondContact O-N 3.35Å; N428-E435 HydrophobicContact CB-CG 4.16Å; N428-E435 VanDerWaalsContact ND2-CD 3.26Å; N428-E435 PolarHBondContact ND2-OE1 3.15Å; N428-E435 VanDerWaalsContact ND2-OE1 3.16Å; N428-E435 PolarHBondContact ND2-OE2 3.04Å
429	V	88.4	Confident	89.6	Confident	76 Å²	76	69.3 Å²	69.3	46%	0.461	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-29.2	-179.1	-64.8	0	0	0	0	113.1	C409 Y427	C409-V429 WeakPolarHBondContact O-CG1 3.29Å; Y427-V429 HydrophobicContact CD1-CG1 4.11Å; Y427-V429 HydrophobicContact CE1-CG1 4.01Å
430	D	86.5	Confident	89.9	Confident	145 Å²	145	65.6 Å²	65.6	78%	0.775	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-44.7	-177.8	-60.5	-42.7	0	0	0	111	N428	N428-D430 PolarHBondContact O-N 2.89Å; N428-D430 WeakPolarHBondContact OD1-CB 3.41Å; N428-D430 PolarHBondContact OD1-N 3.35Å
431	T	87.4	Confident	90.1	Very high	63 Å²	63	65.5 Å²	65.5	39%	0.387	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-11.5	179.5	66.1	0	0	0	0	113	N428 R433 E435	N428-T431 WeakPolarHBondContact CB-OG1 3.34Å; N428-T431 PolarHBondContact O-N 3.32Å; N428-T431 PolarHBondContact OD1-N 3.47Å; T431-R433 VanDerWaalsContact C-N 3.25Å; T431-R433 WeakPolarHBondContact O-CG 3.18Å; T431-R433 PolarHBondContact O-N 3.13Å; T431-E435 VanDerWaalsContact CB-OE1 3.29Å; T431-E435 WeakPolarHBondContact CB-OE1 3.17Å; T431-E435 WeakPolarHBondContact CG2-OE1 3.44Å; T431-E435 PolarHBondContact OG1-OE1 3.45Å
432	K	88.3	Confident	90.1	Very high	150 Å²	150	58.2 Å²	58.2	65%	0.652	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.1	39.1	-174.6	-57.5	-177	178.3	-176.4	0	112.6	N428	N428-K432 VanDerWaalsContact O-CA 3.24Å; N428-K432 WeakPolarHBondContact O-CA 3.29Å; N428-K432 PolarHBondContact O-N 2.96Å
433	R	87.5	Confident	90	Very high	104 Å²	104	59.4 Å²	59.4	39%	0.392	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	155.1	-175.2	-70.4	179.1	-175.2	-84.6	-2.9	111.1	N428 T431 E435	N428-R433 PolarHBondContact N-O 3.25Å; N428-R433 PolarHBondContact O-N 3.35Å; T431-R433 VanDerWaalsContact C-N 3.25Å; T431-R433 WeakPolarHBondContact O-CG 3.18Å; T431-R433 PolarHBondContact O-N 3.13Å; R433-E435 PolarHBondContact O-N 3.44Å
434	C	92.6	Very high	90	Very high	13 Å²	13	57.2 Å²	57.2	9%	0.088	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	119.7	167.4	-71.3	0	0	0	0	109.9	F426 I452 C455 E456	F426-C434 CarbonylContact O-C 3.5Å; F426-C434 WeakPolarHBondContact O-CA 3.21Å; C434-I452 HydrophobicContact CB-CG1 4.02Å; C434-C455 HydrophobicContact CB-CB 3.68Å; C434-C455 WeakPolarHBondContact CB-SG 3.39Å; C434-C455 WeakPolarHBondContact SG-CB 3.34Å; C434-C455 CovalentContact SG-SG 2.03Å; C434-C455 PolarHBondContact SG-SG 3.3Å; C434-E456 HydrophobicContact CB-CG 4.07Å; C434-E456 PolarHBondContact SG-N 3.34Å
435	E	90.9	Very high	89.8	Confident	59 Å²	59	56.6 Å²	56.6	28%	0.276	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	147.9	-179	-71.9	177.3	-167.4	0	0	110.2	F425 F426 N428 T431 R433	F425-E435 CarbonylContact C-O 3.56Å; F425-E435 VanDerWaalsContact CA-O 3.25Å; F425-E435 WeakPolarHBondContact CA-O 3.21Å; F426-E435 HydrophobicContact CD1-CB 4.19Å; F426-E435 VanDerWaalsContact CD1-O 3.23Å; F426-E435 WeakPolarHBondContact CD1-O 3.24Å; F426-E435 HydrophobicContact CE1-CB 3.6Å; F426-E435 HydrophobicContact CZ-CB 4.14Å; F426-E435 PolarHBondContact N-O 3.09Å; F426-E435 PolarHBondContact O-N 2.85Å; N428-E435 HydrophobicContact CB-CG 4.16Å; N428-E435 VanDerWaalsContact ND2-CD 3.26Å; N428-E435 PolarHBondContact ND2-OE1 3.15Å; N428-E435 VanDerWaalsContact ND2-OE1 3.16Å; N428-E435 PolarHBondContact ND2-OE2 3.04Å; T431-E435 VanDerWaalsContact CB-OE1 3.29Å; T431-E435 WeakPolarHBondContact CB-OE1 3.17Å; T431-E435 WeakPolarHBondContact CG2-OE1 3.44Å; T431-E435 PolarHBondContact OG1-OE1 3.45Å; R433-E435 PolarHBondContact O-N 3.44Å
436	M	88.6	Confident	89.6	Confident	81 Å²	81	58 Å²	58	40%	0.399	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	142.5	177.3	-177.4	-104.4	-72.3	0	0	111.1	Q423 R424 F425 Q503	Q423-M436 HydrophobicContact CG-CG 3.78Å; Q423-M436 HydrophobicContact CG-SD 4.38Å; R424-M436 CarbonylContact O-C 3.5Å; R424-M436 VanDerWaalsContact O-CA 3.31Å; R424-M436 WeakPolarHBondContact O-CA 3.37Å; F425-M436 HydrophobicContact CD1-CB 4.01Å; F425-M436 HydrophobicContact CE1-CB 3.85Å; F425-M436 HydrophobicContact CE1-CG 4.34Å; M436-Q503 HydrophobicContact CE-CB 4.18Å
437	F	91.7	Very high	89.6	Confident	10 Å²	10	57.4 Å²	57.4	4%	0.044	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	163.8	168.2	80	-71.9	0	0	0	111.3	K413 A414 P415 R424 F426 N448	K413-F437 HydrophobicContact CB-CB 4.5Å; K413-F437 HydrophobicContact CB-CD1 4.49Å; K413-F437 HydrophobicContact CB-CD2 4.15Å; K413-F437 HydrophobicContact CB-CG 4.13Å; K413-F437 HydrophobicContact CD-CB 4.06Å; A414-F437 WeakPolarHBondContact O-CE2 3.07Å; P415-F437 HydrophobicContact CG-CD2 4.38Å; R424-F437 HydrophobicContact CB-CD1 3.99Å; R424-F437 HydrophobicContact CB-CE1 3.47Å; R424-F437 VanDerWaalsContact CB-CE1 3.47Å; R424-F437 HydrophobicContact CB-CZ 3.84Å; R424-F437 PolarHBondContact N-O 3.44Å; R424-F437 PolarHBondContact O-N 2.04Å; R424-F437 VanDerWaalsContact O-O 3.08Å; F426-F437 HydrophobicContact CB-CD1 3.98Å; F426-F437 HydrophobicContact CB-CE1 3.92Å; F426-F437 HydrophobicContact CD1-CB 4.14Å; F426-F437 AromaticContact CD1-CD1 3.76Å; F426-F437 HydrophobicContact CD1-CD1 3.76Å; F426-F437 HydrophobicContact CD1-CG 4.2Å; F426-F437 HydrophobicContact CE1-CB 4.4Å; F426-F437 HydrophobicContact CG-CD1 4.26Å; F437-N448 HydrophobicContact CE1-CB 4.47Å; F437-N448 HydrophobicContact CZ-CB 4.02Å
438	V	89.3	Confident	89.6	Confident	65 Å²	65	56.6 Å²	56.6	39%	0.394	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	118.6	175.5	174.7	0	0	0	0	108.8	P415 Y421	P415-V438 WeakPolarHBondContact CA-O 3.49Å; P415-V438 WeakPolarHBondContact CB-O 3.41Å; Y421-V438 HydrophobicContact CD1-CG1 3.54Å; Y421-V438 HydrophobicContact CE1-CG1 4.27Å; Y421-V438 HydrophobicContact CG-CG1 4.43Å
439	Y	93.4	Very high	89.8	Confident	32 Å²	32	56.5 Å²	56.5	13%	0.125	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	129.5	171.5	176.8	-122.9	0	0	0	110.3	A414 F422 R424 G441 C442 G444 N448	A414-Y439 WeakPolarHBondContact O-CD2 3.38Å; F422-Y439 HydrophobicContact CB-CD1 4.33Å; F422-Y439 AromaticContact CD2-CD1 3.98Å; F422-Y439 HydrophobicContact CD2-CD1 3.98Å; F422-Y439 PolarHBondContact N-O 2.03Å; F422-Y439 PolarHBondContact O-N 2.89Å; R424-Y439 HydrophobicContact CG-CD1 4.42Å; R424-Y439 HydrophobicContact CG-CG 4.32Å; R424-Y439 VanDerWaalsContact NH1-CD1 3.34Å; Y439-G441 VanDerWaalsContact C-N 3.29Å; Y439-G441 VanDerWaalsContact CE1-CA 3.48Å; Y439-G441 VanDerWaalsContact CZ-C 3.43Å; Y439-G441 PolarHBondContact O-N 3.22Å; Y439-G441 VanDerWaalsContact OH-C 3.31Å; Y439-G441 PolarHBondContact OH-O 3.45Å; Y439-C442 WeakPolarHBondContact CE2-O 3.38Å; Y439-C442 WeakPolarHBondContact OH-CA 3.36Å; Y439-C442 PolarHBondContact OH-N 2.99Å; Y439-G444 VanDerWaalsContact CE2-CA 3.44Å; Y439-N448 VanDerWaalsContact CD2-ND2 3.31Å; Y439-N448 WeakPolarHBondContact CD2-ND2 3.11Å; Y439-N448 VanDerWaalsContact CG-ND2 3.32Å
440	T	91	Very high	90	Very high	17 Å²	17	59.2 Å²	59.2	10%	0.104	32%	0.319	C	S	.	.			trans	-86.7	0.5	-171	63.4	0	0	0	0	114.3	P415 G416 R417 C418 A420	P415-T440 WeakPolarHBondContact O-CA 3.33Å; P415-T440 VanDerWaalsContact O-CB 3.26Å; P415-T440 WeakPolarHBondContact O-CB 3.34Å; P415-T440 VanDerWaalsContact O-CG2 3.3Å; P415-T440 WeakPolarHBondContact O-CG2 3.3Å; P415-T440 PolarHBondContact O-N 2.88Å; P415-T440 PolarHBondContact O-OG1 2.66Å; G416-T440 VanDerWaalsContact CA-OG1 3.3Å; G416-T440 WeakPolarHBondContact CA-OG1 3.37Å; G416-T440 WeakPolarHBondContact O-CG2 2.89Å; G416-T440 PolarHBondContact O-OG1 2.95Å; R417-T440 PolarHBondContact N-OG1 3.12Å; R417-T440 VanDerWaalsContact N-OG1 3.15Å; C418-T440 CarbonylContact C-O 3.52Å; C418-T440 WeakPolarHBondContact CB-O 3.34Å; C418-T440 PolarHBondContact N-OG1 2.85Å; C418-T440 VanDerWaalsContact O-CB 3.31Å; C418-T440 WeakPolarHBondContact O-CB 3.38Å; A420-T440 WeakPolarHBondContact CA-O 3.14Å; A420-T440 WeakPolarHBondContact CB-O 3.36Å; A420-T440 PolarHBondContact N-O 3.34Å; A420-T440 CarbonylContact O-C 3.56Å; A420-T440 WeakPolarHBondContact O-CA 3.15Å
441	G	86.5	Confident	90.2	Very high	34 Å²	34	54.7 Å²	54.7	35%	0.351	30%	0.297	S	S	.	.	S	Bend	trans	101.4	-12.7	176.2	0	0	0	0	0	115.4	Y439	Y439-G441 VanDerWaalsContact C-N 3.29Å; Y439-G441 VanDerWaalsContact CE1-CA 3.48Å; Y439-G441 VanDerWaalsContact CZ-C 3.43Å; Y439-G441 PolarHBondContact O-N 3.22Å; Y439-G441 VanDerWaalsContact OH-C 3.31Å; Y439-G441 PolarHBondContact OH-O 3.45Å
442	C	85.8	Confident	90.2	Very high	34 Å²	34	54.8 Å²	54.8	23%	0.23	30%	0.295	C	S	.	.	S	Bend	trans	-144.2	173.5	173.4	70.9	0	0	0	0	111.2	G416 C418 Y439 G444	G416-C442 WeakPolarHBondContact CA-O 3.49Å; C418-C442 HydrophobicContact CB-CB 3.94Å; C418-C442 WeakPolarHBondContact CB-SG 3.5Å; C418-C442 WeakPolarHBondContact SG-CB 3.38Å; C418-C442 CovalentContact SG-SG 2.01Å; C418-C442 PolarHBondContact SG-SG 3.1Å; Y439-C442 WeakPolarHBondContact CE2-O 3.38Å; Y439-C442 WeakPolarHBondContact OH-CA 3.36Å; Y439-C442 PolarHBondContact OH-N 2.99Å; C442-G444 PolarHBondContact O-N 3.35Å
443	E	86.4	Confident	90.1	Very high	117 Å²	117	54.4 Å²	54.4	55%	0.547	30%	0.295	S	S	.	.	S	Bend	trans	57.1	31.5	177.5	-60.2	179.8	-173.1	0	0	114	R417	R417-E443 WeakPolarHBondContact CD-OE2 3.3Å; R417-E443 WeakPolarHBondContact CG-OE2 3.43Å; R417-E443 IonicContact NE-OE2 2.6Å; R417-E443 PolarHBondContact NE-OE2 2.89Å
444	G	86	Confident	90.3	Very high	36 Å²	36	53.5 Å²	53.5	37%	0.371	30%	0.295	S	S	.	.			trans	-83	163.9	174	0	0	0	0	0	112.1	Y439 C442	Y439-G444 VanDerWaalsContact CE2-CA 3.44Å; C442-G444 PolarHBondContact O-N 3.35Å
445	N	89.9	Confident	90.3	Very high	44 Å²	44	52.9 Å²	52.9	24%	0.235	29%	0.291	C	S	.	.			trans	-119.2	179.7	166.6	66.9	35.1	0	0	0	110.1	L411 P412 A414 N447 N448	L411-N445 HydrophobicContact CD1-CB 4.1Å; P412-N445 PolarHBondContact O-ND2 2.85Å; P412-N445 PolarHBondContact O-OD1 2.72Å; A414-N445 HydrophobicContact CB-CB 4.35Å; N445-N447 PolarHBondContact O-N 3.41Å; N445-N447 VanDerWaalsContact O-N 3.17Å; N445-N447 WeakPolarHBondContact OD1-CB 3.28Å; N445-N447 PolarHBondContact OD1-N 3.4Å; N445-N448 WeakPolarHBondContact O-CB 3.09Å
446	A	90.2	Very high	90.4	Very high	57 Å²	57	52.8 Å²	52.8	47%	0.471	29%	0.291	S	S	.	.	S	Bend	trans	-66.2	-15.6	-174.3	0	0	0	0	0	114.5	P408 L411 N448	P408-A446 HydrophobicContact CB-CB 3.73Å; P408-A446 HydrophobicContact CG-CB 3.93Å; L411-A446 HydrophobicContact CD1-CB 4.1Å; A446-N448 PolarHBondContact O-N 3.48Å
447	N	95.1	Very high	90.4	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	31%	0.309	C	S	.	.	S	Bend	trans	-80.1	54.3	172.9	-153.9	1.8	0	0	0	111.1	P408 L411 F426 Y427 N445 F449	P408-N447 WeakPolarHBondContact O-CB 3.06Å; P408-N447 VanDerWaalsContact O-CG 3.31Å; L411-N447 HydrophobicContact CB-CB 4.05Å; L411-N447 PolarHBondContact O-ND2 3.35Å; F426-N447 WeakPolarHBondContact CA-OD1 3.47Å; F426-N447 HydrophobicContact CB-CB 4.32Å; F426-N447 WeakPolarHBondContact CB-O 3.48Å; Y427-N447 PolarHBondContact N-ND2 3.27Å; Y427-N447 PolarHBondContact N-OD1 2.78Å; Y427-N447 PolarHBondContact O-ND2 3.49Å; N445-N447 PolarHBondContact O-N 3.41Å; N445-N447 VanDerWaalsContact O-N 3.17Å; N445-N447 WeakPolarHBondContact OD1-CB 3.28Å; N445-N447 PolarHBondContact OD1-N 3.4Å; N447-F449 WeakPolarHBondContact OD1-CE2 3.33Å
448	N	95.3	Very high	90.3	Very high	28 Å²	28	63 Å²	63	15%	0.15	33%	0.333	C	S	.	.			trans	-144.2	89.2	-171.3	-176.1	-23	0	0	0	108.9	R424 F437 Y439 N445 A446	R424-N448 VanDerWaalsContact CB-OD1 3.31Å; R424-N448 WeakPolarHBondContact CB-OD1 3.15Å; R424-N448 WeakPolarHBondContact CD-OD1 3.28Å; R424-N448 WeakPolarHBondContact CG-OD1 3.01Å; R424-N448 PolarHBondContact NH1-OD1 3.37Å; F437-N448 HydrophobicContact CE1-CB 4.47Å; F437-N448 HydrophobicContact CZ-CB 4.02Å; Y439-N448 VanDerWaalsContact CD2-ND2 3.31Å; Y439-N448 WeakPolarHBondContact CD2-ND2 3.11Å; Y439-N448 VanDerWaalsContact CG-ND2 3.32Å; N445-N448 WeakPolarHBondContact O-CB 3.09Å; A446-N448 PolarHBondContact O-N 3.48Å
449	F	95.4	Very high	90.5	Very high	22 Å²	22	60.6 Å²	60.6	10%	0.096	32%	0.319	C	S	.	.	B	Isolated β-bridge	trans	-101.8	145	-176	-57.7	-78.5	0	0	0	111.1	P408 R424 F425 N447 Q454 C455 K458	P408-F449 HydrophobicContact CB-CZ 4.37Å; R424-F449 CarbonylContact C-O 3.34Å; R424-F449 VanDerWaalsContact CA-O 3.23Å; R424-F449 WeakPolarHBondContact CA-O 3.19Å; R424-F449 WeakPolarHBondContact CB-O 3.11Å; R424-F449 WeakPolarHBondContact CD-O 3.42Å; F425-F449 HydrophobicContact CB-CB 4.35Å; F425-F449 PolarHBondContact N-O 2.99Å; F425-F449 WeakPolarHBondContact O-CD2 3.48Å; F425-F449 PolarHBondContact O-N 2.66Å; N447-F449 WeakPolarHBondContact OD1-CE2 3.33Å; F449-Q454 HydrophobicContact CB-CB 4.21Å; F449-Q454 HydrophobicContact CD1-CB 4.21Å; F449-C455 HydrophobicContact CB-CB 3.81Å; F449-C455 HydrophobicContact CD1-CB 4.46Å; F449-C455 HydrophobicContact CD2-CB 3.34Å; F449-C455 VanDerWaalsContact CD2-SG 3.52Å; F449-C455 HydrophobicContact CE2-CB 4Å; F449-C455 HydrophobicContact CG-CB 3.61Å; F449-K458 HydrophobicContact CE1-CB 3.68Å; F449-K458 HydrophobicContact CE1-CG 3.72Å; F449-K458 HydrophobicContact CZ-CB 3.89Å; F449-K458 HydrophobicContact CZ-CG 3.81Å
450	E	91.5	Very high	90.3	Very high	133 Å²	133	65.9 Å²	65.9	62%	0.621	35%	0.349	S	S	*	.	S	Bend	trans	-75.1	-36.7	179.5	-172.2	173.6	-158.4	0	0	111.6
451	T	90.9	Very high	89.7	Confident	50 Å²	50	66 Å²	66	31%	0.307	35%	0.35	S	S	.	.	S	Bend	trans	-122.5	155.8	177.2	73.7	0	0	0	0	112.2	F425 E453 Q454 C455	F425-T451 VanDerWaalsContact CD2-C 3.44Å; T451-E453 VanDerWaalsContact C-N 3.27Å; T451-E453 PolarHBondContact O-N 3.45Å; T451-Q454 PolarHBondContact O-N 2.84Å; T451-Q454 VanDerWaalsContact OG1-CG 3.27Å; T451-Q454 WeakPolarHBondContact OG1-CG 3.35Å; T451-Q454 PolarHBondContact OG1-N 3.17Å; T451-Q454 VanDerWaalsContact OG1-N 3.15Å; T451-C455 PolarHBondContact O-N 3.02Å
452	I	88	Confident	88.9	Confident	65 Å²	65	70.8 Å²	70.8	33%	0.333	37%	0.367	S	S	.	.	H	α-helix	trans	-62.3	-38.1	174.7	-163.5	172.5	0	0	0	111.1	F425 C434 Q454 C455 E456	F425-I452 HydrophobicContact CD1-CB 3.81Å; F425-I452 HydrophobicContact CD1-CD1 4.4Å; F425-I452 HydrophobicContact CD1-CG1 3.98Å; F425-I452 HydrophobicContact CD2-CB 4.46Å; F425-I452 HydrophobicContact CE1-CB 3.75Å; F425-I452 HydrophobicContact CE1-CD1 4.27Å; F425-I452 HydrophobicContact CE1-CG1 4.17Å; F425-I452 HydrophobicContact CE2-CB 4.42Å; F425-I452 HydrophobicContact CG-CB 4.16Å; F425-I452 HydrophobicContact CZ-CB 4.07Å; C434-I452 HydrophobicContact CB-CG1 4.02Å; I452-Q454 PolarHBondContact O-N 3Å; I452-C455 WeakPolarHBondContact O-CB 3.44Å; I452-C455 PolarHBondContact O-N 3.32Å; I452-C455 VanDerWaalsContact O-N 3.12Å; I452-E456 HydrophobicContact CG1-CG 4.17Å; I452-E456 WeakPolarHBondContact O-CG 3.39Å; I452-E456 PolarHBondContact O-N 2.99Å
453	E	85.9	Confident	87.5	Confident	141 Å²	141	74.3 Å²	74.3	66%	0.659	39%	0.39	S	S	*	.	H	α-helix	trans	-61.3	-41.3	177.5	-65.5	171	175.7	0	0	112.1	T451 C455 E456 K457	T451-E453 VanDerWaalsContact C-N 3.27Å; T451-E453 PolarHBondContact O-N 3.45Å; E453-C455 VanDerWaalsContact C-N 3.33Å; E453-C455 PolarHBondContact O-N 3.03Å; E453-E456 PolarHBondContact O-N 2.95Å; E453-K457 WeakPolarHBondContact O-CB 3.29Å; E453-K457 PolarHBondContact O-N 3.47Å
454	Q	91.5	Very high	85.8	Confident	85 Å²	85	75.1 Å²	75.1	40%	0.397	39%	0.394	S	S	.	.	H	α-helix	trans	-60.5	-44.2	174.2	-76.8	170.7	6.5	0	0	111	F449 T451 I452 K458	F449-Q454 HydrophobicContact CB-CB 4.21Å; F449-Q454 HydrophobicContact CD1-CB 4.21Å; T451-Q454 PolarHBondContact O-N 2.84Å; T451-Q454 VanDerWaalsContact OG1-CG 3.27Å; T451-Q454 WeakPolarHBondContact OG1-CG 3.35Å; T451-Q454 PolarHBondContact OG1-N 3.17Å; T451-Q454 VanDerWaalsContact OG1-N 3.15Å; I452-Q454 PolarHBondContact O-N 3Å; Q454-K458 WeakPolarHBondContact O-CB 3.27Å; Q454-K458 PolarHBondContact O-N 2.68Å
455	C	94.1	Very high	84.3	Confident	0 Å²	0	79.5 Å²	79.5	0%	0	42%	0.416	C	S	.	.	H	α-helix	trans	-64.4	-51.4	176.9	-178.9	0	0	0	0	111.7	F425 C434 F449 T451 I452 E453 K457 K458 C459	F425-C455 HydrophobicContact CB-CB 4.12Å; C434-C455 HydrophobicContact CB-CB 3.68Å; C434-C455 WeakPolarHBondContact CB-SG 3.39Å; C434-C455 WeakPolarHBondContact SG-CB 3.34Å; C434-C455 CovalentContact SG-SG 2.03Å; C434-C455 PolarHBondContact SG-SG 3.3Å; F449-C455 HydrophobicContact CB-CB 3.81Å; F449-C455 HydrophobicContact CD1-CB 4.46Å; F449-C455 HydrophobicContact CD2-CB 3.34Å; F449-C455 VanDerWaalsContact CD2-SG 3.52Å; F449-C455 HydrophobicContact CE2-CB 4Å; F449-C455 HydrophobicContact CG-CB 3.61Å; T451-C455 PolarHBondContact O-N 3.02Å; I452-C455 WeakPolarHBondContact O-CB 3.44Å; I452-C455 PolarHBondContact O-N 3.32Å; I452-C455 VanDerWaalsContact O-N 3.12Å; E453-C455 VanDerWaalsContact C-N 3.33Å; E453-C455 PolarHBondContact O-N 3.03Å; C455-K457 VanDerWaalsContact C-N 3.34Å; C455-K457 PolarHBondContact O-N 2.56Å; C455-K458 PolarHBondContact O-N 3.21Å; C455-C459 VanDerWaalsContact O-CB 3.24Å; C455-C459 WeakPolarHBondContact O-CB 3.49Å; C455-C459 PolarHBondContact O-N 3.34Å; C455-C459 PolarHBondContact O-SG 3.23Å
456	E	91.7	Very high	83.1	Confident	58 Å²	58	80.8 Å²	80.8	27%	0.271	43%	0.425	S	S	.	.	H	α-helix	trans	-62	-42.8	-177.1	-71.9	179.8	160.3	0	0	111.4	C434 I452 E453 N460 V461	C434-E456 HydrophobicContact CB-CG 4.07Å; C434-E456 PolarHBondContact SG-N 3.34Å; I452-E456 HydrophobicContact CG1-CG 4.17Å; I452-E456 WeakPolarHBondContact O-CG 3.39Å; I452-E456 PolarHBondContact O-N 2.99Å; E453-E456 PolarHBondContact O-N 2.95Å; E456-N460 WeakPolarHBondContact O-CA 3.26Å; E456-N460 PolarHBondContact O-N 2.85Å; E456-V461 HydrophobicContact CB-CB 4.02Å; E456-V461 HydrophobicContact CB-CG2 4.47Å; E456-V461 HydrophobicContact CG-CB 3.97Å; E456-V461 HydrophobicContact CG-CG1 4.29Å; E456-V461 HydrophobicContact CG-CG2 4.3Å; E456-V461 PolarHBondContact O-N 3.11Å
457	K	88.9	Confident	82.6	Confident	182 Å²	182	81.2 Å²	81.2	79%	0.791	42%	0.419	S	S	*	.	H	α-helix	trans	-64	-47.5	175.1	-175	178.9	-179.6	-179.4	0	111.7	E453 C455 C459	E453-K457 WeakPolarHBondContact O-CB 3.29Å; E453-K457 PolarHBondContact O-N 3.47Å; C455-K457 VanDerWaalsContact C-N 3.34Å; C455-K457 PolarHBondContact O-N 2.56Å; K457-C459 VanDerWaalsContact C-N 3.34Å
458	K	89.8	Confident	82.2	Confident	123 Å²	123	81.9 Å²	81.9	54%	0.535	42%	0.423	S	S	.	.	H	α-helix	trans	-69.4	-32.7	-177.4	-173.9	63.2	173.9	-178.6	0	112.4	F449 Q454 C455	F449-K458 HydrophobicContact CE1-CB 3.68Å; F449-K458 HydrophobicContact CE1-CG 3.72Å; F449-K458 HydrophobicContact CZ-CB 3.89Å; F449-K458 HydrophobicContact CZ-CG 3.81Å; Q454-K458 WeakPolarHBondContact O-CB 3.27Å; Q454-K458 PolarHBondContact O-N 2.68Å; C455-K458 PolarHBondContact O-N 3.21Å
459	C	92.7	Very high	82	Confident	14 Å²	14	80.8 Å²	80.8	10%	0.095	42%	0.418	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.3	10.3	-175.6	-59.2	0	0	0	0	114.2	C409 Y427 C455 K457 V461	C409-C459 HydrophobicContact CB-CB 3.71Å; C409-C459 WeakPolarHBondContact CB-SG 3.17Å; C409-C459 WeakPolarHBondContact SG-CA 3.18Å; C409-C459 WeakPolarHBondContact SG-CB 3.12Å; C409-C459 CovalentContact SG-SG 2.02Å; C409-C459 PolarHBondContact SG-SG 3.41Å; Y427-C459 WeakPolarHBondContact CB-SG 3.38Å; Y427-C459 HydrophobicContact CD2-CB 3.59Å; Y427-C459 HydrophobicContact CE2-CB 4.29Å; Y427-C459 HydrophobicContact CG-CB 3.86Å; C455-C459 VanDerWaalsContact O-CB 3.24Å; C455-C459 WeakPolarHBondContact O-CB 3.49Å; C455-C459 PolarHBondContact O-N 3.34Å; C455-C459 PolarHBondContact O-SG 3.23Å; K457-C459 VanDerWaalsContact C-N 3.34Å; C459-V461 HydrophobicContact CB-CG2 4.36Å; C459-V461 PolarHBondContact O-N 3.19Å
460	N	89	Confident	81.7	Confident	143 Å²	143	86.3 Å²	86.3	77%	0.765	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.3	41.3	176.9	-60.3	87.5	0	0	0	112.8	E456 D462	E456-N460 WeakPolarHBondContact O-CA 3.26Å; E456-N460 PolarHBondContact O-N 2.85Å; N460-D462 PolarHBondContact O-N 3.02Å
461	V	79.7	Confident	81.6	Confident	21 Å²	21	81.5 Å²	81.5	13%	0.127	42%	0.42	C	S	.	.			trans	-73.6	115.6	172.6	-177	0	0	0	0	107.2	Y427 E456 C459 P463	Y427-V461 HydrophobicContact CD2-CG2 3.72Å; Y427-V461 HydrophobicContact CE2-CG2 3.74Å; E456-V461 HydrophobicContact CB-CB 4.02Å; E456-V461 HydrophobicContact CB-CG2 4.47Å; E456-V461 HydrophobicContact CG-CB 3.97Å; E456-V461 HydrophobicContact CG-CG1 4.29Å; E456-V461 HydrophobicContact CG-CG2 4.3Å; E456-V461 PolarHBondContact O-N 3.11Å; C459-V461 HydrophobicContact CB-CG2 4.36Å; C459-V461 PolarHBondContact O-N 3.19Å; V461-P463 WeakPolarHBondContact O-CD 3.16Å
462	D	68.6	Low	81.7	Confident	133 Å²	133	83.5 Å²	83.5	71%	0.711	43%	0.433	S	S	*	.			trans	-57.9	122.7	170.1	-79.7	-38.3	0	0	0	108.5	N460 Q464	N460-D462 PolarHBondContact O-N 3.02Å; D462-Q464 PolarHBondContact O-N 2.83Å
463	P	56	Low	81.9	Confident	108 Å²	108	85.4 Å²	85.4	70%	0.701	44%	0.439	S	S	*	.			trans	-69.9	82.6	177.2	20.9	-21.5	0	0	0	108.6	V461 P465	V461-P463 WeakPolarHBondContact O-CD 3.16Å; P463-P465 WeakPolarHBondContact O-CD 3.47Å
464	Q	52.1	Low	82.2	Confident	135 Å²	135	80.9 Å²	80.9	63%	0.631	42%	0.421	S	S	*	.			trans	-77.6	116.6	162	-71.9	-159.2	0.6	0	0	107	D462 V466	D462-Q464 PolarHBondContact O-N 2.83Å; Q464-V466 PolarHBondContact O-N 2.97Å
465	P	54.1	Low	82.3	Confident	128 Å²	128	80.7 Å²	80.7	83%	0.831	43%	0.426	S	S	*	.			trans	-56.8	110.1	175.5	20.2	-29	0	0	0	108.5	P463 D467	P463-P465 WeakPolarHBondContact O-CD 3.47Å; P465-D467 PolarHBondContact O-N 3.46Å; P465-D467 VanDerWaalsContact O-N 3.08Å
466	V	64.4	Low	82	Confident	71 Å²	71	81.9 Å²	81.9	43%	0.43	44%	0.438	S	S	.	.			trans	-75.5	103.2	178.7	-171.6	0	0	0	0	106.1	Q464 P468 Q471	Q464-V466 PolarHBondContact O-N 2.97Å; V466-P468 VanDerWaalsContact O-CD 3.23Å; V466-P468 WeakPolarHBondContact O-CD 3.08Å; V466-Q471 HydrophobicContact CG1-CG 4Å; V466-Q471 PolarHBondContact O-NE2 2.83Å
467	D	80.3	Confident	81.5	Confident	66 Å²	66	83.1 Å²	83.1	35%	0.353	45%	0.451	S	S	.	.			trans	-43.1	111	177.6	179.5	-1.8	0	0	0	110.3	P465 C469 K470	P465-D467 PolarHBondContact O-N 3.46Å; P465-D467 VanDerWaalsContact O-N 3.08Å; D467-C469 PolarHBondContact O-N 2.79Å; D467-C469 VanDerWaalsContact OD1-CB 3.25Å; D467-C469 WeakPolarHBondContact OD1-CB 3.49Å; D467-C469 PolarHBondContact OD1-N 2.82Å; D467-C469 PolarHBondContact OD1-SG 2.03Å; D467-K470 HydrophobicContact CB-CB 4.36Å; D467-K470 HydrophobicContact CB-CD 4.01Å; D467-K470 HydrophobicContact CB-CG 4.05Å; D467-K470 PolarHBondContact O-N 3.49Å; D467-K470 VanDerWaalsContact OD2-CE 3.28Å; D467-K470 WeakPolarHBondContact OD2-CE 3.1Å
468	P	86.5	Confident	81.4	Confident	13 Å²	13	77.1 Å²	77.1	8%	0.084	43%	0.431	C	S	.	.	G	3₁₀ helix	trans	-47.2	-37.9	-179.5	-29.3	32	0	0	0	111.7	V466 K470 Q471 E506 N507	V466-P468 VanDerWaalsContact O-CD 3.23Å; V466-P468 WeakPolarHBondContact O-CD 3.08Å; P468-K470 PolarHBondContact O-N 2.91Å; P468-Q471 WeakPolarHBondContact O-CB 2.98Å; P468-Q471 PolarHBondContact O-N 3.3Å; P468-E506 HydrophobicContact CB-CB 3.67Å; P468-E506 HydrophobicContact CG-CB 3.93Å; P468-E506 WeakPolarHBondContact CG-OE2 2.98Å; P468-N507 WeakPolarHBondContact O-CB 3.13Å
469	C	91.1	Very high	81.3	Confident	5 Å²	5	81 Å²	81	3%	0.034	45%	0.448	C	S	.	.	G	3₁₀ helix	trans	-70.9	-19.1	-173.7	-51	0	0	0	0	112.8	D467 Y487 C519	D467-C469 PolarHBondContact O-N 2.79Å; D467-C469 VanDerWaalsContact OD1-CB 3.25Å; D467-C469 WeakPolarHBondContact OD1-CB 3.49Å; D467-C469 PolarHBondContact OD1-N 2.82Å; D467-C469 PolarHBondContact OD1-SG 2.03Å; C469-Y487 HydrophobicContact CB-CD1 3.8Å; C469-Y487 HydrophobicContact CB-CG 4.3Å; C469-Y487 WeakPolarHBondContact O-CD1 3.3Å; C469-C519 HydrophobicContact CB-CB 3.59Å; C469-C519 WeakPolarHBondContact CB-SG 3.39Å; C469-C519 WeakPolarHBondContact SG-CA 2.99Å; C469-C519 WeakPolarHBondContact SG-CB 3.28Å; C469-C519 CovalentContact SG-SG 2.03Å; C469-C519 PolarHBondContact SG-SG 3.33Å
470	K	89.4	Confident	81	Confident	138 Å²	138	82.7 Å²	82.7	60%	0.6	46%	0.463	S	S	*	.	G	3₁₀ helix	trans	-90.7	-8.1	177.1	-64.9	-178.9	-173.9	171.5	0	113.4	D467 P468 M489	D467-K470 HydrophobicContact CB-CB 4.36Å; D467-K470 HydrophobicContact CB-CD 4.01Å; D467-K470 HydrophobicContact CB-CG 4.05Å; D467-K470 PolarHBondContact O-N 3.49Å; D467-K470 VanDerWaalsContact OD2-CE 3.28Å; D467-K470 WeakPolarHBondContact OD2-CE 3.1Å; P468-K470 PolarHBondContact O-N 2.91Å; K470-M489 HydrophobicContact CG-CE 4.03Å; K470-M489 HydrophobicContact CG-SD 4.19Å
471	Q	89.9	Confident	81.3	Confident	33 Å²	33	80.3 Å²	80.3	15%	0.154	45%	0.453	C	S	.	.	S	Bend	trans	-78.4	153.5	-179.2	-53	174.1	2.4	0	0	110.7	V466 P468 N505 N507	V466-Q471 HydrophobicContact CG1-CG 4Å; V466-Q471 PolarHBondContact O-NE2 2.83Å; P468-Q471 WeakPolarHBondContact O-CB 2.98Å; P468-Q471 PolarHBondContact O-N 3.3Å; Q471-N505 WeakPolarHBondContact CB-ND2 3.01Å; Q471-N507 HydrophobicContact CB-CB 4.15Å; Q471-N507 PolarHBondContact O-ND2 3.29Å
472	P	91.9	Very high	82	Confident	92 Å²	92	82.1 Å²	82.1	60%	0.597	46%	0.462	S	S	*	.	P	Polyproline II helix	trans	-71.8	164.5	175.7	30.2	-35.9	0	0	0	111.9	N505	P472-N505 PolarHBondContact O-ND2 3.31Å; P472-N505 PolarHBondContact O-OD1 2.87Å
473	K	93.2	Very high	83.3	Confident	104 Å²	104	78.8 Å²	78.8	45%	0.452	45%	0.446	S	S	.	.	P	Polyproline II helix	trans	-68.1	135.2	165.6	62	176	167	-149.2	0	110.6	Y486 F497	K473-Y486 HydrophobicContact CB-CD1 3.88Å; K473-Y486 HydrophobicContact CB-CD2 3.76Å; K473-Y486 HydrophobicContact CB-CE1 4.1Å; K473-Y486 HydrophobicContact CB-CE2 3.98Å; K473-Y486 HydrophobicContact CB-CG 3.7Å; K473-Y486 HydrophobicContact CD-CD1 4.15Å; K473-Y486 HydrophobicContact CD-CE1 3.59Å; K473-Y486 HydrophobicContact CD-CE2 4.24Å; K473-Y486 HydrophobicContact CG-CD2 4.45Å; K473-Y486 HydrophobicContact CG-CE1 4.28Å; K473-Y486 HydrophobicContact CG-CE2 4.16Å; K473-Y486 PolarHBondContact NZ-OH 2.03Å; K473-F497 HydrophobicContact CB-CD2 4.07Å; K473-F497 HydrophobicContact CB-CE2 4.36Å; K473-F497 HydrophobicContact CB-CG 4.18Å; K473-F497 HydrophobicContact CD-CB 3.91Å; K473-F497 HydrophobicContact CD-CG 4.35Å
474	V	92.1	Very high	85.3	Confident	47 Å²	47	76.6 Å²	76.6	29%	0.285	42%	0.424	S	S	.	.			trans	-124.5	115.1	178.1	176.6	0	0	0	0	110	F497 Q503 N505	V474-F497 WeakPolarHBondContact O-CE2 3.45Å; V474-Q503 WeakPolarHBondContact CG1-O 3.4Å; V474-N505 HydrophobicContact CG2-CB 4.35Å; V474-N505 WeakPolarHBondContact CG2-ND2 3.33Å
475	V	93.5	Very high	87.5	Confident	81 Å²	81	72.6 Å²	72.6	49%	0.491	40%	0.403	S	S	.	.			trans	-68.8	-39.1	175.8	178.5	0	0	0	0	110.8	Y499 G500	V475-Y499 VanDerWaalsContact O-CD2 3.3Å; V475-Y499 WeakPolarHBondContact O-CD2 3.34Å; V475-G500 VanDerWaalsContact O-CA 3.22Å; V475-G500 WeakPolarHBondContact O-CA 3.07Å; V475-G500 PolarHBondContact O-N 3.45Å
476	G	87.9	Confident	89.5	Confident	25 Å²	25	67.3 Å²	67.3	26%	0.258	37%	0.367	S	S	.	.			trans	77.1	169.3	-173.2	0	0	0	0	0	112.8
477	P	79.6	Confident	91	Very high	84 Å²	84	65.2 Å²	65.2	55%	0.545	35%	0.351	S	S	.	.	S	Bend	trans	-87.2	-14.7	-173.6	36.4	-37.6	0	0	0	113.8	Q503	P477-Q503 HydrophobicContact CG-CG 4.35Å
478	C	87.7	Confident	91.6	Very high	55 Å²	55	63.3 Å²	63.3	37%	0.372	34%	0.341	S	S	.	.	S	Bend	trans	-66.3	150.6	175.7	-72.4	0	0	0	0	110.7	G500 C502	C478-G500 CarbonylContact C-O 3.14Å; C478-G500 WeakPolarHBondContact CB-O 3.31Å; C478-G500 CarbonylContact O-C 3.53Å; C478-G500 WeakPolarHBondContact O-CA 3.46Å; C478-C502 HydrophobicContact CB-CB 3.86Å; C478-C502 WeakPolarHBondContact CB-SG 3.34Å; C478-C502 WeakPolarHBondContact SG-CB 2.99Å; C478-C502 CovalentContact SG-SG 2.01Å; C478-C502 PolarHBondContact SG-SG 3.47Å
479	K	87.7	Confident	91.6	Very high	206 Å²	206	66.3 Å²	66.3	90%	0.896	36%	0.355	S	S	*	.			trans	-98	11.9	-172	-61.2	-177.1	-179.3	178.1	0	113.8
480	A	87.6	Confident	91.2	Very high	49 Å²	49	72.4 Å²	72.4	41%	0.405	39%	0.392	S	S	.	.			trans	-70	156.3	173.1	0	0	0	0	0	109.9	I482 G500	A480-I482 HydrophobicContact CB-CD1 4.16Å; A480-I482 HydrophobicContact CB-CG1 3.83Å; A480-G500 WeakPolarHBondContact CA-O 3.18Å; A480-G500 WeakPolarHBondContact CB-O 3.43Å; A480-G500 PolarHBondContact N-O 2.83Å; A480-G500 CarbonylContact O-C 3.11Å; A480-G500 WeakPolarHBondContact O-CA 3.31Å
481	V	93.4	Very high	91.2	Very high	93 Å²	93	68.6 Å²	68.6	56%	0.564	38%	0.38	S	S	*	.			trans	-117.4	73.2	178.9	-175.3	0	0	0	0	108	R498	V481-R498 HydrophobicContact CG1-CB 4.38Å; V481-R498 HydrophobicContact CG1-CG 4.09Å
482	I	96.3	Very high	90.9	Very high	58 Å²	58	72.4 Å²	72.4	30%	0.297	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	117.4	-175.9	-47.3	-172.9	0	0	0	109	A480 R484 Y499	A480-I482 HydrophobicContact CB-CD1 4.16Å; A480-I482 HydrophobicContact CB-CG1 3.83Å; I482-R484 HydrophobicContact CG2-CG 4.24Å; I482-R484 PolarHBondContact O-N 2.87Å; I482-Y499 HydrophobicContact CB-CD1 4.41Å; I482-Y499 WeakPolarHBondContact CB-O 3.43Å; I482-Y499 HydrophobicContact CD1-CD1 4.48Å; I482-Y499 PolarHBondContact N-O 3.35Å; I482-Y499 WeakPolarHBondContact O-CB 3.37Å; I482-Y499 PolarHBondContact O-N 3.36Å
483	V	95.8	Very high	90.8	Very high	63 Å²	63	74.4 Å²	74.4	38%	0.382	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	126.2	174.8	170.6	0	0	0	0	109.7	Q496	V483-Q496 HydrophobicContact CG1-CG 3.53Å
484	R	97.7	Very high	90.8	Very high	62 Å²	62	70 Å²	70	23%	0.234	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	168.2	179.2	-64.4	-66.2	175.2	80.6	-2.5	110.4	I482 Q496 F497 Y499 N508 F509	I482-R484 HydrophobicContact CG2-CG 4.24Å; I482-R484 PolarHBondContact O-N 2.87Å; R484-Q496 CarbonylContact O-C 3.47Å; R484-Q496 VanDerWaalsContact O-CA 3.3Å; R484-Q496 WeakPolarHBondContact O-CA 3.37Å; R484-F497 HydrophobicContact CB-CD1 4.01Å; R484-F497 HydrophobicContact CB-CE1 3.49Å; R484-F497 VanDerWaalsContact CB-CE1 3.49Å; R484-F497 HydrophobicContact CB-CZ 3.93Å; R484-F497 PolarHBondContact N-O 2.81Å; R484-F497 WeakPolarHBondContact O-CD1 3.38Å; R484-F497 PolarHBondContact O-N 3.24Å; R484-Y499 HydrophobicContact CG-CD1 4.18Å; R484-Y499 HydrophobicContact CG-CG 4.27Å; R484-N508 WeakPolarHBondContact CB-OD1 3.35Å; R484-N508 VanDerWaalsContact CD-OD1 3.26Å; R484-N508 WeakPolarHBondContact CD-OD1 3.42Å; R484-N508 WeakPolarHBondContact CG-OD1 3.35Å; R484-N508 PolarHBondContact NH1-OD1 3.23Å; R484-F509 CarbonylContact C-O 3.56Å; R484-F509 WeakPolarHBondContact CA-O 3.41Å; R484-F509 WeakPolarHBondContact CD-O 3.31Å
485	Y	97.5	Very high	91.1	Very high	52 Å²	52	70.5 Å²	70.5	20%	0.204	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	147.1	177.1	-65.3	-94	0	0	0	110.6	E495 Q496 F509 K512	Y485-E495 CarbonylContact C-O 3.48Å; Y485-E495 VanDerWaalsContact CA-O 3.27Å; Y485-E495 WeakPolarHBondContact CA-O 3.18Å; Y485-Q496 HydrophobicContact CD1-CB 4.16Å; Y485-Q496 HydrophobicContact CE1-CB 3.86Å; Y485-Q496 HydrophobicContact CE1-CG 4.27Å; Y485-F509 PolarHBondContact N-O 2.82Å; Y485-F509 WeakPolarHBondContact O-CD2 3.3Å; Y485-F509 PolarHBondContact O-N 2.9Å; Y485-K512 HydrophobicContact CD1-CB 3.76Å; Y485-K512 HydrophobicContact CD1-CG 4.08Å; Y485-K512 HydrophobicContact CD2-CB 4.31Å; Y485-K512 HydrophobicContact CE1-CB 3.67Å; Y485-K512 HydrophobicContact CE1-CD 4.4Å; Y485-K512 HydrophobicContact CE1-CG 4.14Å; Y485-K512 HydrophobicContact CE2-CB 4.21Å; Y485-K512 HydrophobicContact CG-CB 4.09Å
486	Y	97.1	Very high	91.2	Very high	16 Å²	16	71.8 Å²	71.8	6%	0.063	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	147.9	173.5	79.8	-74.9	0	0	0	109.5	K473 N488 C494 E495 F497 N507	K473-Y486 HydrophobicContact CB-CD1 3.88Å; K473-Y486 HydrophobicContact CB-CD2 3.76Å; K473-Y486 HydrophobicContact CB-CE1 4.1Å; K473-Y486 HydrophobicContact CB-CE2 3.98Å; K473-Y486 HydrophobicContact CB-CG 3.7Å; K473-Y486 HydrophobicContact CD-CD1 4.15Å; K473-Y486 HydrophobicContact CD-CE1 3.59Å; K473-Y486 HydrophobicContact CD-CE2 4.24Å; K473-Y486 HydrophobicContact CG-CD2 4.45Å; K473-Y486 HydrophobicContact CG-CE1 4.28Å; K473-Y486 HydrophobicContact CG-CE2 4.16Å; K473-Y486 PolarHBondContact NZ-OH 2.03Å; Y486-N488 HydrophobicContact CD2-CB 4.48Å; Y486-N488 HydrophobicContact CE2-CB 3.76Å; Y486-N488 PolarHBondContact O-N 3.23Å; Y486-N488 PolarHBondContact OH-ND2 3.49Å; Y486-C494 CarbonylContact O-C 3.57Å; Y486-C494 WeakPolarHBondContact O-CA 3.34Å; Y486-E495 HydrophobicContact CD1-CB 4.27Å; Y486-E495 WeakPolarHBondContact CD1-O 3.41Å; Y486-E495 HydrophobicContact CE1-CB 3.72Å; Y486-E495 PolarHBondContact N-O 3.18Å; Y486-E495 PolarHBondContact O-N 2.97Å; Y486-E495 PolarHBondContact OH-OE2 2.9Å; Y486-F497 HydrophobicContact CD1-CB 4.1Å; Y486-F497 AromaticContact CD1-CD1 3.72Å; Y486-F497 HydrophobicContact CD1-CD1 3.72Å; Y486-F497 HydrophobicContact CD1-CE1 4.47Å; Y486-F497 HydrophobicContact CD1-CG 4.13Å; Y486-F497 HydrophobicContact CE1-CB 4.25Å; Y486-F497 HydrophobicContact CG-CD1 4.29Å; Y486-N507 WeakPolarHBondContact CA-OD1 3.43Å; Y486-N507 WeakPolarHBondContact CB-O 3.49Å
487	Y	94.9	Very high	91.6	Very high	27 Å²	27	71.1 Å²	71.1	11%	0.106	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	114.3	172.9	-174.2	-114.4	0	0	0	109.8	C469 M489 K492 N507 C515 C519 M520	C469-Y487 HydrophobicContact CB-CD1 3.8Å; C469-Y487 HydrophobicContact CB-CG 4.3Å; C469-Y487 WeakPolarHBondContact O-CD1 3.3Å; Y487-M489 HydrophobicContact CD1-CG 4.33Å; Y487-M489 HydrophobicContact CD1-SD 3.89Å; Y487-M489 HydrophobicContact CE1-CG 4.42Å; Y487-M489 HydrophobicContact CE1-SD 3.52Å; Y487-M489 VanDerWaalsContact CE1-SD 3.52Å; Y487-K492 WeakPolarHBondContact OH-CD 3.36Å; Y487-N507 PolarHBondContact N-OD1 2.81Å; Y487-N507 PolarHBondContact O-ND2 2.01Å; Y487-C515 PolarHBondContact N-SG 2.79Å; Y487-C519 HydrophobicContact CD1-CB 4.11Å; Y487-C519 HydrophobicContact CD2-CB 3.78Å; Y487-C519 HydrophobicContact CE2-CB 4.45Å; Y487-C519 HydrophobicContact CG-CB 3.59Å; Y487-M520 HydrophobicContact CD2-CE 4.02Å; Y487-M520 HydrophobicContact CD2-CG 4.42Å; Y487-M520 HydrophobicContact CE2-CE 3.82Å; Y487-M520 HydrophobicContact CE2-CG 3.97Å
488	N	93.5	Very high	92.4	Very high	26 Å²	26	75 Å²	75	14%	0.139	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	110.9	175.7	-177.8	-24	0	0	0	109.2	Y486 V490 T491 K492 K493 E495	Y486-N488 HydrophobicContact CD2-CB 4.48Å; Y486-N488 HydrophobicContact CE2-CB 3.76Å; Y486-N488 PolarHBondContact O-N 3.23Å; Y486-N488 PolarHBondContact OH-ND2 3.49Å; N488-V490 PolarHBondContact O-N 3.36Å; N488-V490 WeakPolarHBondContact OD1-CB 3.28Å; N488-V490 PolarHBondContact OD1-N 2.82Å; N488-T491 VanDerWaalsContact CB-OG1 3.28Å; N488-T491 WeakPolarHBondContact CB-OG1 3.34Å; N488-T491 VanDerWaalsContact CG-OG1 3.27Å; N488-T491 PolarHBondContact O-N 2.81Å; N488-T491 PolarHBondContact OD1-N 3.4Å; N488-K492 VanDerWaalsContact O-CA 3.26Å; N488-K492 WeakPolarHBondContact O-CA 3.3Å; N488-K492 PolarHBondContact O-N 2.75Å; N488-K493 PolarHBondContact N-O 3.44Å; N488-K493 PolarHBondContact O-N 3.4Å; N488-E495 HydrophobicContact CB-CG 4.23Å; N488-E495 VanDerWaalsContact ND2-CD 3.29Å; N488-E495 PolarHBondContact ND2-OE1 2.74Å; N488-E495 PolarHBondContact ND2-OE2 3.42Å
489	M	86.5	Confident	92.8	Very high	76 Å²	76	73.5 Å²	73.5	37%	0.374	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-22.3	-178.6	-76.9	-71.1	-72.8	0	0	114.5	K470 Y487 K492	K470-M489 HydrophobicContact CG-CE 4.03Å; K470-M489 HydrophobicContact CG-SD 4.19Å; Y487-M489 HydrophobicContact CD1-CG 4.33Å; Y487-M489 HydrophobicContact CD1-SD 3.89Å; Y487-M489 HydrophobicContact CE1-CG 4.42Å; Y487-M489 HydrophobicContact CE1-SD 3.52Å; Y487-M489 VanDerWaalsContact CE1-SD 3.52Å; M489-K492 WeakPolarHBondContact O-CD 3.32Å; M489-K492 WeakPolarHBondContact O-CE 3.4Å; M489-K492 PolarHBondContact O-NZ 2.03Å; M489-K492 VanDerWaalsContact O-NZ 3.13Å
490	V	83.3	Confident	93	Very high	133 Å²	133	63.7 Å²	63.7	81%	0.806	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-49	178.4	-178.7	0	0	0	0	110.1	N488	N488-V490 PolarHBondContact O-N 3.36Å; N488-V490 WeakPolarHBondContact OD1-CB 3.28Å; N488-V490 PolarHBondContact OD1-N 2.82Å
491	T	88.4	Confident	93	Very high	58 Å²	58	63 Å²	63	36%	0.356	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-11.1	-178.5	62	0	0	0	0	113.1	N488 K493 E495	N488-T491 VanDerWaalsContact CB-OG1 3.28Å; N488-T491 WeakPolarHBondContact CB-OG1 3.34Å; N488-T491 VanDerWaalsContact CG-OG1 3.27Å; N488-T491 PolarHBondContact O-N 2.81Å; N488-T491 PolarHBondContact OD1-N 3.4Å; T491-K493 WeakPolarHBondContact O-CG 3.49Å; T491-K493 PolarHBondContact O-N 3.35Å; T491-E495 VanDerWaalsContact CB-OE1 3.31Å; T491-E495 WeakPolarHBondContact CB-OE1 3.07Å; T491-E495 WeakPolarHBondContact CG2-OE1 3.14Å; T491-E495 PolarHBondContact OG1-OE1 3.42Å
492	K	84.2	Confident	92.7	Very high	113 Å²	113	60.1 Å²	60.1	49%	0.491	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.5	33.7	-172.9	-55.5	-64.6	-177.5	-169	0	112.3	Y487 N488 M489 M520	Y487-K492 WeakPolarHBondContact OH-CD 3.36Å; N488-K492 VanDerWaalsContact O-CA 3.26Å; N488-K492 WeakPolarHBondContact O-CA 3.3Å; N488-K492 PolarHBondContact O-N 2.75Å; M489-K492 WeakPolarHBondContact O-CD 3.32Å; M489-K492 WeakPolarHBondContact O-CE 3.4Å; M489-K492 PolarHBondContact O-NZ 2.03Å; M489-K492 VanDerWaalsContact O-NZ 3.13Å; K492-M520 WeakPolarHBondContact O-CE 3.38Å
493	K	88.4	Confident	91.9	Very high	135 Å²	135	59.9 Å²	59.9	59%	0.587	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.3	150.1	-177.1	-70.2	178.1	-173.4	-179.2	0	111.3	N488 T491 E495	N488-K493 PolarHBondContact N-O 3.44Å; N488-K493 PolarHBondContact O-N 3.4Å; T491-K493 WeakPolarHBondContact O-CG 3.49Å; T491-K493 PolarHBondContact O-N 3.35Å; K493-E495 HydrophobicContact CB-CG 4.46Å; K493-E495 PolarHBondContact O-N 3.3Å
494	C	94.6	Very high	91.4	Very high	11 Å²	11	58.3 Å²	58.3	7%	0.074	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	112.4	165.8	-74.3	0	0	0	0	109.4	Y486 K512 C515 E516 M520	Y486-C494 CarbonylContact O-C 3.57Å; Y486-C494 WeakPolarHBondContact O-CA 3.34Å; C494-K512 HydrophobicContact CB-CG 4.29Å; C494-C515 HydrophobicContact CB-CB 3.67Å; C494-C515 WeakPolarHBondContact CB-SG 3.4Å; C494-C515 WeakPolarHBondContact SG-CB 3.21Å; C494-C515 CovalentContact SG-SG 2.03Å; C494-C515 PolarHBondContact SG-SG 2.79Å; C494-E516 HydrophobicContact CB-CG 3.96Å; C494-E516 PolarHBondContact SG-N 2.98Å; C494-E516 VanDerWaalsContact SG-N 3.4Å; C494-M520 HydrophobicContact CB-CE 4.27Å; C494-M520 VanDerWaalsContact N-CE 3.34Å
495	E	96.7	Very high	91.1	Very high	58 Å²	58	57.2 Å²	57.2	27%	0.271	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	147.9	-176.3	-71.7	175.6	-170.8	0	0	110.8	Y485 Y486 N488 T491 K493	Y485-E495 CarbonylContact C-O 3.48Å; Y485-E495 VanDerWaalsContact CA-O 3.27Å; Y485-E495 WeakPolarHBondContact CA-O 3.18Å; Y486-E495 HydrophobicContact CD1-CB 4.27Å; Y486-E495 WeakPolarHBondContact CD1-O 3.41Å; Y486-E495 HydrophobicContact CE1-CB 3.72Å; Y486-E495 PolarHBondContact N-O 3.18Å; Y486-E495 PolarHBondContact O-N 2.97Å; Y486-E495 PolarHBondContact OH-OE2 2.9Å; N488-E495 HydrophobicContact CB-CG 4.23Å; N488-E495 VanDerWaalsContact ND2-CD 3.29Å; N488-E495 PolarHBondContact ND2-OE1 2.74Å; N488-E495 PolarHBondContact ND2-OE2 3.42Å; T491-E495 VanDerWaalsContact CB-OE1 3.31Å; T491-E495 WeakPolarHBondContact CB-OE1 3.07Å; T491-E495 WeakPolarHBondContact CG2-OE1 3.14Å; T491-E495 PolarHBondContact OG1-OE1 3.42Å; K493-E495 HydrophobicContact CB-CG 4.46Å; K493-E495 PolarHBondContact O-N 3.3Å
496	Q	96.1	Very high	90.8	Very high	107 Å²	107	60.5 Å²	60.5	50%	0.5	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	142.8	178.5	-168.3	-179	-39.6	0	0	111.1	V483 R484 Y485	V483-Q496 HydrophobicContact CG1-CG 3.53Å; R484-Q496 CarbonylContact O-C 3.47Å; R484-Q496 VanDerWaalsContact O-CA 3.3Å; R484-Q496 WeakPolarHBondContact O-CA 3.37Å; Y485-Q496 HydrophobicContact CD1-CB 4.16Å; Y485-Q496 HydrophobicContact CE1-CB 3.86Å; Y485-Q496 HydrophobicContact CE1-CG 4.27Å
497	F	97.1	Very high	90.7	Very high	12 Å²	12	59.7 Å²	59.7	5%	0.053	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	165.7	168.7	79.4	-69.9	0	0	0	111.5	K473 V474 R484 Y486 N508	K473-F497 HydrophobicContact CB-CD2 4.07Å; K473-F497 HydrophobicContact CB-CE2 4.36Å; K473-F497 HydrophobicContact CB-CG 4.18Å; K473-F497 HydrophobicContact CD-CB 3.91Å; K473-F497 HydrophobicContact CD-CG 4.35Å; V474-F497 WeakPolarHBondContact O-CE2 3.45Å; R484-F497 HydrophobicContact CB-CD1 4.01Å; R484-F497 HydrophobicContact CB-CE1 3.49Å; R484-F497 VanDerWaalsContact CB-CE1 3.49Å; R484-F497 HydrophobicContact CB-CZ 3.93Å; R484-F497 PolarHBondContact N-O 2.81Å; R484-F497 WeakPolarHBondContact O-CD1 3.38Å; R484-F497 PolarHBondContact O-N 3.24Å; Y486-F497 HydrophobicContact CD1-CB 4.1Å; Y486-F497 AromaticContact CD1-CD1 3.72Å; Y486-F497 HydrophobicContact CD1-CD1 3.72Å; Y486-F497 HydrophobicContact CD1-CE1 4.47Å; Y486-F497 HydrophobicContact CD1-CG 4.13Å; Y486-F497 HydrophobicContact CE1-CB 4.25Å; Y486-F497 HydrophobicContact CG-CD1 4.29Å; F497-N508 HydrophobicContact CZ-CB 4.17Å
498	R	96.5	Very high	90.8	Very high	164 Å²	164	59.7 Å²	59.7	62%	0.619	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97	108.1	177.4	-67	178	-176.6	-87.5	3.3	108.9	V481	V481-R498 HydrophobicContact CG1-CB 4.38Å; V481-R498 HydrophobicContact CG1-CG 4.09Å
499	Y	96.3	Very high	90.9	Very high	25 Å²	25	59.6 Å²	59.6	10%	0.098	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	130.8	175.3	176.3	-129.9	0	0	0	110.7	V475 I482 R484 G501 C502 Q503 G504 N508	V475-Y499 VanDerWaalsContact O-CD2 3.3Å; V475-Y499 WeakPolarHBondContact O-CD2 3.34Å; I482-Y499 HydrophobicContact CB-CD1 4.41Å; I482-Y499 WeakPolarHBondContact CB-O 3.43Å; I482-Y499 HydrophobicContact CD1-CD1 4.48Å; I482-Y499 PolarHBondContact N-O 3.35Å; I482-Y499 WeakPolarHBondContact O-CB 3.37Å; I482-Y499 PolarHBondContact O-N 3.36Å; R484-Y499 HydrophobicContact CG-CD1 4.18Å; R484-Y499 HydrophobicContact CG-CG 4.27Å; Y499-G501 VanDerWaalsContact CE1-C 3.44Å; Y499-G501 VanDerWaalsContact CE1-CA 3.45Å; Y499-G501 VanDerWaalsContact CZ-C 3.46Å; Y499-G501 PolarHBondContact O-N 2.97Å; Y499-G501 VanDerWaalsContact O-N 3.16Å; Y499-C502 VanDerWaalsContact CE2-O 3.3Å; Y499-C502 WeakPolarHBondContact CE2-O 3.06Å; Y499-C502 WeakPolarHBondContact OH-CA 3.34Å; Y499-C502 PolarHBondContact OH-N 2.79Å; Y499-C502 PolarHBondContact OH-O 2.87Å; Y499-Q503 PolarHBondContact OH-N 3.17Å; Y499-G504 VanDerWaalsContact CE2-CA 3.43Å; Y499-G504 VanDerWaalsContact CE2-N 3.28Å; Y499-G504 PolarHBondContact OH-N 2.02Å; Y499-N508 WeakPolarHBondContact CD1-ND2 3.21Å; Y499-N508 VanDerWaalsContact CD2-ND2 3.32Å; Y499-N508 WeakPolarHBondContact CD2-ND2 3.46Å; Y499-N508 VanDerWaalsContact CG-ND2 3.28Å
500	G	90.5	Very high	91.3	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	31%	0.312	C	S	.	.			trans	-62.7	-14.8	179.2	0	0	0	0	0	114.6	V475 C478 A480	V475-G500 VanDerWaalsContact O-CA 3.22Å; V475-G500 WeakPolarHBondContact O-CA 3.07Å; V475-G500 PolarHBondContact O-N 3.45Å; C478-G500 CarbonylContact C-O 3.14Å; C478-G500 WeakPolarHBondContact CB-O 3.31Å; C478-G500 CarbonylContact O-C 3.53Å; C478-G500 WeakPolarHBondContact O-CA 3.46Å; A480-G500 WeakPolarHBondContact CA-O 3.18Å; A480-G500 WeakPolarHBondContact CB-O 3.43Å; A480-G500 PolarHBondContact N-O 2.83Å; A480-G500 CarbonylContact O-C 3.11Å; A480-G500 WeakPolarHBondContact O-CA 3.31Å
501	G	88.3	Confident	91.9	Very high	33 Å²	33	55.8 Å²	55.8	34%	0.34	29%	0.292	S	S	.	.	S	Bend	trans	98.4	-12.5	177.9	0	0	0	0	0	115.2	Y499	Y499-G501 VanDerWaalsContact CE1-C 3.44Å; Y499-G501 VanDerWaalsContact CE1-CA 3.45Å; Y499-G501 VanDerWaalsContact CZ-C 3.46Å; Y499-G501 PolarHBondContact O-N 2.97Å; Y499-G501 VanDerWaalsContact O-N 3.16Å
502	C	87.5	Confident	92.1	Very high	34 Å²	34	57.8 Å²	57.8	23%	0.23	30%	0.295	C	S	.	.	S	Bend	trans	-143.6	161.3	172.6	76.1	0	0	0	0	111.5	C478 Y499 G504	C478-C502 HydrophobicContact CB-CB 3.86Å; C478-C502 WeakPolarHBondContact CB-SG 3.34Å; C478-C502 WeakPolarHBondContact SG-CB 2.99Å; C478-C502 CovalentContact SG-SG 2.01Å; C478-C502 PolarHBondContact SG-SG 3.47Å; Y499-C502 VanDerWaalsContact CE2-O 3.3Å; Y499-C502 WeakPolarHBondContact CE2-O 3.06Å; Y499-C502 WeakPolarHBondContact OH-CA 3.34Å; Y499-C502 PolarHBondContact OH-N 2.79Å; Y499-C502 PolarHBondContact OH-O 2.87Å; C502-G504 VanDerWaalsContact C-N 3.28Å; C502-G504 PolarHBondContact O-N 3.16Å
503	Q	78.9	Confident	92.3	Very high	53 Å²	53	55.2 Å²	55.2	25%	0.248	30%	0.295	C	S	.	.	S	Bend	trans	55.4	34.7	175.1	-51.7	-176.1	-12.2	0	0	115.4	M436 V474 P477 Y499	M436-Q503 HydrophobicContact CE-CB 4.18Å; V474-Q503 WeakPolarHBondContact CG1-O 3.4Å; P477-Q503 HydrophobicContact CG-CG 4.35Å; Y499-Q503 PolarHBondContact OH-N 3.17Å
504	G	85.6	Confident	92.4	Very high	29 Å²	29	52 Å²	52	30%	0.299	28%	0.284	S	S	.	.			trans	-77.2	167.2	165.5	0	0	0	0	0	111	Y499 C502	Y499-G504 VanDerWaalsContact CE2-CA 3.43Å; Y499-G504 VanDerWaalsContact CE2-N 3.28Å; Y499-G504 PolarHBondContact OH-N 2.02Å; C502-G504 VanDerWaalsContact C-N 3.28Å; C502-G504 PolarHBondContact O-N 3.16Å
505	N	90.3	Very high	92.4	Very high	39 Å²	39	51.5 Å²	51.5	21%	0.209	28%	0.281	C	S	.	.			trans	-98.8	-174.3	168.4	67.5	7	0	0	0	110.6	Q471 P472 V474 N507 N508	Q471-N505 WeakPolarHBondContact CB-ND2 3.01Å; P472-N505 PolarHBondContact O-ND2 3.31Å; P472-N505 PolarHBondContact O-OD1 2.87Å; V474-N505 HydrophobicContact CG2-CB 4.35Å; V474-N505 WeakPolarHBondContact CG2-ND2 3.33Å; N505-N507 VanDerWaalsContact C-N 3.26Å; N505-N507 PolarHBondContact O-N 3.13Å; N505-N507 PolarHBondContact OD1-N 2.98Å; N505-N508 WeakPolarHBondContact O-CB 3.46Å
506	E	91.8	Very high	92.1	Very high	121 Å²	121	52 Å²	52	57%	0.565	28%	0.283	S	S	*	.	S	Bend	trans	-75.5	-12.7	-173.8	-61.1	-177.5	145.7	0	0	113.3	P468 N508	P468-E506 HydrophobicContact CB-CB 3.67Å; P468-E506 HydrophobicContact CG-CB 3.93Å; P468-E506 WeakPolarHBondContact CG-OE2 2.98Å; E506-N508 PolarHBondContact O-N 3.48Å
507	N	95.6	Very high	91.5	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	30%	0.296	C	S	.	.	S	Bend	trans	-77.4	51.2	170.3	-152.5	0.1	0	0	0	111.5	P468 Q471 Y486 Y487 N505 F509	P468-N507 WeakPolarHBondContact O-CB 3.13Å; Q471-N507 HydrophobicContact CB-CB 4.15Å; Q471-N507 PolarHBondContact O-ND2 3.29Å; Y486-N507 WeakPolarHBondContact CA-OD1 3.43Å; Y486-N507 WeakPolarHBondContact CB-O 3.49Å; Y487-N507 PolarHBondContact N-OD1 2.81Å; Y487-N507 PolarHBondContact O-ND2 2.01Å; N505-N507 VanDerWaalsContact C-N 3.26Å; N505-N507 PolarHBondContact O-N 3.13Å; N505-N507 PolarHBondContact OD1-N 2.98Å; N507-F509 WeakPolarHBondContact OD1-CE2 3.14Å
508	N	96.5	Very high	91.1	Very high	26 Å²	26	61.6 Å²	61.6	14%	0.139	32%	0.321	C	S	.	.			trans	-144	91.4	-171.3	-174.5	-28.9	0	0	0	109.4	R484 F497 Y499 N505 E506	R484-N508 WeakPolarHBondContact CB-OD1 3.35Å; R484-N508 VanDerWaalsContact CD-OD1 3.26Å; R484-N508 WeakPolarHBondContact CD-OD1 3.42Å; R484-N508 WeakPolarHBondContact CG-OD1 3.35Å; R484-N508 PolarHBondContact NH1-OD1 3.23Å; F497-N508 HydrophobicContact CZ-CB 4.17Å; Y499-N508 WeakPolarHBondContact CD1-ND2 3.21Å; Y499-N508 VanDerWaalsContact CD2-ND2 3.32Å; Y499-N508 WeakPolarHBondContact CD2-ND2 3.46Å; Y499-N508 VanDerWaalsContact CG-ND2 3.28Å; N505-N508 WeakPolarHBondContact O-CB 3.46Å; E506-N508 PolarHBondContact O-N 3.48Å
509	F	96.7	Very high	90.7	Very high	24 Å²	24	54.1 Å²	54.1	11%	0.105	29%	0.294	C	S	.	.	B	Isolated β-bridge	trans	-103.6	140.6	-174.8	-58.7	-78.5	0	0	0	110.9	R484 Y485 N507 D514 C515 R518 C519	R484-F509 CarbonylContact C-O 3.56Å; R484-F509 WeakPolarHBondContact CA-O 3.41Å; R484-F509 WeakPolarHBondContact CD-O 3.31Å; Y485-F509 PolarHBondContact N-O 2.82Å; Y485-F509 WeakPolarHBondContact O-CD2 3.3Å; Y485-F509 PolarHBondContact O-N 2.9Å; N507-F509 WeakPolarHBondContact OD1-CE2 3.14Å; F509-D514 HydrophobicContact CB-CB 4.19Å; F509-D514 HydrophobicContact CD1-CB 4.21Å; F509-C515 HydrophobicContact CB-CB 3.7Å; F509-C515 HydrophobicContact CD1-CB 4.38Å; F509-C515 HydrophobicContact CD2-CB 3.33Å; F509-C515 VanDerWaalsContact CD2-SG 3.54Å; F509-C515 HydrophobicContact CE2-CB 4.04Å; F509-C515 VanDerWaalsContact CG-CA 3.45Å; F509-C515 HydrophobicContact CG-CB 3.53Å; F509-R518 HydrophobicContact CE1-CB 3.66Å; F509-R518 HydrophobicContact CE1-CG 3.69Å; F509-R518 HydrophobicContact CZ-CB 3.94Å; F509-R518 HydrophobicContact CZ-CG 3.77Å; F509-C519 VanDerWaalsContact CZ-SG 3.58Å
510	A	94.6	Very high	90.1	Very high	67 Å²	67	55.1 Å²	55.1	55%	0.554	30%	0.301	S	S	*	.	S	Bend	trans	-66.2	-42.3	179.5	0	0	0	0	0	111.3
511	T	94.8	Very high	88.5	Confident	63 Å²	63	58 Å²	58	39%	0.387	32%	0.319	S	S	.	.	S	Bend	trans	-121.3	160.9	177.5	75.9	0	0	0	0	111.9	A513 D514 C515	T511-A513 VanDerWaalsContact C-N 3.27Å; T511-A513 PolarHBondContact O-N 2.92Å; T511-A513 PolarHBondContact OG1-N 2.76Å; T511-D514 WeakPolarHBondContact CB-OD2 3.27Å; T511-D514 PolarHBondContact N-OD2 2.76Å; T511-D514 VanDerWaalsContact N-OD2 3.07Å; T511-D514 PolarHBondContact O-N 2.9Å; T511-D514 PolarHBondContact OG1-N 2.84Å; T511-D514 VanDerWaalsContact OG1-N 3.13Å; T511-D514 PolarHBondContact OG1-OD1 3.32Å; T511-D514 PolarHBondContact OG1-OD2 2.73Å; T511-C515 PolarHBondContact O-N 3.5Å
512	K	93.9	Very high	86.8	Confident	100 Å²	100	63.6 Å²	63.6	44%	0.435	33%	0.33	S	S	.	.	H	α-helix	trans	-60.6	-39.9	172.9	-173.2	179.8	160.2	-172.3	0	111.3	Y485 C494 C515 E516	Y485-K512 HydrophobicContact CD1-CB 3.76Å; Y485-K512 HydrophobicContact CD1-CG 4.08Å; Y485-K512 HydrophobicContact CD2-CB 4.31Å; Y485-K512 HydrophobicContact CE1-CB 3.67Å; Y485-K512 HydrophobicContact CE1-CD 4.4Å; Y485-K512 HydrophobicContact CE1-CG 4.14Å; Y485-K512 HydrophobicContact CE2-CB 4.21Å; Y485-K512 HydrophobicContact CG-CB 4.09Å; C494-K512 HydrophobicContact CB-CG 4.29Å; K512-C515 WeakPolarHBondContact O-CB 3.29Å; K512-C515 PolarHBondContact O-N 3.49Å; K512-E516 VanDerWaalsContact CE-CD 3.49Å; K512-E516 WeakPolarHBondContact CE-OE1 3.26Å; K512-E516 HydrophobicContact CG-CG 4.34Å; K512-E516 IonicContact NZ-OE1 3.25Å; K512-E516 WeakPolarHBondContact O-CG 3.21Å; K512-E516 PolarHBondContact O-N 3.35Å
513	A	86.6	Confident	85.2	Confident	58 Å²	58	71 Å²	71	48%	0.479	36%	0.361	S	S	.	.	H	α-helix	trans	-63.2	-41.6	179.7	0	0	0	0	0	112.1	T511 C515 E516 Q517	T511-A513 VanDerWaalsContact C-N 3.27Å; T511-A513 PolarHBondContact O-N 2.92Å; T511-A513 PolarHBondContact OG1-N 2.76Å; A513-C515 VanDerWaalsContact C-N 3.3Å; A513-C515 PolarHBondContact O-N 3.42Å; A513-E516 PolarHBondContact O-N 2.82Å; A513-Q517 VanDerWaalsContact O-CB 3.32Å; A513-Q517 WeakPolarHBondContact O-CB 3Å; A513-Q517 PolarHBondContact O-N 3.07Å
514	D	91.9	Very high	84.5	Confident	68 Å²	68	73.7 Å²	73.7	36%	0.364	37%	0.372	S	S	.	.	H	α-helix	trans	-60.9	-41.9	176.2	-56.1	-38	0	0	0	111.3	F509 T511 R518	F509-D514 HydrophobicContact CB-CB 4.19Å; F509-D514 HydrophobicContact CD1-CB 4.21Å; T511-D514 WeakPolarHBondContact CB-OD2 3.27Å; T511-D514 PolarHBondContact N-OD2 2.76Å; T511-D514 VanDerWaalsContact N-OD2 3.07Å; T511-D514 PolarHBondContact O-N 2.9Å; T511-D514 PolarHBondContact OG1-N 2.84Å; T511-D514 VanDerWaalsContact OG1-N 3.13Å; T511-D514 PolarHBondContact OG1-OD1 3.32Å; T511-D514 PolarHBondContact OG1-OD2 2.73Å; D514-R518 VanDerWaalsContact O-CB 3.22Å; D514-R518 WeakPolarHBondContact O-CB 2.99Å; D514-R518 PolarHBondContact O-N 2.79Å
515	C	94.5	Very high	84.3	Confident	0 Å²	0	75.9 Å²	75.9	0%	0	38%	0.381	C	S	.	.	H	α-helix	trans	-63.6	-47.7	175.3	179.7	0	0	0	0	111.5	Y487 C494 F509 T511 K512 A513 R518 C519	Y487-C515 PolarHBondContact N-SG 2.79Å; C494-C515 HydrophobicContact CB-CB 3.67Å; C494-C515 WeakPolarHBondContact CB-SG 3.4Å; C494-C515 WeakPolarHBondContact SG-CB 3.21Å; C494-C515 CovalentContact SG-SG 2.03Å; C494-C515 PolarHBondContact SG-SG 2.79Å; F509-C515 HydrophobicContact CB-CB 3.7Å; F509-C515 HydrophobicContact CD1-CB 4.38Å; F509-C515 HydrophobicContact CD2-CB 3.33Å; F509-C515 VanDerWaalsContact CD2-SG 3.54Å; F509-C515 HydrophobicContact CE2-CB 4.04Å; F509-C515 VanDerWaalsContact CG-CA 3.45Å; F509-C515 HydrophobicContact CG-CB 3.53Å; T511-C515 PolarHBondContact O-N 3.5Å; K512-C515 WeakPolarHBondContact O-CB 3.29Å; K512-C515 PolarHBondContact O-N 3.49Å; A513-C515 VanDerWaalsContact C-N 3.3Å; A513-C515 PolarHBondContact O-N 3.42Å; C515-R518 PolarHBondContact O-N 3.32Å; C515-C519 WeakPolarHBondContact O-CA 3.3Å; C515-C519 WeakPolarHBondContact O-CB 3.39Å; C515-C519 PolarHBondContact O-N 2.95Å
516	E	89.8	Confident	84.2	Confident	68 Å²	68	75.8 Å²	75.8	32%	0.318	38%	0.382	S	S	.	.	H	α-helix	trans	-65	-45.5	-178.5	-70.6	177.7	151.3	0	0	111.1	C494 K512 A513 R518 C519 M520	C494-E516 HydrophobicContact CB-CG 3.96Å; C494-E516 PolarHBondContact SG-N 2.98Å; C494-E516 VanDerWaalsContact SG-N 3.4Å; K512-E516 VanDerWaalsContact CE-CD 3.49Å; K512-E516 WeakPolarHBondContact CE-OE1 3.26Å; K512-E516 HydrophobicContact CG-CG 4.34Å; K512-E516 IonicContact NZ-OE1 3.25Å; K512-E516 WeakPolarHBondContact O-CG 3.21Å; K512-E516 PolarHBondContact O-N 3.35Å; A513-E516 PolarHBondContact O-N 2.82Å; E516-R518 VanDerWaalsContact C-N 3.32Å; E516-R518 PolarHBondContact O-N 2.86Å; E516-C519 PolarHBondContact O-N 2.89Å; E516-M520 HydrophobicContact CB-SD 4.17Å; E516-M520 HydrophobicContact CG-CE 4.01Å; E516-M520 HydrophobicContact CG-SD 3.84Å; E516-M520 WeakPolarHBondContact O-CA 3.46Å; E516-M520 VanDerWaalsContact O-CB 3.24Å; E516-M520 WeakPolarHBondContact O-CB 3.06Å; E516-M520 PolarHBondContact O-N 3.3Å
517	Q	83.8	Confident	84.2	Confident	165 Å²	165	71.3 Å²	71.3	77%	0.771	36%	0.364	S	S	*	.	H	α-helix	trans	-61.1	-40.7	176.5	-172.9	-177.7	14.3	0	0	111.9	A513	A513-Q517 VanDerWaalsContact O-CB 3.32Å; A513-Q517 WeakPolarHBondContact O-CB 3Å; A513-Q517 PolarHBondContact O-N 3.07Å
518	R	87.6	Confident	83.8	Confident	156 Å²	156	77.3 Å²	77.3	59%	0.589	39%	0.392	S	S	*	.	H	α-helix	trans	-75	-39.5	179.8	-177.1	59.3	174.4	-171.6	-1.5	112.8	F509 D514 C515 E516	F509-R518 HydrophobicContact CE1-CB 3.66Å; F509-R518 HydrophobicContact CE1-CG 3.69Å; F509-R518 HydrophobicContact CZ-CB 3.94Å; F509-R518 HydrophobicContact CZ-CG 3.77Å; D514-R518 VanDerWaalsContact O-CB 3.22Å; D514-R518 WeakPolarHBondContact O-CB 2.99Å; D514-R518 PolarHBondContact O-N 2.79Å; C515-R518 PolarHBondContact O-N 3.32Å; E516-R518 VanDerWaalsContact C-N 3.32Å; E516-R518 PolarHBondContact O-N 2.86Å
519	C	89.5	Confident	83.3	Confident	8 Å²	8	76.6 Å²	76.6	5%	0.054	39%	0.388	C	S	.	.	H	α-helix	trans	-110.7	-6.9	-165.8	-63.2	0	0	0	0	115.8	C469 Y487 F509 C515 E516 P521	C469-C519 HydrophobicContact CB-CB 3.59Å; C469-C519 WeakPolarHBondContact CB-SG 3.39Å; C469-C519 WeakPolarHBondContact SG-CA 2.99Å; C469-C519 WeakPolarHBondContact SG-CB 3.28Å; C469-C519 CovalentContact SG-SG 2.03Å; C469-C519 PolarHBondContact SG-SG 3.33Å; Y487-C519 HydrophobicContact CD1-CB 4.11Å; Y487-C519 HydrophobicContact CD2-CB 3.78Å; Y487-C519 HydrophobicContact CE2-CB 4.45Å; Y487-C519 HydrophobicContact CG-CB 3.59Å; F509-C519 VanDerWaalsContact CZ-SG 3.58Å; C515-C519 WeakPolarHBondContact O-CA 3.3Å; C515-C519 WeakPolarHBondContact O-CB 3.39Å; C515-C519 PolarHBondContact O-N 2.95Å; E516-C519 PolarHBondContact O-N 2.89Å; C519-P521 WeakPolarHBondContact O-CD 3.09Å
520	M	83.6	Confident	82.9	Confident	46 Å²	46	79.3 Å²	79.3	23%	0.227	41%	0.408	C	S	.	.			trans	-122.5	78	178	-55.8	-176.1	-178.1	0	0	110.9	Y487 K492 C494 E516 W522	Y487-M520 HydrophobicContact CD2-CE 4.02Å; Y487-M520 HydrophobicContact CD2-CG 4.42Å; Y487-M520 HydrophobicContact CE2-CE 3.82Å; Y487-M520 HydrophobicContact CE2-CG 3.97Å; K492-M520 WeakPolarHBondContact O-CE 3.38Å; C494-M520 HydrophobicContact CB-CE 4.27Å; C494-M520 VanDerWaalsContact N-CE 3.34Å; E516-M520 HydrophobicContact CB-SD 4.17Å; E516-M520 HydrophobicContact CG-CE 4.01Å; E516-M520 HydrophobicContact CG-SD 3.84Å; E516-M520 WeakPolarHBondContact O-CA 3.46Å; E516-M520 VanDerWaalsContact O-CB 3.24Å; E516-M520 WeakPolarHBondContact O-CB 3.06Å; E516-M520 PolarHBondContact O-N 3.3Å; M520-W522 PolarHBondContact O-N 3.44Å
521	P	55.5	Low	82.6	Confident	59 Å²	59	80.6 Å²	80.6	38%	0.383	40%	0.401	S	S	.	.			trans	-73.5	11.6	-166.8	-14.8	30	0	0	0	117.2	C519 Q523 K524	C519-P521 WeakPolarHBondContact O-CD 3.09Å; P521-Q523 PolarHBondContact O-N 3.04Å; P521-K524 PolarHBondContact O-N 2.83Å; P521-K524 VanDerWaalsContact O-N 3.12Å
522	W	53.5	Low	82.4	Confident	151 Å²	151	79.8 Å²	79.8	57%	0.572	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	15.8	-176.8	-50.5	97.7	0	0	0	114.7	M520 E532 N563	M520-W522 PolarHBondContact O-N 3.44Å; W522-E532 VanDerWaalsContact CH2-CD 3.4Å; W522-E532 WeakPolarHBondContact CH2-OE1 3.35Å; W522-E532 WeakPolarHBondContact CH2-OE2 3.32Å; W522-E532 WeakPolarHBondContact CZ3-OE1 3.26Å; W522-E532 WeakPolarHBondContact CZ3-OE2 3.43Å; W522-N563 HydrophobicContact CE3-CB 4.19Å; W522-N563 HydrophobicContact CZ3-CB 3.95Å
523	Q	54	Low	82.1	Confident	191 Å²	191	79.7 Å²	79.7	89%	0.893	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.7	1.6	175.9	-63	-168.7	-6	0	0	114.1	P521	P521-Q523 PolarHBondContact O-N 3.04Å
524	K	65.2	Low	82.1	Confident	109 Å²	109	78.6 Å²	78.6	47%	0.474	39%	0.388	S	S	.	.	S	Bend	trans	-74.1	152.6	175.2	-70.2	-170	179	-176.1	0	111.7	P521 E528 Q529	P521-K524 PolarHBondContact O-N 2.83Å; P521-K524 VanDerWaalsContact O-N 3.12Å; K524-E528 HydrophobicContact CB-CB 4.21Å; K524-E528 HydrophobicContact CD-CB 4.36Å; K524-Q529 HydrophobicContact CB-CG 4.23Å; K524-Q529 PolarHBondContact O-NE2 2.9Å
525	P	81.1	Confident	81.7	Confident	75 Å²	75	82 Å²	82	49%	0.487	41%	0.407	S	S	.	.			trans	-53.2	147.3	171.7	-24.1	33.6	0	0	0	111.7	C527 E528	P525-C527 VanDerWaalsContact C-N 3.35Å; P525-C527 PolarHBondContact O-N 3.42Å; P525-C527 VanDerWaalsContact O-N 3.15Å; P525-E528 WeakPolarHBondContact O-CB 2.94Å; P525-E528 PolarHBondContact O-N 2.99Å
526	P	87.1	Confident	81.4	Confident	36 Å²	36	84.8 Å²	84.8	23%	0.234	43%	0.426	C	S	.	.	G	3₁₀ helix	trans	-47.5	-49.3	-172.8	-31.2	34.7	0	0	0	114.6	E528 Q529 D564 N565 F567	P526-E528 PolarHBondContact O-N 2.84Å; P526-Q529 WeakPolarHBondContact O-CB 3.48Å; P526-Q529 PolarHBondContact O-N 3.46Å; P526-Q529 VanDerWaalsContact O-N 3.07Å; P526-D564 HydrophobicContact CB-CB 3.62Å; P526-D564 HydrophobicContact CG-CB 3.58Å; P526-N565 WeakPolarHBondContact O-CB 3.41Å; P526-F567 HydrophobicContact CB-CZ 4.43Å
527	C	92.6	Very high	81	Confident	28 Å²	28	90 Å²	90	19%	0.189	46%	0.455	C	S	.	.	G	3₁₀ helix	trans	-69.7	-6.3	-177.1	-50.9	0	0	0	0	114.6	P525 Y545 C577	P525-C527 VanDerWaalsContact C-N 3.35Å; P525-C527 PolarHBondContact O-N 3.42Å; P525-C527 VanDerWaalsContact O-N 3.15Å; C527-Y545 HydrophobicContact CB-CD1 4.19Å; C527-Y545 HydrophobicContact CB-CG 4.33Å; C527-Y545 VanDerWaalsContact O-CD1 3.25Å; C527-Y545 WeakPolarHBondContact O-CD1 3.48Å; C527-C577 HydrophobicContact CB-CB 3.79Å; C527-C577 WeakPolarHBondContact CB-SG 3.41Å; C527-C577 WeakPolarHBondContact SG-CA 2.92Å; C527-C577 WeakPolarHBondContact SG-CB 3.02Å; C527-C577 CovalentContact SG-SG 2.04Å; C527-C577 PolarHBondContact SG-SG 2.77Å
528	E	86.5	Confident	80.9	Confident	126 Å²	126	83.3 Å²	83.3	59%	0.589	43%	0.43	S	S	*	.	G	3₁₀ helix	trans	-102.6	-5.6	175.3	-65.1	-179.2	-149.2	0	0	113	K524 P525 P526	K524-E528 HydrophobicContact CB-CB 4.21Å; K524-E528 HydrophobicContact CD-CB 4.36Å; P525-E528 WeakPolarHBondContact O-CB 2.94Å; P525-E528 PolarHBondContact O-N 2.99Å; P526-E528 PolarHBondContact O-N 2.84Å
529	Q	86.4	Confident	80.9	Confident	11 Å²	11	82.8 Å²	82.8	5%	0.051	44%	0.436	C	S	.	.	S	Bend	trans	-82.5	152	176.6	-58.5	171.2	-0.5	0	0	110.1	K524 P526 N563 D564 N565	K524-Q529 HydrophobicContact CB-CG 4.23Å; K524-Q529 PolarHBondContact O-NE2 2.9Å; P526-Q529 WeakPolarHBondContact O-CB 3.48Å; P526-Q529 PolarHBondContact O-N 3.46Å; P526-Q529 VanDerWaalsContact O-N 3.07Å; Q529-N563 VanDerWaalsContact OE1-CG 3.25Å; Q529-N563 PolarHBondContact OE1-OD1 2.6Å; Q529-D564 PolarHBondContact NE2-OD2 2.88Å; Q529-N565 HydrophobicContact CB-CB 4.13Å; Q529-N565 PolarHBondContact O-ND2 2.8Å
530	P	88.5	Confident	80.9	Confident	81 Å²	81	87.8 Å²	87.8	53%	0.526	46%	0.457	S	S	.	.	P	Polyproline II helix	trans	-71.9	164.6	176.1	31.2	-35.6	0	0	0	111.7	N563	P530-N563 PolarHBondContact O-ND2 2.83Å; P530-N563 PolarHBondContact O-OD1 3.19Å
531	K	88.8	Confident	81.4	Confident	93 Å²	93	91.1 Å²	91.1	40%	0.404	47%	0.47	S	S	.	.	P	Polyproline II helix	trans	-67.1	137.5	164.8	64.4	164.5	-173.6	152.6	0	110.3	E533 F544 F555	K531-E533 IonicContact NZ-OE1 2.83Å; K531-E533 PolarHBondContact NZ-OE1 2.76Å; K531-F544 HydrophobicContact CB-CB 4.18Å; K531-F544 HydrophobicContact CB-CD1 3.84Å; K531-F544 HydrophobicContact CB-CD2 3.61Å; K531-F544 HydrophobicContact CB-CE1 4.09Å; K531-F544 HydrophobicContact CB-CE2 3.85Å; K531-F544 HydrophobicContact CB-CG 3.59Å; K531-F544 HydrophobicContact CB-CZ 4.09Å; K531-F544 HydrophobicContact CD-CD1 4.16Å; K531-F544 HydrophobicContact CD-CE1 3.67Å; K531-F544 HydrophobicContact CD-CE2 4.29Å; K531-F544 HydrophobicContact CD-CZ 3.74Å; K531-F544 HydrophobicContact CG-CD1 4.48Å; K531-F544 HydrophobicContact CG-CD2 4.32Å; K531-F544 HydrophobicContact CG-CE1 4.23Å; K531-F544 HydrophobicContact CG-CE2 4.04Å; K531-F544 HydrophobicContact CG-CZ 4Å; K531-F555 HydrophobicContact CB-CD2 4.29Å; K531-F555 HydrophobicContact CB-CG 4.39Å; K531-F555 HydrophobicContact CD-CB 4Å; K531-F555 HydrophobicContact CD-CG 4.4Å
532	E	89.2	Confident	83.4	Confident	46 Å²	46	90 Å²	90	22%	0.215	46%	0.459	C	S	.	.			trans	-128.3	108.2	173.1	-78.4	-176.5	-176.5	0	0	110.5	W522 G534 F555 Y557	W522-E532 VanDerWaalsContact CH2-CD 3.4Å; W522-E532 WeakPolarHBondContact CH2-OE1 3.35Å; W522-E532 WeakPolarHBondContact CH2-OE2 3.32Å; W522-E532 WeakPolarHBondContact CZ3-OE1 3.26Å; W522-E532 WeakPolarHBondContact CZ3-OE2 3.43Å; E532-G534 PolarHBondContact O-N 2.99Å; E532-F555 WeakPolarHBondContact O-CE2 3.2Å; E532-Y557 WeakPolarHBondContact O-CD2 3.41Å
533	E	88.2	Confident	85.4	Confident	98 Å²	98	84.4 Å²	84.4	46%	0.458	44%	0.438	S	S	.	.			trans	-66.6	-22	177.1	-64.4	174	-175.4	0	0	110.5	K531 F555 I556 S558	K531-E533 IonicContact NZ-OE1 2.83Å; K531-E533 PolarHBondContact NZ-OE1 2.76Å; E533-F555 HydrophobicContact CG-CD2 4.09Å; E533-I556 WeakPolarHBondContact CB-O 3.36Å; E533-I556 WeakPolarHBondContact CG-O 3.47Å; E533-S558 WeakPolarHBondContact O-CA 3.4Å; E533-S558 WeakPolarHBondContact O-CB 3.06Å; E533-S558 PolarHBondContact O-N 2.77Å; E533-S558 PolarHBondContact O-OG 2.83Å
534	G	86	Confident	87.3	Confident	35 Å²	35	76.3 Å²	76.3	36%	0.361	40%	0.4	S	S	.	.			trans	70.5	-177.2	-177.7	0	0	0	0	0	112.7	E532 S558 C560	E532-G534 PolarHBondContact O-N 2.99Å; G534-S558 WeakPolarHBondContact CA-OG 3.23Å; G534-S558 PolarHBondContact O-OG 3.14Å; G534-C560 WeakPolarHBondContact CA-O 3.39Å
535	N	83.6	Confident	88.7	Confident	139 Å²	139	73 Å²	73	74%	0.743	39%	0.385	S	S	*	.	S	Bend	trans	-124.1	14.1	-171.5	65.8	-23.7	0	0	0	114.4	S558 C560	N535-S558 PolarHBondContact N-OG 3.01Å; N535-S558 VanDerWaalsContact N-OG 3.09Å; N535-C560 PolarHBondContact OD1-SG 2.84Å
536	C	88.5	Confident	89.1	Confident	59 Å²	59	70.6 Å²	70.6	40%	0.399	37%	0.368	S	S	.	.	S	Bend	trans	-82.2	-177.5	173.6	-87.1	0	0	0	0	112.1	S558 C560	C536-S558 WeakPolarHBondContact CB-O 3.37Å; C536-S558 PolarHBondContact N-OG 3.26Å; C536-S558 VanDerWaalsContact O-CB 3.29Å; C536-S558 WeakPolarHBondContact O-CB 3.37Å; C536-C560 HydrophobicContact CB-CB 3.91Å; C536-C560 WeakPolarHBondContact CB-SG 3.42Å; C536-C560 WeakPolarHBondContact SG-CB 3.11Å; C536-C560 CovalentContact SG-SG 2.01Å; C536-C560 PolarHBondContact SG-SG 3.37Å
537	L	82.4	Confident	89.1	Confident	178 Å²	178	71.9 Å²	71.9	93%	0.932	38%	0.378	S	S	*	.	S	Bend	trans	-100.6	0.7	-177.4	-61.6	176.4	0	0	0	113.9
538	G	80.8	Confident	88.2	Confident	24 Å²	24	79.6 Å²	79.6	25%	0.247	41%	0.408	C	S	.	.			trans	-69.3	163.4	174.7	0	0	0	0	0	111.8	S558	G538-S558 WeakPolarHBondContact CA-O 3.35Å; G538-S558 PolarHBondContact N-O 2.93Å; G538-S558 VanDerWaalsContact O-CA 3.26Å; G538-S558 WeakPolarHBondContact O-CA 3.31Å
539	M	88.9	Confident	87.9	Confident	146 Å²	146	76.8 Å²	76.8	72%	0.719	40%	0.4	S	S	*	.			trans	-138.4	78.8	171.3	-71.3	-172.3	66.6	0	0	108.2	I556	M539-I556 HydrophobicContact CB-CG2 3.84Å; M539-I556 HydrophobicContact CE-CG2 4.12Å; M539-I556 HydrophobicContact CG-CG2 4.05Å
540	F	89	Confident	87.8	Confident	112 Å²	112	82.4 Å²	82.4	49%	0.491	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	122	-178.3	-56.5	-77.6	0	0	0	109.1	K542 Y557	F540-K542 HydrophobicContact CB-CG 4.41Å; F540-K542 PolarHBondContact O-N 3.07Å; F540-Y557 WeakPolarHBondContact CB-O 3.41Å; F540-Y557 WeakPolarHBondContact CD2-O 3.32Å; F540-Y557 PolarHBondContact N-O 3.27Å; F540-Y557 PolarHBondContact O-N 3.14Å
541	K	94	Very high	87.8	Confident	117 Å²	117	83.6 Å²	83.6	51%	0.509	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	118.7	173.1	-176.3	-173.9	178.6	-167.7	0	108.6	Y543 M554	K541-Y543 WeakPolarHBondContact CE-OH 3.32Å; K541-Y543 PolarHBondContact NZ-OH 2.97Å; K541-M554 HydrophobicContact CD-CG 4.35Å; K541-M554 HydrophobicContact CG-CG 3.76Å; K541-M554 HydrophobicContact CG-SD 4.24Å
542	K	96.3	Very high	88	Confident	35 Å²	35	79.5 Å²	79.5	15%	0.152	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	171.3	-180	-66.9	-69.2	-160.2	165.2	0	110	F540 M554 F555 Y557 N566 F567 E568	F540-K542 HydrophobicContact CB-CG 4.41Å; F540-K542 PolarHBondContact O-N 3.07Å; K542-M554 WeakPolarHBondContact O-CA 3.28Å; K542-F555 HydrophobicContact CB-CD1 3.99Å; K542-F555 HydrophobicContact CB-CE1 3.48Å; K542-F555 VanDerWaalsContact CB-CE1 3.48Å; K542-F555 HydrophobicContact CB-CZ 3.83Å; K542-F555 PolarHBondContact N-O 3.29Å; K542-F555 PolarHBondContact O-N 3.5Å; K542-F555 VanDerWaalsContact O-O 3.05Å; K542-Y557 HydrophobicContact CG-CD1 4.43Å; K542-Y557 HydrophobicContact CG-CG 4.41Å; K542-N566 WeakPolarHBondContact CB-OD1 3.41Å; K542-N566 WeakPolarHBondContact CD-OD1 3.35Å; K542-N566 WeakPolarHBondContact CE-OD1 3.34Å; K542-N566 WeakPolarHBondContact CG-OD1 3.17Å; K542-F567 CarbonylContact C-O 3.54Å; K542-F567 WeakPolarHBondContact CA-O 3.29Å; K542-F567 WeakPolarHBondContact CD-O 3.21Å; K542-E568 VanDerWaalsContact CE-OE2 3.32Å; K542-E568 WeakPolarHBondContact CE-OE2 3.38Å; K542-E568 IonicContact NZ-OE2 2.83Å; K542-E568 PolarHBondContact NZ-OE2 3.35Å
543	Y	95.7	Very high	88.1	Confident	34 Å²	34	79.8 Å²	79.8	13%	0.133	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	144.6	178.3	-58.1	-92.7	0	0	0	110.1	K541 D553 M554 F567 E568 I570	K541-Y543 WeakPolarHBondContact CE-OH 3.32Å; K541-Y543 PolarHBondContact NZ-OH 2.97Å; Y543-D553 CarbonylContact C-O 3.54Å; Y543-D553 VanDerWaalsContact CA-O 3.28Å; Y543-D553 WeakPolarHBondContact CA-O 3.43Å; Y543-M554 HydrophobicContact CD1-CB 3.91Å; Y543-M554 HydrophobicContact CD1-CG 4.49Å; Y543-M554 HydrophobicContact CE1-CB 3.81Å; Y543-M554 HydrophobicContact CE1-CG 4.19Å; Y543-F567 PolarHBondContact N-O 2.79Å; Y543-F567 WeakPolarHBondContact O-CD2 3.09Å; Y543-F567 PolarHBondContact O-N 3.14Å; Y543-E568 WeakPolarHBondContact CE2-O 3.24Å; Y543-I570 HydrophobicContact CD1-CB 3.63Å; Y543-I570 HydrophobicContact CD1-CD1 4.27Å; Y543-I570 HydrophobicContact CD1-CG1 4Å; Y543-I570 HydrophobicContact CD2-CB 4.34Å; Y543-I570 VanDerWaalsContact CD2-N 3.27Å; Y543-I570 HydrophobicContact CE1-CB 3.64Å; Y543-I570 HydrophobicContact CE1-CD1 4.27Å; Y543-I570 HydrophobicContact CE1-CG1 4.26Å; Y543-I570 HydrophobicContact CE1-CG2 4.49Å; Y543-I570 HydrophobicContact CE2-CB 4.34Å; Y543-I570 HydrophobicContact CG-CB 3.98Å
544	F	95.4	Very high	88.3	Confident	20 Å²	20	80 Å²	80	9%	0.088	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	150.8	177.1	78.7	-75.9	0	0	0	109.5	K531 N546 C552 D553 F555 N565	K531-F544 HydrophobicContact CB-CB 4.18Å; K531-F544 HydrophobicContact CB-CD1 3.84Å; K531-F544 HydrophobicContact CB-CD2 3.61Å; K531-F544 HydrophobicContact CB-CE1 4.09Å; K531-F544 HydrophobicContact CB-CE2 3.85Å; K531-F544 HydrophobicContact CB-CG 3.59Å; K531-F544 HydrophobicContact CB-CZ 4.09Å; K531-F544 HydrophobicContact CD-CD1 4.16Å; K531-F544 HydrophobicContact CD-CE1 3.67Å; K531-F544 HydrophobicContact CD-CE2 4.29Å; K531-F544 HydrophobicContact CD-CZ 3.74Å; K531-F544 HydrophobicContact CG-CD1 4.48Å; K531-F544 HydrophobicContact CG-CD2 4.32Å; K531-F544 HydrophobicContact CG-CE1 4.23Å; K531-F544 HydrophobicContact CG-CE2 4.04Å; K531-F544 HydrophobicContact CG-CZ 4Å; F544-N546 HydrophobicContact CD2-CB 4.43Å; F544-N546 HydrophobicContact CE2-CB 3.69Å; F544-N546 HydrophobicContact CZ-CB 3.9Å; F544-N546 PolarHBondContact O-N 3.3Å; F544-C552 CarbonylContact O-C 3.55Å; F544-C552 VanDerWaalsContact O-CA 3.32Å; F544-C552 WeakPolarHBondContact O-CA 3.2Å; F544-D553 HydrophobicContact CD1-CB 4.26Å; F544-D553 VanDerWaalsContact CD1-O 3.26Å; F544-D553 WeakPolarHBondContact CD1-O 3Å; F544-D553 HydrophobicContact CE1-CB 3.62Å; F544-D553 HydrophobicContact CZ-CB 4.06Å; F544-D553 PolarHBondContact N-O 3.21Å; F544-D553 PolarHBondContact O-N 3.3Å; F544-F555 HydrophobicContact CB-CD1 3.97Å; F544-F555 HydrophobicContact CB-CE1 3.83Å; F544-F555 HydrophobicContact CD1-CB 4.08Å; F544-F555 AromaticContact CD1-CD1 3.63Å; F544-F555 HydrophobicContact CD1-CD1 3.63Å; F544-F555 HydrophobicContact CD1-CE1 4.36Å; F544-F555 HydrophobicContact CD1-CG 4.06Å; F544-F555 HydrophobicContact CE1-CB 4.28Å; F544-F555 HydrophobicContact CG-CD1 4.21Å; F544-N565 WeakPolarHBondContact CA-OD1 3.46Å; F544-N565 HydrophobicContact CB-CB 4.49Å; F544-N565 WeakPolarHBondContact CB-O 3.44Å
545	Y	94.2	Very high	88.7	Confident	39 Å²	39	78.6 Å²	78.6	15%	0.153	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	116	171.6	-179.2	-98.2	0	0	0	109.9	C527 S547 K550 N565 C573 C577 V579	C527-Y545 HydrophobicContact CB-CD1 4.19Å; C527-Y545 HydrophobicContact CB-CG 4.33Å; C527-Y545 VanDerWaalsContact O-CD1 3.25Å; C527-Y545 WeakPolarHBondContact O-CD1 3.48Å; Y545-S547 PolarHBondContact O-N 3.39Å; Y545-K550 WeakPolarHBondContact OH-CD 3.16Å; Y545-N565 PolarHBondContact N-OD1 2.91Å; Y545-N565 PolarHBondContact O-ND2 3.11Å; Y545-C573 PolarHBondContact N-SG 2.77Å; Y545-C573 VanDerWaalsContact N-SG 3.43Å; Y545-C577 WeakPolarHBondContact CB-SG 3.48Å; Y545-C577 HydrophobicContact CD2-CB 3.39Å; Y545-C577 HydrophobicContact CE2-CB 4.04Å; Y545-C577 HydrophobicContact CG-CB 3.67Å; Y545-V579 HydrophobicContact CD2-CG2 3.82Å; Y545-V579 HydrophobicContact CE2-CG2 3.76Å
546	N	89.9	Confident	89	Confident	26 Å²	26	75.1 Å²	75.1	14%	0.139	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	109.2	176.3	-178.5	-15.2	0	0	0	109.7	F544 F548 T549 K550 Q551 D553	F544-N546 HydrophobicContact CD2-CB 4.43Å; F544-N546 HydrophobicContact CE2-CB 3.69Å; F544-N546 HydrophobicContact CZ-CB 3.9Å; F544-N546 PolarHBondContact O-N 3.3Å; N546-F548 PolarHBondContact O-N 2.96Å; N546-F548 WeakPolarHBondContact OD1-CB 2.99Å; N546-F548 PolarHBondContact OD1-N 2.83Å; N546-T549 VanDerWaalsContact CB-OG1 3.3Å; N546-T549 WeakPolarHBondContact CB-OG1 3.38Å; N546-T549 VanDerWaalsContact CG-OG1 3.29Å; N546-T549 PolarHBondContact ND2-OG1 2.74Å; N546-T549 PolarHBondContact O-N 2.83Å; N546-T549 PolarHBondContact OD1-N 2.74Å; N546-K550 WeakPolarHBondContact O-CA 2.93Å; N546-K550 PolarHBondContact O-N 2.02Å; N546-Q551 WeakPolarHBondContact CB-O 3.37Å; N546-Q551 PolarHBondContact N-O 3.04Å; N546-Q551 PolarHBondContact O-N 2.88Å; N546-D553 HydrophobicContact CB-CB 4.4Å; N546-D553 WeakPolarHBondContact CB-OD2 3.3Å; N546-D553 PolarHBondContact ND2-OD2 3.34Å
547	S	85.5	Confident	89.3	Confident	62 Å²	62	74 Å²	74	43%	0.434	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-19.5	-177.1	61.4	0	0	0	0	114.2	Y545 K550	Y545-S547 PolarHBondContact O-N 3.39Å; S547-K550 WeakPolarHBondContact O-CD 3.39Å; S547-K550 WeakPolarHBondContact O-CE 3.42Å; S547-K550 PolarHBondContact O-NZ 2.83Å; S547-K550 VanDerWaalsContact O-NZ 3.07Å
548	F	75.5	Confident	89.5	Confident	190 Å²	190	66 Å²	66	83%	0.833	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-46.9	176.2	-62.8	-81.9	0	0	0	111.9	N546 K550	N546-F548 PolarHBondContact O-N 2.96Å; N546-F548 WeakPolarHBondContact OD1-CB 2.99Å; N546-F548 PolarHBondContact OD1-N 2.83Å; F548-K550 VanDerWaalsContact C-N 3.34Å
549	T	79.8	Confident	89.8	Confident	67 Å²	67	66.5 Å²	66.5	41%	0.411	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84	-14	179.8	61.3	0	0	0	0	112.6	N546 Q551 D553	N546-T549 VanDerWaalsContact CB-OG1 3.3Å; N546-T549 WeakPolarHBondContact CB-OG1 3.38Å; N546-T549 VanDerWaalsContact CG-OG1 3.29Å; N546-T549 PolarHBondContact ND2-OG1 2.74Å; N546-T549 PolarHBondContact O-N 2.83Å; N546-T549 PolarHBondContact OD1-N 2.74Å; T549-Q551 PolarHBondContact O-N 3.2Å; T549-Q551 PolarHBondContact OG1-N 3.3Å; T549-D553 PolarHBondContact OG1-OD2 3.37Å
550	K	84.7	Confident	89.6	Confident	130 Å²	130	61.4 Å²	61.4	57%	0.565	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.9	31.2	-171.3	-55.8	-64.7	-177.4	-166.8	0	112.4	Y545 N546 S547 F548	Y545-K550 WeakPolarHBondContact OH-CD 3.16Å; N546-K550 WeakPolarHBondContact O-CA 2.93Å; N546-K550 PolarHBondContact O-N 2.02Å; S547-K550 WeakPolarHBondContact O-CD 3.39Å; S547-K550 WeakPolarHBondContact O-CE 3.42Å; S547-K550 PolarHBondContact O-NZ 2.83Å; S547-K550 VanDerWaalsContact O-NZ 3.07Å; F548-K550 VanDerWaalsContact C-N 3.34Å
551	Q	87.3	Confident	89.2	Confident	105 Å²	105	58.3 Å²	58.3	49%	0.491	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	163.3	-178.1	-67.9	180	23.3	0	0	110.8	N546 T549 V579	N546-Q551 WeakPolarHBondContact CB-O 3.37Å; N546-Q551 PolarHBondContact N-O 3.04Å; N546-Q551 PolarHBondContact O-N 2.88Å; T549-Q551 PolarHBondContact O-N 3.2Å; T549-Q551 PolarHBondContact OG1-N 3.3Å; Q551-V579 HydrophobicContact CG-CG1 4.35Å
552	C	93.7	Very high	88.7	Confident	8 Å²	8	53.9 Å²	53.9	5%	0.054	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	117.5	173.7	-74.4	0	0	0	0	110.5	F544 I570 C573 E574	F544-C552 CarbonylContact O-C 3.55Å; F544-C552 VanDerWaalsContact O-CA 3.32Å; F544-C552 WeakPolarHBondContact O-CA 3.2Å; C552-I570 HydrophobicContact CB-CG1 3.97Å; C552-C573 HydrophobicContact CB-CB 3.69Å; C552-C573 WeakPolarHBondContact CB-SG 2.96Å; C552-C573 WeakPolarHBondContact SG-CB 3.29Å; C552-C573 PolarHBondContact SG-O 3.31Å; C552-C573 CovalentContact SG-SG 2.03Å; C552-C573 PolarHBondContact SG-SG 3.44Å; C552-E574 HydrophobicContact CB-CG 4.12Å; C552-E574 PolarHBondContact SG-N 3.12Å
553	D	90.9	Very high	88.3	Confident	52 Å²	52	53.1 Å²	53.1	28%	0.278	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	150.6	-178.7	-71.2	-34.9	0	0	0	110.5	Y543 F544 N546 T549	Y543-D553 CarbonylContact C-O 3.54Å; Y543-D553 VanDerWaalsContact CA-O 3.28Å; Y543-D553 WeakPolarHBondContact CA-O 3.43Å; F544-D553 HydrophobicContact CD1-CB 4.26Å; F544-D553 VanDerWaalsContact CD1-O 3.26Å; F544-D553 WeakPolarHBondContact CD1-O 3Å; F544-D553 HydrophobicContact CE1-CB 3.62Å; F544-D553 HydrophobicContact CZ-CB 4.06Å; F544-D553 PolarHBondContact N-O 3.21Å; F544-D553 PolarHBondContact O-N 3.3Å; N546-D553 HydrophobicContact CB-CB 4.4Å; N546-D553 WeakPolarHBondContact CB-OD2 3.3Å; N546-D553 PolarHBondContact ND2-OD2 3.34Å; T549-D553 PolarHBondContact OG1-OD2 3.37Å
554	M	93.1	Very high	88	Confident	102 Å²	102	56.5 Å²	56.5	50%	0.502	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	141.7	176.1	-179.4	-83.5	-61.1	0	0	110.7	K541 K542 Y543 I556	K541-M554 HydrophobicContact CD-CG 4.35Å; K541-M554 HydrophobicContact CG-CG 3.76Å; K541-M554 HydrophobicContact CG-SD 4.24Å; K542-M554 WeakPolarHBondContact O-CA 3.28Å; Y543-M554 HydrophobicContact CD1-CB 3.91Å; Y543-M554 HydrophobicContact CD1-CG 4.49Å; Y543-M554 HydrophobicContact CE1-CB 3.81Å; Y543-M554 HydrophobicContact CE1-CG 4.19Å; M554-I556 HydrophobicContact SD-CD1 4.1Å
555	F	93.5	Very high	88	Confident	6 Å²	6	55.5 Å²	55.5	3%	0.026	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	165.1	168.7	78.1	-68.1	0	0	0	111.2	K531 E532 E533 K542 F544 N566	K531-F555 HydrophobicContact CB-CD2 4.29Å; K531-F555 HydrophobicContact CB-CG 4.39Å; K531-F555 HydrophobicContact CD-CB 4Å; K531-F555 HydrophobicContact CD-CG 4.4Å; E532-F555 WeakPolarHBondContact O-CE2 3.2Å; E533-F555 HydrophobicContact CG-CD2 4.09Å; K542-F555 HydrophobicContact CB-CD1 3.99Å; K542-F555 HydrophobicContact CB-CE1 3.48Å; K542-F555 VanDerWaalsContact CB-CE1 3.48Å; K542-F555 HydrophobicContact CB-CZ 3.83Å; K542-F555 PolarHBondContact N-O 3.29Å; K542-F555 PolarHBondContact O-N 3.5Å; K542-F555 VanDerWaalsContact O-O 3.05Å; F544-F555 HydrophobicContact CB-CD1 3.97Å; F544-F555 HydrophobicContact CB-CE1 3.83Å; F544-F555 HydrophobicContact CD1-CB 4.08Å; F544-F555 AromaticContact CD1-CD1 3.63Å; F544-F555 HydrophobicContact CD1-CD1 3.63Å; F544-F555 HydrophobicContact CD1-CE1 4.36Å; F544-F555 HydrophobicContact CD1-CG 4.06Å; F544-F555 HydrophobicContact CE1-CB 4.28Å; F544-F555 HydrophobicContact CG-CD1 4.21Å; F555-N566 HydrophobicContact CZ-CB 4.12Å
556	I	90.8	Very high	88.1	Confident	65 Å²	65	55 Å²	55	33%	0.333	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	114.1	176.2	-57	-58.2	0	0	0	108.6	E533 M539 M554	E533-I556 WeakPolarHBondContact CB-O 3.36Å; E533-I556 WeakPolarHBondContact CG-O 3.47Å; M539-I556 HydrophobicContact CB-CG2 3.84Å; M539-I556 HydrophobicContact CE-CG2 4.12Å; M539-I556 HydrophobicContact CG-CG2 4.05Å; M554-I556 HydrophobicContact SD-CD1 4.1Å
557	Y	93.8	Very high	88.4	Confident	35 Å²	35	54.4 Å²	54.4	14%	0.137	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	132.6	173.1	179.5	-128.5	0	0	0	110.4	E532 F540 K542 G559 C560 G562 N566	E532-Y557 WeakPolarHBondContact O-CD2 3.41Å; F540-Y557 WeakPolarHBondContact CB-O 3.41Å; F540-Y557 WeakPolarHBondContact CD2-O 3.32Å; F540-Y557 PolarHBondContact N-O 3.27Å; F540-Y557 PolarHBondContact O-N 3.14Å; K542-Y557 HydrophobicContact CG-CD1 4.43Å; K542-Y557 HydrophobicContact CG-CG 4.41Å; Y557-G559 VanDerWaalsContact CE1-C 3.44Å; Y557-G559 VanDerWaalsContact CE1-CA 3.42Å; Y557-G559 VanDerWaalsContact CZ-C 3.47Å; Y557-G559 PolarHBondContact O-N 3.38Å; Y557-C560 WeakPolarHBondContact CE2-O 3.22Å; Y557-C560 WeakPolarHBondContact OH-CA 3.36Å; Y557-C560 PolarHBondContact OH-N 2.9Å; Y557-G562 PolarHBondContact OH-N 2.57Å; Y557-N566 VanDerWaalsContact CD1-ND2 3.35Å; Y557-N566 WeakPolarHBondContact CD1-ND2 3.45Å; Y557-N566 VanDerWaalsContact CD2-ND2 3.33Å; Y557-N566 WeakPolarHBondContact CD2-ND2 3.3Å
558	S	88	Confident	88.7	Confident	10 Å²	10	56.8 Å²	56.8	7%	0.07	31%	0.307	C	S	.	.			trans	-75.8	-8.7	-176.9	66.6	0	0	0	0	114.3	E533 G534 N535 C536 G538 C560	E533-S558 WeakPolarHBondContact O-CA 3.4Å; E533-S558 WeakPolarHBondContact O-CB 3.06Å; E533-S558 PolarHBondContact O-N 2.77Å; E533-S558 PolarHBondContact O-OG 2.83Å; G534-S558 WeakPolarHBondContact CA-OG 3.23Å; G534-S558 PolarHBondContact O-OG 3.14Å; N535-S558 PolarHBondContact N-OG 3.01Å; N535-S558 VanDerWaalsContact N-OG 3.09Å; C536-S558 WeakPolarHBondContact CB-O 3.37Å; C536-S558 PolarHBondContact N-OG 3.26Å; C536-S558 VanDerWaalsContact O-CB 3.29Å; C536-S558 WeakPolarHBondContact O-CB 3.37Å; G538-S558 WeakPolarHBondContact CA-O 3.35Å; G538-S558 PolarHBondContact N-O 2.93Å; G538-S558 VanDerWaalsContact O-CA 3.26Å; G538-S558 WeakPolarHBondContact O-CA 3.31Å; S558-C560 PolarHBondContact OG-O 3.39Å
559	G	85.5	Confident	89.6	Confident	36 Å²	36	50.5 Å²	50.5	37%	0.371	29%	0.285	S	S	.	.	S	Bend	trans	99.6	-14	178.5	0	0	0	0	0	114.9	Y557	Y557-G559 VanDerWaalsContact CE1-C 3.44Å; Y557-G559 VanDerWaalsContact CE1-CA 3.42Å; Y557-G559 VanDerWaalsContact CZ-C 3.47Å; Y557-G559 PolarHBondContact O-N 3.38Å
560	C	84.4	Confident	90.2	Very high	39 Å²	39	49.6 Å²	49.6	26%	0.264	28%	0.277	S	S	.	.	S	Bend	trans	-145.6	164.9	172.1	76.6	0	0	0	0	111.7	G534 N535 C536 Y557 S558 G562	G534-C560 WeakPolarHBondContact CA-O 3.39Å; N535-C560 PolarHBondContact OD1-SG 2.84Å; C536-C560 HydrophobicContact CB-CB 3.91Å; C536-C560 WeakPolarHBondContact CB-SG 3.42Å; C536-C560 WeakPolarHBondContact SG-CB 3.11Å; C536-C560 CovalentContact SG-SG 2.01Å; C536-C560 PolarHBondContact SG-SG 3.37Å; Y557-C560 WeakPolarHBondContact CE2-O 3.22Å; Y557-C560 WeakPolarHBondContact OH-CA 3.36Å; Y557-C560 PolarHBondContact OH-N 2.9Å; S558-C560 PolarHBondContact OG-O 3.39Å; C560-G562 VanDerWaalsContact C-N 3.32Å; C560-G562 PolarHBondContact O-N 3.22Å
561	G	82.1	Confident	90.2	Very high	47 Å²	47	48.9 Å²	48.9	49%	0.485	28%	0.276	S	S	.	.	S	Bend	trans	68.2	29.7	172.6	0	0	0	0	0	114.2
562	G	82.2	Confident	90.5	Very high	24 Å²	24	48.2 Å²	48.2	25%	0.247	27%	0.272	C	S	.	.			trans	-104.3	177.1	171	0	0	0	0	0	112.1	Y557 C560	Y557-G562 PolarHBondContact OH-N 2.57Å; C560-G562 VanDerWaalsContact C-N 3.32Å; C560-G562 PolarHBondContact O-N 3.22Å
563	N	87.7	Confident	90.6	Very high	19 Å²	19	47.8 Å²	47.8	10%	0.102	27%	0.27	C	S	.	.			trans	-113.2	-171.5	177.1	66.6	35.8	0	0	0	111.2	W522 Q529 P530 N565 N566	W522-N563 HydrophobicContact CE3-CB 4.19Å; W522-N563 HydrophobicContact CZ3-CB 3.95Å; Q529-N563 VanDerWaalsContact OE1-CG 3.25Å; Q529-N563 PolarHBondContact OE1-OD1 2.6Å; P530-N563 PolarHBondContact O-ND2 2.83Å; P530-N563 PolarHBondContact O-OD1 3.19Å; N563-N565 VanDerWaalsContact C-N 3.31Å; N563-N565 PolarHBondContact O-N 3.3Å; N563-N565 WeakPolarHBondContact OD1-CB 3.24Å; N563-N565 PolarHBondContact OD1-N 2.77Å; N563-N566 WeakPolarHBondContact O-CB 3.1Å
564	D	91.1	Very high	90.6	Very high	104 Å²	104	47 Å²	47	56%	0.556	26%	0.264	S	S	*	.	S	Bend	trans	-76.8	-12.3	-174.7	-57.3	-50.2	0	0	0	113.6	P526 Q529 N566	P526-D564 HydrophobicContact CB-CB 3.62Å; P526-D564 HydrophobicContact CG-CB 3.58Å; Q529-D564 PolarHBondContact NE2-OD2 2.88Å; D564-N566 PolarHBondContact O-N 2.85Å
565	N	94.5	Very high	90.4	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	27%	0.269	C	S	.	.			trans	-76.7	50	171.8	-156.5	3.2	0	0	0	111.5	P526 Q529 F544 Y545 N563 F567	P526-N565 WeakPolarHBondContact O-CB 3.41Å; Q529-N565 HydrophobicContact CB-CB 4.13Å; Q529-N565 PolarHBondContact O-ND2 2.8Å; F544-N565 WeakPolarHBondContact CA-OD1 3.46Å; F544-N565 HydrophobicContact CB-CB 4.49Å; F544-N565 WeakPolarHBondContact CB-O 3.44Å; Y545-N565 PolarHBondContact N-OD1 2.91Å; Y545-N565 PolarHBondContact O-ND2 3.11Å; N563-N565 VanDerWaalsContact C-N 3.31Å; N563-N565 PolarHBondContact O-N 3.3Å; N563-N565 WeakPolarHBondContact OD1-CB 3.24Å; N563-N565 PolarHBondContact OD1-N 2.77Å; N565-F567 WeakPolarHBondContact OD1-CE2 3.45Å
566	N	95.6	Very high	90.3	Very high	29 Å²	29	53.7 Å²	53.7	16%	0.155	30%	0.299	C	S	.	.			trans	-141.8	84	-168.4	-173.7	-20.8	0	0	0	109.4	K542 F555 Y557 N563 D564	K542-N566 WeakPolarHBondContact CB-OD1 3.41Å; K542-N566 WeakPolarHBondContact CD-OD1 3.35Å; K542-N566 WeakPolarHBondContact CE-OD1 3.34Å; K542-N566 WeakPolarHBondContact CG-OD1 3.17Å; F555-N566 HydrophobicContact CZ-CB 4.12Å; Y557-N566 VanDerWaalsContact CD1-ND2 3.35Å; Y557-N566 WeakPolarHBondContact CD1-ND2 3.45Å; Y557-N566 VanDerWaalsContact CD2-ND2 3.33Å; Y557-N566 WeakPolarHBondContact CD2-ND2 3.3Å; N563-N566 WeakPolarHBondContact O-CB 3.1Å; D564-N566 PolarHBondContact O-N 2.85Å
567	F	96.1	Very high	90.4	Very high	12 Å²	12	51.1 Å²	51.1	5%	0.053	29%	0.287	C	S	.	.	B	Isolated β-bridge	trans	-97.4	144.6	-175.4	-55.5	-75.4	0	0	0	111.5	P526 K542 Y543 N565 E572 C573 R576	P526-F567 HydrophobicContact CB-CZ 4.43Å; K542-F567 CarbonylContact C-O 3.54Å; K542-F567 WeakPolarHBondContact CA-O 3.29Å; K542-F567 WeakPolarHBondContact CD-O 3.21Å; Y543-F567 PolarHBondContact N-O 2.79Å; Y543-F567 WeakPolarHBondContact O-CD2 3.09Å; Y543-F567 PolarHBondContact O-N 3.14Å; N565-F567 WeakPolarHBondContact OD1-CE2 3.45Å; F567-E572 HydrophobicContact CB-CB 4.41Å; F567-E572 HydrophobicContact CB-CG 4.34Å; F567-E572 HydrophobicContact CD1-CG 3.9Å; F567-C573 HydrophobicContact CB-CB 3.83Å; F567-C573 HydrophobicContact CD2-CB 3.39Å; F567-C573 VanDerWaalsContact CD2-SG 3.56Å; F567-C573 HydrophobicContact CE2-CB 4.12Å; F567-C573 HydrophobicContact CG-CB 3.71Å; F567-R576 HydrophobicContact CE1-CB 3.82Å; F567-R576 HydrophobicContact CE1-CG 3.75Å; F567-R576 HydrophobicContact CZ-CB 4.06Å; F567-R576 HydrophobicContact CZ-CG 3.96Å
568	E	93.3	Very high	90.1	Very high	112 Å²	112	56.1 Å²	56.1	52%	0.523	32%	0.316	S	S	.	.	S	Bend	trans	-71.2	-37.8	-179.5	-175.6	63.6	-153.3	0	0	111.5	K542 Y543 E572	K542-E568 VanDerWaalsContact CE-OE2 3.32Å; K542-E568 WeakPolarHBondContact CE-OE2 3.38Å; K542-E568 IonicContact NZ-OE2 2.83Å; K542-E568 PolarHBondContact NZ-OE2 3.35Å; Y543-E568 WeakPolarHBondContact CE2-O 3.24Å; E568-E572 PolarHBondContact N-OE2 3.18Å
569	T	94.3	Very high	89.8	Confident	59 Å²	59	56.7 Å²	56.7	36%	0.362	32%	0.32	S	S	.	.	S	Bend	trans	-124.1	154.1	-177.4	65.7	0	0	0	0	111.6	E571 E572 C573	T569-E571 VanDerWaalsContact C-N 3.25Å; T569-E571 PolarHBondContact O-N 3.21Å; T569-E572 PolarHBondContact O-N 3.16Å; T569-E572 WeakPolarHBondContact OG1-CB 3.44Å; T569-E572 PolarHBondContact OG1-N 3.39Å; T569-E572 VanDerWaalsContact OG1-N 3.15Å; T569-C573 PolarHBondContact O-N 2.99Å
570	I	90.5	Very high	88.7	Confident	47 Å²	47	61.3 Å²	61.3	24%	0.241	34%	0.34	C	S	.	.	H	α-helix	trans	-66.7	-34.9	176.2	-168.2	168.1	0	0	0	110.2	Y543 C552 E572 C573 E574	Y543-I570 HydrophobicContact CD1-CB 3.63Å; Y543-I570 HydrophobicContact CD1-CD1 4.27Å; Y543-I570 HydrophobicContact CD1-CG1 4Å; Y543-I570 HydrophobicContact CD2-CB 4.34Å; Y543-I570 VanDerWaalsContact CD2-N 3.27Å; Y543-I570 HydrophobicContact CE1-CB 3.64Å; Y543-I570 HydrophobicContact CE1-CD1 4.27Å; Y543-I570 HydrophobicContact CE1-CG1 4.26Å; Y543-I570 HydrophobicContact CE1-CG2 4.49Å; Y543-I570 HydrophobicContact CE2-CB 4.34Å; Y543-I570 HydrophobicContact CG-CB 3.98Å; C552-I570 HydrophobicContact CB-CG1 3.97Å; I570-E572 VanDerWaalsContact C-N 3.35Å; I570-E572 PolarHBondContact O-N 3.35Å; I570-C573 PolarHBondContact O-N 2.78Å; I570-E574 HydrophobicContact CG1-CG 4.17Å; I570-E574 WeakPolarHBondContact O-CB 3.28Å; I570-E574 VanDerWaalsContact O-CG 3.26Å; I570-E574 WeakPolarHBondContact O-CG 3.49Å; I570-E574 PolarHBondContact O-N 2.86Å
571	E	85.8	Confident	87.2	Confident	115 Å²	115	66.2 Å²	66.2	54%	0.537	36%	0.357	S	S	.	.	H	α-helix	trans	-62.6	-40.4	177	-65.8	73.4	-160.2	0	0	111.9	T569 A575	T569-E571 VanDerWaalsContact C-N 3.25Å; T569-E571 PolarHBondContact O-N 3.21Å; E571-A575 WeakPolarHBondContact O-CB 3.38Å; E571-A575 PolarHBondContact O-N 3.12Å
572	E	93.3	Very high	85.6	Confident	91 Å²	91	73.3 Å²	73.3	43%	0.425	38%	0.375	S	S	.	.	H	α-helix	trans	-64.1	-45.7	174.6	-176.7	-173.7	-174.3	0	0	111.5	F567 E568 T569 I570 A575 R576	F567-E572 HydrophobicContact CB-CB 4.41Å; F567-E572 HydrophobicContact CB-CG 4.34Å; F567-E572 HydrophobicContact CD1-CG 3.9Å; E568-E572 PolarHBondContact N-OE2 3.18Å; T569-E572 PolarHBondContact O-N 3.16Å; T569-E572 WeakPolarHBondContact OG1-CB 3.44Å; T569-E572 PolarHBondContact OG1-N 3.39Å; T569-E572 VanDerWaalsContact OG1-N 3.15Å; I570-E572 VanDerWaalsContact C-N 3.35Å; I570-E572 PolarHBondContact O-N 3.35Å; E572-A575 PolarHBondContact O-N 3.41Å; E572-R576 VanDerWaalsContact O-CB 3.24Å; E572-R576 WeakPolarHBondContact O-CB 2.93Å; E572-R576 PolarHBondContact O-N 2.82Å
573	C	95.7	Very high	83.9	Confident	0 Å²	0	80.8 Å²	80.8	0%	0	40%	0.4	C	S	.	.	H	α-helix	trans	-60.6	-49.5	175	179.6	0	0	0	0	111.6	Y545 C552 F567 T569 I570 A575 R576 C577	Y545-C573 PolarHBondContact N-SG 2.77Å; Y545-C573 VanDerWaalsContact N-SG 3.43Å; C552-C573 HydrophobicContact CB-CB 3.69Å; C552-C573 WeakPolarHBondContact CB-SG 2.96Å; C552-C573 WeakPolarHBondContact SG-CB 3.29Å; C552-C573 PolarHBondContact SG-O 3.31Å; C552-C573 CovalentContact SG-SG 2.03Å; C552-C573 PolarHBondContact SG-SG 3.44Å; F567-C573 HydrophobicContact CB-CB 3.83Å; F567-C573 HydrophobicContact CD2-CB 3.39Å; F567-C573 VanDerWaalsContact CD2-SG 3.56Å; F567-C573 HydrophobicContact CE2-CB 4.12Å; F567-C573 HydrophobicContact CG-CB 3.71Å; T569-C573 PolarHBondContact O-N 2.99Å; I570-C573 PolarHBondContact O-N 2.78Å; C573-A575 VanDerWaalsContact C-N 3.31Å; C573-A575 PolarHBondContact O-N 2.72Å; C573-R576 PolarHBondContact O-N 3.34Å; C573-C577 VanDerWaalsContact O-CB 3.28Å; C573-C577 WeakPolarHBondContact O-CB 3.43Å; C573-C577 PolarHBondContact O-N 3.25Å
574	E	91.7	Very high	82.7	Confident	35 Å²	35	89 Å²	89	16%	0.164	43%	0.43	C	S	.	.	H	α-helix	trans	-61.9	-40.3	-178.4	-74	178.9	149.7	0	0	111.4	C552 I570 N578 V579 K581	C552-E574 HydrophobicContact CB-CG 4.12Å; C552-E574 PolarHBondContact SG-N 3.12Å; I570-E574 HydrophobicContact CG1-CG 4.17Å; I570-E574 WeakPolarHBondContact O-CB 3.28Å; I570-E574 VanDerWaalsContact O-CG 3.26Å; I570-E574 WeakPolarHBondContact O-CG 3.49Å; I570-E574 PolarHBondContact O-N 2.86Å; E574-N578 WeakPolarHBondContact O-CA 3.1Å; E574-N578 PolarHBondContact O-N 3.22Å; E574-V579 HydrophobicContact CB-CB 4.15Å; E574-V579 HydrophobicContact CB-CG2 4.47Å; E574-V579 HydrophobicContact CG-CB 4.02Å; E574-V579 HydrophobicContact CG-CG1 4.4Å; E574-V579 HydrophobicContact CG-CG2 4.29Å; E574-V579 PolarHBondContact O-N 3.39Å; E574-K581 VanDerWaalsContact OE1-CE 3.27Å; E574-K581 WeakPolarHBondContact OE1-CE 2.8Å; E574-K581 IonicContact OE1-NZ 3.39Å; E574-K581 WeakPolarHBondContact OE2-CE 3.22Å; E574-K581 IonicContact OE2-NZ 3.47Å; E574-K581 PolarHBondContact OE2-NZ 3.36Å
575	A	87.9	Confident	82.2	Confident	73 Å²	73	86.1 Å²	86.1	60%	0.603	42%	0.417	S	S	*	.	H	α-helix	trans	-70	-43.8	177.3	0	0	0	0	0	112	E571 E572 C573 C577	E571-A575 WeakPolarHBondContact O-CB 3.38Å; E571-A575 PolarHBondContact O-N 3.12Å; E572-A575 PolarHBondContact O-N 3.41Å; C573-A575 VanDerWaalsContact C-N 3.31Å; C573-A575 PolarHBondContact O-N 2.72Å; A575-C577 VanDerWaalsContact C-N 3.34Å
576	R	92.2	Very high	81.9	Confident	175 Å²	175	87.4 Å²	87.4	66%	0.66	43%	0.426	S	S	*	.	H	α-helix	trans	-71.4	-31	-178.8	-168.8	59.3	169.7	158.9	-0.7	112.6	F567 E572 C573	F567-R576 HydrophobicContact CE1-CB 3.82Å; F567-R576 HydrophobicContact CE1-CG 3.75Å; F567-R576 HydrophobicContact CZ-CB 4.06Å; F567-R576 HydrophobicContact CZ-CG 3.96Å; E572-R576 VanDerWaalsContact O-CB 3.24Å; E572-R576 WeakPolarHBondContact O-CB 2.93Å; E572-R576 PolarHBondContact O-N 2.82Å; C573-R576 PolarHBondContact O-N 3.34Å
577	C	93.1	Very high	81.5	Confident	12 Å²	12	93.7 Å²	93.7	8%	0.081	45%	0.452	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.4	11.8	-175.3	-54.6	0	0	0	0	114.5	C527 Y545 C573 A575 V579	C527-C577 HydrophobicContact CB-CB 3.79Å; C527-C577 WeakPolarHBondContact CB-SG 3.41Å; C527-C577 WeakPolarHBondContact SG-CA 2.92Å; C527-C577 WeakPolarHBondContact SG-CB 3.02Å; C527-C577 CovalentContact SG-SG 2.04Å; C527-C577 PolarHBondContact SG-SG 2.77Å; Y545-C577 WeakPolarHBondContact CB-SG 3.48Å; Y545-C577 HydrophobicContact CD2-CB 3.39Å; Y545-C577 HydrophobicContact CE2-CB 4.04Å; Y545-C577 HydrophobicContact CG-CB 3.67Å; C573-C577 VanDerWaalsContact O-CB 3.28Å; C573-C577 WeakPolarHBondContact O-CB 3.43Å; C573-C577 PolarHBondContact O-N 3.25Å; A575-C577 VanDerWaalsContact C-N 3.34Å; C577-V579 PolarHBondContact O-N 3.44Å
578	N	87.2	Confident	81.1	Confident	139 Å²	139	95.6 Å²	95.6	74%	0.743	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.4	48.2	173.2	-65.7	-28.6	0	0	0	115.1	E574	E574-N578 WeakPolarHBondContact O-CA 3.1Å; E574-N578 PolarHBondContact O-N 3.22Å
579	V	81.1	Confident	81	Confident	23 Å²	23	94.8 Å²	94.8	14%	0.139	47%	0.465	C	S	.	.			trans	-76.3	123.8	179.4	178.9	0	0	0	0	111.7	Y545 Q551 E574 C577	Y545-V579 HydrophobicContact CD2-CG2 3.82Å; Y545-V579 HydrophobicContact CE2-CG2 3.76Å; Q551-V579 HydrophobicContact CG-CG1 4.35Å; E574-V579 HydrophobicContact CB-CB 4.15Å; E574-V579 HydrophobicContact CB-CG2 4.47Å; E574-V579 HydrophobicContact CG-CB 4.02Å; E574-V579 HydrophobicContact CG-CG1 4.4Å; E574-V579 HydrophobicContact CG-CG2 4.29Å; E574-V579 PolarHBondContact O-N 3.39Å; C577-V579 PolarHBondContact O-N 3.44Å
580	V	63.1	Low	80.9	Confident	133 Å²	133	97.7 Å²	97.7	81%	0.806	47%	0.473	S	S	*	.			trans	-84.5	111.2	176.5	-175.1	0	0	0	0	110.8	K582	V580-K582 PolarHBondContact O-N 3.18Å
581	K	52.1	Low	81.1	Confident	142 Å²	142	98.5 Å²	98.5	62%	0.617	48%	0.478	S	S	*	.			trans	-67.5	107.7	-179.6	-69.9	-176.7	176.5	177.5	0	112.7	E574	E574-K581 VanDerWaalsContact OE1-CE 3.27Å; E574-K581 WeakPolarHBondContact OE1-CE 2.8Å; E574-K581 IonicContact OE1-NZ 3.39Å; E574-K581 WeakPolarHBondContact OE2-CE 3.22Å; E574-K581 IonicContact OE2-NZ 3.47Å; E574-K581 PolarHBondContact OE2-NZ 3.36Å
582	K	49	Very low	81.5	Confident	196 Å²	196	95.1 Å²	95.1	85%	0.852	47%	0.469	S	S	*	.	P	Polyproline II helix	trans	-72.8	125	163.5	-77.8	-174.6	175.6	-178.4	0	110	V580	V580-K582 PolarHBondContact O-N 3.18Å
583	K	47	Very low	81.4	Confident	180 Å²	180	91.9 Å²	91.9	78%	0.783	46%	0.461	S	S	*	.	P	Polyproline II helix	trans	-65.7	137.2	-179.6	-71.2	-179.7	178.4	176.1	0	110.5
584	R	61.4	Low	81.1	Confident	191 Å²	191	95.9 Å²	95.9	72%	0.721	49%	0.487	S	S	*	.	P	Polyproline II helix	trans	-63.5	125.4	-178	-67.3	-176.5	-178.8	-176.4	1.3	111.6	C586 K587	R584-C586 PolarHBondContact O-N 3.23Å; R584-K587 PolarHBondContact O-N 2.74Å
585	P	80.1	Confident	81.1	Confident	45 Å²	45	96.8 Å²	96.8	29%	0.292	50%	0.496	S	S	.	.	G	3₁₀ helix	trans	-48.2	-52.8	-177.7	-33.1	36.9	0	0	0	114.6	K587 Q588 D623 N624	P585-K587 PolarHBondContact O-N 2.79Å; P585-Q588 WeakPolarHBondContact O-CB 3.36Å; P585-Q588 PolarHBondContact O-N 3.47Å; P585-D623 HydrophobicContact CB-CB 3.53Å; P585-D623 HydrophobicContact CG-CB 3.61Å; P585-N624 WeakPolarHBondContact O-CB 3.36Å
586	C	89.7	Confident	81.2	Confident	27 Å²	27	103.4 Å²	103.4	18%	0.182	51%	0.511	C	S	.	.	G	3₁₀ helix	trans	-62.6	-4.9	-174.1	-52.4	0	0	0	0	115.5	R584 Y604 C636	R584-C586 PolarHBondContact O-N 3.23Å; C586-Y604 HydrophobicContact CB-CD1 4.09Å; C586-Y604 HydrophobicContact CB-CG 4.46Å; C586-Y604 WeakPolarHBondContact O-CD1 3.34Å; C586-C636 HydrophobicContact CB-CB 3.78Å; C586-C636 WeakPolarHBondContact CB-SG 3.45Å; C586-C636 WeakPolarHBondContact SG-CA 3.12Å; C586-C636 WeakPolarHBondContact SG-CB 3.23Å; C586-C636 CovalentContact SG-SG 2.05Å; C586-C636 PolarHBondContact SG-SG 2.87Å
587	K	86.5	Confident	80.9	Confident	161 Å²	161	96.6 Å²	96.6	70%	0.7	50%	0.496	S	S	*	.	G	3₁₀ helix	trans	-99	-3.9	175.2	-66.8	-169	175.7	-171	0	113.2	R584 P585	R584-K587 PolarHBondContact O-N 2.74Å; P585-K587 PolarHBondContact O-N 2.79Å
588	Q	88.3	Confident	80.9	Confident	51 Å²	51	103.4 Å²	103.4	24%	0.238	52%	0.524	C	S	.	.	S	Bend	trans	-82.8	151.4	179.5	-61.8	174.4	-57.4	0	0	110.5	P585 N622 N624	P585-Q588 WeakPolarHBondContact O-CB 3.36Å; P585-Q588 PolarHBondContact O-N 3.47Å; Q588-N622 HydrophobicContact CB-CB 4.4Å; Q588-N624 HydrophobicContact CB-CB 4.17Å; Q588-N624 PolarHBondContact O-ND2 2.76Å
589	P	90.9	Very high	81.2	Confident	96 Å²	96	101.9 Å²	101.9	62%	0.623	51%	0.51	S	S	*	.	P	Polyproline II helix	trans	-69.3	163.2	174.4	30.3	-35.4	0	0	0	111.5	D591 N622	P589-D591 PolarHBondContact O-N 2.72Å; P589-N622 PolarHBondContact O-ND2 2.81Å; P589-N622 PolarHBondContact O-OD1 2.9Å
590	K	92.7	Very high	81.9	Confident	120 Å²	120	105 Å²	105	52%	0.522	52%	0.523	S	S	.	.	P	Polyproline II helix	trans	-60.1	138.6	165.9	64	-176.3	174	-166.4	0	110.4	F603 F614	K590-F603 HydrophobicContact CB-CB 4.28Å; K590-F603 HydrophobicContact CB-CD1 3.7Å; K590-F603 HydrophobicContact CB-CD2 3.66Å; K590-F603 HydrophobicContact CB-CE1 3.92Å; K590-F603 HydrophobicContact CB-CE2 3.85Å; K590-F603 HydrophobicContact CB-CG 3.59Å; K590-F603 HydrophobicContact CB-CZ 3.99Å; K590-F603 HydrophobicContact CD-CD1 4.2Å; K590-F603 HydrophobicContact CD-CE1 3.63Å; K590-F603 HydrophobicContact CD-CE2 4.31Å; K590-F603 HydrophobicContact CD-CZ 3.7Å; K590-F603 HydrophobicContact CG-CE1 4.27Å; K590-F603 HydrophobicContact CG-CE2 4.23Å; K590-F603 HydrophobicContact CG-CZ 4.12Å; K590-F614 HydrophobicContact CB-CB 4.44Å; K590-F614 HydrophobicContact CB-CD2 4.02Å; K590-F614 HydrophobicContact CB-CE2 4.39Å; K590-F614 HydrophobicContact CB-CG 4.09Å; K590-F614 HydrophobicContact CD-CB 3.95Å; K590-F614 HydrophobicContact CD-CG 4.48Å
591	D	94.9	Very high	83.5	Confident	64 Å²	64	101.3 Å²	101.3	34%	0.342	50%	0.495	S	S	.	.			trans	-135.7	111.1	179.7	-171.8	-4.6	0	0	0	110.4	P589 G593 F614 G621 N622	P589-D591 PolarHBondContact O-N 2.72Å; D591-G593 VanDerWaalsContact C-N 3.25Å; D591-G593 PolarHBondContact O-N 2.92Å; D591-G593 PolarHBondContact OD1-N 3.45Å; D591-F614 WeakPolarHBondContact O-CE2 3.33Å; D591-G621 WeakPolarHBondContact OD2-CA 3.4Å; D591-N622 WeakPolarHBondContact CB-ND2 3.42Å
592	A	93	Very high	85.7	Confident	44 Å²	44	96.4 Å²	96.4	36%	0.364	47%	0.473	S	S	.	.			trans	-73.3	-19.2	178.8	0	0	0	0	0	112.2	F615 Y616 G617	A592-F615 WeakPolarHBondContact CB-O 3.13Å; A592-Y616 WeakPolarHBondContact O-CD2 3.25Å; A592-G617 WeakPolarHBondContact O-CA 3.48Å; A592-G617 PolarHBondContact O-N 3.29Å
593	G	92.5	Very high	87.9	Confident	23 Å²	23	87.6 Å²	87.6	24%	0.237	44%	0.435	C	S	.	.			trans	65.2	179.1	-169.6	0	0	0	0	0	113.4	D591 C619	D591-G593 VanDerWaalsContact C-N 3.25Å; D591-G593 PolarHBondContact O-N 2.92Å; D591-G593 PolarHBondContact OD1-N 3.45Å; G593-C619 WeakPolarHBondContact CA-O 3.41Å
594	P	87.9	Confident	90.2	Very high	84 Å²	84	81.1 Å²	81.1	55%	0.545	41%	0.406	S	S	.	.	S	Bend	trans	-85.8	-12.2	-173.1	34.2	-35.7	0	0	0	113.6	E620	P594-E620 VanDerWaalsContact CD-OE2 3.23Å; P594-E620 WeakPolarHBondContact CD-OE2 3Å; P594-E620 HydrophobicContact CG-CB 4.43Å; P594-E620 VanDerWaalsContact CG-CD 3.43Å; P594-E620 HydrophobicContact CG-CG 4.06Å; P594-E620 VanDerWaalsContact CG-OE2 3.32Å; P594-E620 WeakPolarHBondContact CG-OE2 3.13Å
595	C	93	Very high	91.8	Very high	54 Å²	54	73 Å²	73	37%	0.365	38%	0.377	S	S	.	.			trans	-72.7	153.2	178.5	-74.9	0	0	0	0	111.8	G617 C619	C595-G617 CarbonylContact C-O 3.56Å; C595-G617 WeakPolarHBondContact CB-O 3.26Å; C595-G617 WeakPolarHBondContact O-CA 3.24Å; C595-C619 HydrophobicContact CB-CB 3.9Å; C595-C619 WeakPolarHBondContact CB-SG 3.3Å; C595-C619 WeakPolarHBondContact SG-CB 3.45Å; C595-C619 CovalentContact SG-SG 2.01Å; C595-C619 PolarHBondContact SG-SG 3.09Å
596	K	89	Confident	92	Very high	212 Å²	212	74.7 Å²	74.7	92%	0.922	39%	0.386	S	S	*	.			trans	-98.3	11.1	-174.1	-62.3	-173.6	178.6	-174.8	0	114
597	G	86.8	Confident	91.7	Very high	32 Å²	32	81.5 Å²	81.5	33%	0.33	42%	0.415	S	S	.	.			trans	-61.6	160.1	170.9	0	0	0	0	0	111.1	Y616 G617	G597-Y616 CarbonylContact C-O 3.48Å; G597-G617 WeakPolarHBondContact CA-O 3.24Å; G597-G617 PolarHBondContact N-O 2.02Å; G597-G617 WeakPolarHBondContact O-CA 3.42Å
598	K	92.1	Very high	91.9	Very high	154 Å²	154	76.8 Å²	76.8	67%	0.67	40%	0.4	S	S	*	.			trans	-125.5	61.2	177.2	-167.5	176.2	178.7	-176.9	0	108.7	F615	K598-F615 HydrophobicContact CB-CD1 4.45Å; K598-F615 HydrophobicContact CD-CD1 4.18Å; K598-F615 HydrophobicContact CD-CE1 4.23Å; K598-F615 HydrophobicContact CD-CG 4.38Å; K598-F615 HydrophobicContact CD-CZ 4.49Å; K598-F615 VanDerWaalsContact CE-CE2 3.43Å; K598-F615 HydrophobicContact CG-CB 4.01Å; K598-F615 HydrophobicContact CG-CD1 3.29Å; K598-F615 HydrophobicContact CG-CD2 4.3Å; K598-F615 HydrophobicContact CG-CE1 3.75Å; K598-F615 HydrophobicContact CG-CG 3.6Å; K598-F615 HydrophobicContact CG-CZ 4.42Å
599	F	93.6	Very high	91.9	Very high	107 Å²	107	81.4 Å²	81.4	47%	0.469	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	120.5	179.6	-59.4	-80.1	0	0	0	108.9	R601 F615 Y616 G618	F599-R601 PolarHBondContact O-N 3.33Å; F599-F615 CarbonylContact O-C 3.53Å; F599-F615 WeakPolarHBondContact O-CA 3.19Å; F599-Y616 HydrophobicContact CB-CD1 4.43Å; F599-Y616 WeakPolarHBondContact CB-O 3.45Å; F599-Y616 WeakPolarHBondContact CD2-O 3.29Å; F599-Y616 PolarHBondContact N-O 3.18Å; F599-Y616 PolarHBondContact O-N 2.67Å; F599-G618 VanDerWaalsContact CD2-CA 3.43Å; F599-G618 VanDerWaalsContact CE2-CA 3.46Å
600	E	96.8	Very high	91.9	Very high	88 Å²	88	83.1 Å²	83.1	41%	0.411	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	123.3	171.6	174.4	160.8	-175.2	0	0	109.9	Y602 K613	E600-Y602 HydrophobicContact CG-CE2 4.47Å; E600-K613 HydrophobicContact CG-CD 3.98Å; E600-K613 HydrophobicContact CG-CG 4.11Å; E600-K613 VanDerWaalsContact OE1-CD 3.29Å; E600-K613 WeakPolarHBondContact OE1-CD 3.47Å; E600-K613 WeakPolarHBondContact OE1-CE 3.18Å; E600-K613 IonicContact OE1-NZ 2.82Å; E600-K613 PolarHBondContact OE1-NZ 3.33Å; E600-K613 VanDerWaalsContact OE2-CE 3.24Å; E600-K613 WeakPolarHBondContact OE2-CE 3.37Å; E600-K613 IonicContact OE2-NZ 3.12Å; E600-K613 PolarHBondContact OE2-NZ 3.34Å
601	R	97.3	Very high	92.1	Very high	57 Å²	57	77.9 Å²	77.9	22%	0.215	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	167.6	179	-64.5	-63.4	176.3	79.2	-1.1	109.6	F599 K613 F614 Y616 N625 F626	F599-R601 PolarHBondContact O-N 3.33Å; R601-K613 CarbonylContact O-C 3.55Å; R601-K613 VanDerWaalsContact O-CA 3.32Å; R601-K613 WeakPolarHBondContact O-CA 3.48Å; R601-F614 HydrophobicContact CB-CD1 3.92Å; R601-F614 HydrophobicContact CB-CE1 3.4Å; R601-F614 VanDerWaalsContact CB-CE1 3.4Å; R601-F614 HydrophobicContact CB-CZ 3.79Å; R601-F614 PolarHBondContact N-O 3.35Å; R601-F614 WeakPolarHBondContact O-CD1 3.14Å; R601-F614 PolarHBondContact O-N 3.43Å; R601-F614 VanDerWaalsContact O-O 3.05Å; R601-Y616 VanDerWaalsContact CG-CB 3.45Å; R601-Y616 HydrophobicContact CG-CD1 4.28Å; R601-Y616 HydrophobicContact CG-CG 4.2Å; R601-N625 WeakPolarHBondContact CB-OD1 3.5Å; R601-N625 VanDerWaalsContact CD-OD1 3.31Å; R601-N625 WeakPolarHBondContact CD-OD1 3Å; R601-N625 WeakPolarHBondContact CG-OD1 2.96Å; R601-N625 PolarHBondContact NH1-OD1 3.04Å; R601-F626 CarbonylContact C-O 3.58Å; R601-F626 VanDerWaalsContact CA-O 3.31Å; R601-F626 WeakPolarHBondContact CA-O 2.98Å; R601-F626 WeakPolarHBondContact CD-O 3.08Å
602	Y	97	Very high	92.1	Very high	38 Å²	38	77.5 Å²	77.5	15%	0.149	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	142.7	179.1	-63.1	-96.4	0	0	0	110.2	E600 E612 K613 F626 R628 E629	E600-Y602 HydrophobicContact CG-CE2 4.47Å; Y602-E612 VanDerWaalsContact CA-O 3.31Å; Y602-E612 WeakPolarHBondContact CA-O 3.44Å; Y602-K613 HydrophobicContact CD1-CB 4.36Å; Y602-K613 HydrophobicContact CE1-CB 4.13Å; Y602-F626 PolarHBondContact N-O 2.88Å; Y602-F626 WeakPolarHBondContact O-CD2 3.29Å; Y602-F626 PolarHBondContact O-N 2.97Å; Y602-R628 VanDerWaalsContact CD2-C 3.46Å; Y602-E629 HydrophobicContact CD1-CB 3.62Å; Y602-E629 HydrophobicContact CD1-CG 3.71Å; Y602-E629 HydrophobicContact CD2-CB 4.24Å; Y602-E629 HydrophobicContact CE1-CB 3.46Å; Y602-E629 VanDerWaalsContact CE1-CB 3.46Å; Y602-E629 HydrophobicContact CE1-CG 3.75Å; Y602-E629 HydrophobicContact CE2-CB 4.12Å; Y602-E629 HydrophobicContact CG-CB 3.99Å; Y602-E629 HydrophobicContact CG-CG 4.42Å
603	F	96.5	Very high	92.3	Very high	12 Å²	12	80.2 Å²	80.2	5%	0.053	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	150.7	173.2	79.5	-72	0	0	0	109.3	K590 N605 C611 E612 F614 N624 C632	K590-F603 HydrophobicContact CB-CB 4.28Å; K590-F603 HydrophobicContact CB-CD1 3.7Å; K590-F603 HydrophobicContact CB-CD2 3.66Å; K590-F603 HydrophobicContact CB-CE1 3.92Å; K590-F603 HydrophobicContact CB-CE2 3.85Å; K590-F603 HydrophobicContact CB-CG 3.59Å; K590-F603 HydrophobicContact CB-CZ 3.99Å; K590-F603 HydrophobicContact CD-CD1 4.2Å; K590-F603 HydrophobicContact CD-CE1 3.63Å; K590-F603 HydrophobicContact CD-CE2 4.31Å; K590-F603 HydrophobicContact CD-CZ 3.7Å; K590-F603 HydrophobicContact CG-CE1 4.27Å; K590-F603 HydrophobicContact CG-CE2 4.23Å; K590-F603 HydrophobicContact CG-CZ 4.12Å; F603-N605 HydrophobicContact CE2-CB 3.72Å; F603-N605 HydrophobicContact CZ-CB 3.82Å; F603-N605 PolarHBondContact O-N 2.74Å; F603-C611 WeakPolarHBondContact O-CA 3.25Å; F603-E612 HydrophobicContact CD1-CB 4.3Å; F603-E612 VanDerWaalsContact CD1-O 3.22Å; F603-E612 WeakPolarHBondContact CD1-O 3.22Å; F603-E612 HydrophobicContact CE1-CB 3.69Å; F603-E612 HydrophobicContact CZ-CB 4.24Å; F603-E612 PolarHBondContact N-O 3.25Å; F603-E612 PolarHBondContact O-N 3.12Å; F603-F614 HydrophobicContact CB-CD1 4.01Å; F603-F614 HydrophobicContact CB-CE1 3.89Å; F603-F614 HydrophobicContact CD1-CB 4.06Å; F603-F614 AromaticContact CD1-CD1 3.67Å; F603-F614 HydrophobicContact CD1-CD1 3.67Å; F603-F614 HydrophobicContact CD1-CE1 4.41Å; F603-F614 HydrophobicContact CD1-CG 4.06Å; F603-F614 HydrophobicContact CE1-CB 4.27Å; F603-F614 HydrophobicContact CG-CD1 4.24Å; F603-N624 HydrophobicContact CB-CB 4.48Å; F603-N624 WeakPolarHBondContact CB-O 3.16Å; F603-C632 VanDerWaalsContact C-SG 3.56Å
604	Y	94.9	Very high	92.5	Very high	43 Å²	43	79.8 Å²	79.8	17%	0.169	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	112.5	172.6	-176.4	-108.8	0	0	0	110.1	C586 V606 N624 C632 C636 I637	C586-Y604 HydrophobicContact CB-CD1 4.09Å; C586-Y604 HydrophobicContact CB-CG 4.46Å; C586-Y604 WeakPolarHBondContact O-CD1 3.34Å; Y604-V606 HydrophobicContact CD1-CG1 3.95Å; Y604-V606 HydrophobicContact CE1-CG1 3.96Å; Y604-V606 PolarHBondContact O-N 3.39Å; Y604-N624 PolarHBondContact N-ND2 2.77Å; Y604-N624 PolarHBondContact N-OD1 3.48Å; Y604-N624 PolarHBondContact O-ND2 2.59Å; Y604-C632 PolarHBondContact N-SG 3.18Å; Y604-C636 VanDerWaalsContact CB-CB 3.45Å; Y604-C636 VanDerWaalsContact CB-SG 3.59Å; Y604-C636 HydrophobicContact CD1-CB 4.12Å; Y604-C636 HydrophobicContact CD2-CB 3.57Å; Y604-C636 HydrophobicContact CE2-CB 4.34Å; Y604-C636 HydrophobicContact CG-CB 3.43Å; Y604-C636 VanDerWaalsContact CG-CB 3.43Å; Y604-I637 HydrophobicContact CD2-CG1 3.9Å; Y604-I637 HydrophobicContact CE2-CD1 4.36Å; Y604-I637 HydrophobicContact CE2-CG1 3.68Å
605	N	93.5	Very high	92.9	Very high	22 Å²	22	80.3 Å²	80.3	12%	0.118	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	111.3	172.8	-175.2	-22.4	0	0	0	108.9	F603 E607 T608 K609 K610 E612	F603-N605 HydrophobicContact CE2-CB 3.72Å; F603-N605 HydrophobicContact CZ-CB 3.82Å; F603-N605 PolarHBondContact O-N 2.74Å; N605-E607 PolarHBondContact O-N 3.37Å; N605-E607 WeakPolarHBondContact OD1-CB 3.3Å; N605-E607 PolarHBondContact OD1-N 3.23Å; N605-T608 WeakPolarHBondContact CB-OG1 3.3Å; N605-T608 PolarHBondContact OD1-N 3.25Å; N605-K609 WeakPolarHBondContact O-CA 3.37Å; N605-K609 PolarHBondContact O-N 3.2Å; N605-K610 PolarHBondContact N-O 3.2Å; N605-K610 PolarHBondContact O-N 3.01Å; N605-E612 HydrophobicContact CB-CG 4.22Å; N605-E612 PolarHBondContact ND2-OE1 3.1Å; N605-E612 PolarHBondContact ND2-OE2 3.46Å
606	V	85.1	Confident	93.1	Very high	80 Å²	80	78.9 Å²	78.9	49%	0.485	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-25.4	-179.1	-65	0	0	0	0	113.3	Y604	Y604-V606 HydrophobicContact CD1-CG1 3.95Å; Y604-V606 HydrophobicContact CE1-CG1 3.96Å; Y604-V606 PolarHBondContact O-N 3.39Å
607	E	84.1	Confident	93.2	Very high	170 Å²	170	69 Å²	69	79%	0.794	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-49.7	179.9	-60.7	-179.5	168.2	0	0	110.6	N605 K609	N605-E607 PolarHBondContact O-N 3.37Å; N605-E607 WeakPolarHBondContact OD1-CB 3.3Å; N605-E607 PolarHBondContact OD1-N 3.23Å; E607-K609 VanDerWaalsContact C-N 3.33Å
608	T	90.8	Very high	93.3	Very high	62 Å²	62	69.1 Å²	69.1	38%	0.38	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-13.4	179.8	66.2	0	0	0	0	112.8	N605 K610 E612	N605-T608 WeakPolarHBondContact CB-OG1 3.3Å; N605-T608 PolarHBondContact OD1-N 3.25Å; T608-K610 PolarHBondContact O-N 2.7Å; T608-K610 PolarHBondContact OG1-N 2.81Å; T608-E612 VanDerWaalsContact CB-OE1 3.23Å; T608-E612 WeakPolarHBondContact CB-OE1 3.43Å; T608-E612 WeakPolarHBondContact CG2-OE1 3.48Å; T608-E612 PolarHBondContact OG1-OE1 3.12Å
609	K	87.2	Confident	93.2	Very high	147 Å²	147	63.5 Å²	63.5	64%	0.639	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.8	28.4	-173.1	-58.1	178.2	-179.5	172.7	0	112.9	N605 E607	N605-K609 WeakPolarHBondContact O-CA 3.37Å; N605-K609 PolarHBondContact O-N 3.2Å; E607-K609 VanDerWaalsContact C-N 3.33Å
610	K	91.8	Very high	92.7	Very high	133 Å²	133	65.2 Å²	65.2	58%	0.578	32%	0.316	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.9	156.2	-179.7	-68.2	177.9	-176.5	-179	0	110.6	N605 T608 E612	N605-K610 PolarHBondContact N-O 3.2Å; N605-K610 PolarHBondContact O-N 3.01Å; T608-K610 PolarHBondContact O-N 2.7Å; T608-K610 PolarHBondContact OG1-N 2.81Å; K610-E612 HydrophobicContact CB-CG 4.41Å
611	C	95.6	Very high	92	Very high	10 Å²	10	62.6 Å²	62.6	7%	0.068	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	119.2	164.8	-75.1	0	0	0	0	107.7	F603 E629 C632 V633 I637	F603-C611 WeakPolarHBondContact O-CA 3.25Å; C611-E629 HydrophobicContact CB-CG 4.23Å; C611-C632 HydrophobicContact CB-CB 3.68Å; C611-C632 WeakPolarHBondContact CB-SG 2.95Å; C611-C632 WeakPolarHBondContact SG-CB 3.07Å; C611-C632 PolarHBondContact SG-O 3.41Å; C611-C632 CovalentContact SG-SG 2.03Å; C611-C632 PolarHBondContact SG-SG 3.47Å; C611-V633 HydrophobicContact CB-CG2 3.99Å; C611-V633 PolarHBondContact SG-N 2.76Å; C611-I637 HydrophobicContact CB-CD1 4.47Å
612	E	96.5	Very high	91.6	Very high	56 Å²	56	61.3 Å²	61.3	26%	0.262	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	143.5	-175.4	-72.3	176.8	-173.1	0	0	110	Y602 F603 N605 T608 K610	Y602-E612 VanDerWaalsContact CA-O 3.31Å; Y602-E612 WeakPolarHBondContact CA-O 3.44Å; F603-E612 HydrophobicContact CD1-CB 4.3Å; F603-E612 VanDerWaalsContact CD1-O 3.22Å; F603-E612 WeakPolarHBondContact CD1-O 3.22Å; F603-E612 HydrophobicContact CE1-CB 3.69Å; F603-E612 HydrophobicContact CZ-CB 4.24Å; F603-E612 PolarHBondContact N-O 3.25Å; F603-E612 PolarHBondContact O-N 3.12Å; N605-E612 HydrophobicContact CB-CG 4.22Å; N605-E612 PolarHBondContact ND2-OE1 3.1Å; N605-E612 PolarHBondContact ND2-OE2 3.46Å; T608-E612 VanDerWaalsContact CB-OE1 3.23Å; T608-E612 WeakPolarHBondContact CB-OE1 3.43Å; T608-E612 WeakPolarHBondContact CG2-OE1 3.48Å; T608-E612 PolarHBondContact OG1-OE1 3.12Å; K610-E612 HydrophobicContact CB-CG 4.41Å
613	K	97	Very high	91.3	Very high	101 Å²	101	64.5 Å²	64.5	44%	0.439	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	137.8	173.4	177.1	176	173.1	161.8	0	110.6	E600 R601 Y602	E600-K613 HydrophobicContact CG-CD 3.98Å; E600-K613 HydrophobicContact CG-CG 4.11Å; E600-K613 VanDerWaalsContact OE1-CD 3.29Å; E600-K613 WeakPolarHBondContact OE1-CD 3.47Å; E600-K613 WeakPolarHBondContact OE1-CE 3.18Å; E600-K613 IonicContact OE1-NZ 2.82Å; E600-K613 PolarHBondContact OE1-NZ 3.33Å; E600-K613 VanDerWaalsContact OE2-CE 3.24Å; E600-K613 WeakPolarHBondContact OE2-CE 3.37Å; E600-K613 IonicContact OE2-NZ 3.12Å; E600-K613 PolarHBondContact OE2-NZ 3.34Å; R601-K613 CarbonylContact O-C 3.55Å; R601-K613 VanDerWaalsContact O-CA 3.32Å; R601-K613 WeakPolarHBondContact O-CA 3.48Å; Y602-K613 HydrophobicContact CD1-CB 4.36Å; Y602-K613 HydrophobicContact CE1-CB 4.13Å
614	F	97	Very high	91.2	Very high	13 Å²	13	64 Å²	64	6%	0.057	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	166.4	165.7	79.5	-70.2	0	0	0	110.2	K590 D591 R601 F603 N625	K590-F614 HydrophobicContact CB-CB 4.44Å; K590-F614 HydrophobicContact CB-CD2 4.02Å; K590-F614 HydrophobicContact CB-CE2 4.39Å; K590-F614 HydrophobicContact CB-CG 4.09Å; K590-F614 HydrophobicContact CD-CB 3.95Å; K590-F614 HydrophobicContact CD-CG 4.48Å; D591-F614 WeakPolarHBondContact O-CE2 3.33Å; R601-F614 HydrophobicContact CB-CD1 3.92Å; R601-F614 HydrophobicContact CB-CE1 3.4Å; R601-F614 VanDerWaalsContact CB-CE1 3.4Å; R601-F614 HydrophobicContact CB-CZ 3.79Å; R601-F614 PolarHBondContact N-O 3.35Å; R601-F614 WeakPolarHBondContact O-CD1 3.14Å; R601-F614 PolarHBondContact O-N 3.43Å; R601-F614 VanDerWaalsContact O-O 3.05Å; F603-F614 HydrophobicContact CB-CD1 4.01Å; F603-F614 HydrophobicContact CB-CE1 3.89Å; F603-F614 HydrophobicContact CD1-CB 4.06Å; F603-F614 AromaticContact CD1-CD1 3.67Å; F603-F614 HydrophobicContact CD1-CD1 3.67Å; F603-F614 HydrophobicContact CD1-CE1 4.41Å; F603-F614 HydrophobicContact CD1-CG 4.06Å; F603-F614 HydrophobicContact CE1-CB 4.27Å; F603-F614 HydrophobicContact CG-CD1 4.24Å; F614-N625 HydrophobicContact CZ-CB 4.09Å
615	F	96.3	Very high	91.2	Very high	95 Å²	95	63.4 Å²	63.4	42%	0.417	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	115.2	175.3	-68	-66.3	0	0	0	109.9	A592 K598 F599	A592-F615 WeakPolarHBondContact CB-O 3.13Å; K598-F615 HydrophobicContact CB-CD1 4.45Å; K598-F615 HydrophobicContact CD-CD1 4.18Å; K598-F615 HydrophobicContact CD-CE1 4.23Å; K598-F615 HydrophobicContact CD-CG 4.38Å; K598-F615 HydrophobicContact CD-CZ 4.49Å; K598-F615 VanDerWaalsContact CE-CE2 3.43Å; K598-F615 HydrophobicContact CG-CB 4.01Å; K598-F615 HydrophobicContact CG-CD1 3.29Å; K598-F615 HydrophobicContact CG-CD2 4.3Å; K598-F615 HydrophobicContact CG-CE1 3.75Å; K598-F615 HydrophobicContact CG-CG 3.6Å; K598-F615 HydrophobicContact CG-CZ 4.42Å; F599-F615 CarbonylContact O-C 3.53Å; F599-F615 WeakPolarHBondContact O-CA 3.19Å
616	Y	96.5	Very high	91.3	Very high	25 Å²	25	63 Å²	63	10%	0.098	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	137.3	173.2	175.8	-122.7	0	0	0	110.6	A592 G597 F599 R601 G618 C619 E620 N625	A592-Y616 WeakPolarHBondContact O-CD2 3.25Å; G597-Y616 CarbonylContact C-O 3.48Å; F599-Y616 HydrophobicContact CB-CD1 4.43Å; F599-Y616 WeakPolarHBondContact CB-O 3.45Å; F599-Y616 WeakPolarHBondContact CD2-O 3.29Å; F599-Y616 PolarHBondContact N-O 3.18Å; F599-Y616 PolarHBondContact O-N 2.67Å; R601-Y616 VanDerWaalsContact CG-CB 3.45Å; R601-Y616 HydrophobicContact CG-CD1 4.28Å; R601-Y616 HydrophobicContact CG-CG 4.2Å; Y616-G618 VanDerWaalsContact CD1-N 3.35Å; Y616-G618 VanDerWaalsContact CE1-C 3.45Å; Y616-G618 PolarHBondContact O-N 3.49Å; Y616-C619 WeakPolarHBondContact CE2-O 3.34Å; Y616-C619 WeakPolarHBondContact OH-CA 3.06Å; Y616-C619 PolarHBondContact OH-N 2.03Å; Y616-C619 PolarHBondContact OH-O 2.98Å; Y616-E620 WeakPolarHBondContact CE2-O 3.33Å; Y616-E620 PolarHBondContact OH-N 2.68Å; Y616-E620 PolarHBondContact OH-O 3.13Å; Y616-N625 WeakPolarHBondContact CD2-ND2 3.43Å; Y616-N625 WeakPolarHBondContact CE2-ND2 3.32Å
617	G	91.6	Very high	91.7	Very high	3 Å²	3	65.9 Å²	65.9	3%	0.031	33%	0.333	C	S	.	.			trans	-68.4	-17.6	-178.9	0	0	0	0	0	114.4	A592 C595 G597	A592-G617 WeakPolarHBondContact O-CA 3.48Å; A592-G617 PolarHBondContact O-N 3.29Å; C595-G617 CarbonylContact C-O 3.56Å; C595-G617 WeakPolarHBondContact CB-O 3.26Å; C595-G617 WeakPolarHBondContact O-CA 3.24Å; G597-G617 WeakPolarHBondContact CA-O 3.24Å; G597-G617 PolarHBondContact N-O 2.02Å; G597-G617 WeakPolarHBondContact O-CA 3.42Å
618	G	87.6	Confident	92.1	Very high	36 Å²	36	65 Å²	65	37%	0.371	32%	0.322	S	S	.	.	S	Bend	trans	96.5	-3.3	-178.9	0	0	0	0	0	114.7	F599 Y616	F599-G618 VanDerWaalsContact CD2-CA 3.43Å; F599-G618 VanDerWaalsContact CE2-CA 3.46Å; Y616-G618 VanDerWaalsContact CD1-N 3.35Å; Y616-G618 VanDerWaalsContact CE1-C 3.45Å; Y616-G618 PolarHBondContact O-N 3.49Å
619	C	89.9	Confident	92.3	Very high	35 Å²	35	66.6 Å²	66.6	24%	0.236	33%	0.325	C	S	.	.	S	Bend	trans	-149	158.6	171.4	75.7	0	0	0	0	111.6	G593 C595 Y616	G593-C619 WeakPolarHBondContact CA-O 3.41Å; C595-C619 HydrophobicContact CB-CB 3.9Å; C595-C619 WeakPolarHBondContact CB-SG 3.3Å; C595-C619 WeakPolarHBondContact SG-CB 3.45Å; C595-C619 CovalentContact SG-SG 2.01Å; C595-C619 PolarHBondContact SG-SG 3.09Å; Y616-C619 WeakPolarHBondContact CE2-O 3.34Å; Y616-C619 WeakPolarHBondContact OH-CA 3.06Å; Y616-C619 PolarHBondContact OH-N 2.03Å; Y616-C619 PolarHBondContact OH-O 2.98Å
620	E	83.3	Confident	92.4	Very high	144 Å²	144	66.3 Å²	66.3	67%	0.673	33%	0.326	S	S	*	.			trans	55.1	-152.4	-173.9	-53.2	-176.4	-175	0	0	111.9	P594 Y616	P594-E620 VanDerWaalsContact CD-OE2 3.23Å; P594-E620 WeakPolarHBondContact CD-OE2 3Å; P594-E620 HydrophobicContact CG-CB 4.43Å; P594-E620 VanDerWaalsContact CG-CD 3.43Å; P594-E620 HydrophobicContact CG-CG 4.06Å; P594-E620 VanDerWaalsContact CG-OE2 3.32Å; P594-E620 WeakPolarHBondContact CG-OE2 3.13Å; Y616-E620 WeakPolarHBondContact CE2-O 3.33Å; Y616-E620 PolarHBondContact OH-N 2.68Å; Y616-E620 PolarHBondContact OH-O 3.13Å
621	G	82.9	Confident	92.2	Very high	33 Å²	33	63 Å²	63	34%	0.34	32%	0.315	S	S	.	.			trans	95.8	178.9	-173	0	0	0	0	0	113.6	D591	D591-G621 WeakPolarHBondContact OD2-CA 3.4Å
622	N	88.6	Confident	92.1	Very high	29 Å²	29	62.6 Å²	62.6	16%	0.155	31%	0.312	C	S	.	.			trans	-116.4	176.9	179.4	66.4	53.4	0	0	0	112	Q588 P589 D591 N624 N625	Q588-N622 HydrophobicContact CB-CB 4.4Å; P589-N622 PolarHBondContact O-ND2 2.81Å; P589-N622 PolarHBondContact O-OD1 2.9Å; D591-N622 WeakPolarHBondContact CB-ND2 3.42Å; N622-N624 PolarHBondContact O-N 2.85Å; N622-N624 WeakPolarHBondContact OD1-CB 3.24Å; N622-N624 PolarHBondContact OD1-N 3.35Å; N622-N625 WeakPolarHBondContact O-CB 3.46Å
623	D	90.4	Very high	91.8	Very high	106 Å²	106	62.1 Å²	62.1	57%	0.567	31%	0.313	S	S	*	.	S	Bend	trans	-71.2	-9.5	-172.7	-59.5	-41.4	0	0	0	113.4	P585 N625	P585-D623 HydrophobicContact CB-CB 3.53Å; P585-D623 HydrophobicContact CG-CB 3.61Å; D623-N625 PolarHBondContact O-N 3.42Å
624	N	94.7	Very high	91.2	Very high	0 Å²	0	65.7 Å²	65.7	0%	0	33%	0.328	C	S	.	.			trans	-81.9	52.2	171.9	-158.4	11.6	0	0	0	111.1	P585 Q588 F603 Y604 N622 F626	P585-N624 WeakPolarHBondContact O-CB 3.36Å; Q588-N624 HydrophobicContact CB-CB 4.17Å; Q588-N624 PolarHBondContact O-ND2 2.76Å; F603-N624 HydrophobicContact CB-CB 4.48Å; F603-N624 WeakPolarHBondContact CB-O 3.16Å; Y604-N624 PolarHBondContact N-ND2 2.77Å; Y604-N624 PolarHBondContact N-OD1 3.48Å; Y604-N624 PolarHBondContact O-ND2 2.59Å; N622-N624 PolarHBondContact O-N 2.85Å; N622-N624 WeakPolarHBondContact OD1-CB 3.24Å; N622-N624 PolarHBondContact OD1-N 3.35Å; N624-F626 WeakPolarHBondContact OD1-CE2 2.83Å
625	N	95.3	Very high	90.7	Very high	32 Å²	32	70.6 Å²	70.6	17%	0.171	35%	0.352	C	S	.	.			trans	-140	99.9	-174.6	-177.4	-20.3	0	0	0	109.7	R601 F614 Y616 N622 D623	R601-N625 WeakPolarHBondContact CB-OD1 3.5Å; R601-N625 VanDerWaalsContact CD-OD1 3.31Å; R601-N625 WeakPolarHBondContact CD-OD1 3Å; R601-N625 WeakPolarHBondContact CG-OD1 2.96Å; R601-N625 PolarHBondContact NH1-OD1 3.04Å; F614-N625 HydrophobicContact CZ-CB 4.09Å; Y616-N625 WeakPolarHBondContact CD2-ND2 3.43Å; Y616-N625 WeakPolarHBondContact CE2-ND2 3.32Å; N622-N625 WeakPolarHBondContact O-CB 3.46Å; D623-N625 PolarHBondContact O-N 3.42Å
626	F	95.3	Very high	90.3	Very high	14 Å²	14	66.9 Å²	66.9	6%	0.061	34%	0.337	C	S	.	.	B	Isolated β-bridge	trans	-110.3	138	-176.2	-55.8	-78.6	0	0	0	110.8	R601 Y602 N624 D631 C632 Q635	R601-F626 CarbonylContact C-O 3.58Å; R601-F626 VanDerWaalsContact CA-O 3.31Å; R601-F626 WeakPolarHBondContact CA-O 2.98Å; R601-F626 WeakPolarHBondContact CD-O 3.08Å; Y602-F626 PolarHBondContact N-O 2.88Å; Y602-F626 WeakPolarHBondContact O-CD2 3.29Å; Y602-F626 PolarHBondContact O-N 2.97Å; N624-F626 WeakPolarHBondContact OD1-CE2 2.83Å; F626-D631 HydrophobicContact CB-CB 4.34Å; F626-D631 HydrophobicContact CD1-CB 4.28Å; F626-C632 HydrophobicContact CB-CB 3.89Å; F626-C632 HydrophobicContact CD2-CB 3.34Å; F626-C632 HydrophobicContact CE2-CB 4.01Å; F626-C632 HydrophobicContact CG-CB 3.68Å; F626-Q635 HydrophobicContact CE1-CB 4.15Å; F626-Q635 VanDerWaalsContact CE1-CD 3.48Å; F626-Q635 HydrophobicContact CE1-CG 4.27Å; F626-Q635 HydrophobicContact CZ-CB 4.22Å
627	E	92.8	Very high	89.7	Confident	140 Å²	140	68.2 Å²	68.2	65%	0.654	35%	0.346	S	S	*	.	S	Bend	trans	-68.4	-35.9	177.8	-171	176.2	177.7	0	0	112.2
628	R	94	Very high	88.6	Confident	152 Å²	152	76.7 Å²	76.7	57%	0.574	38%	0.382	S	S	*	.	S	Bend	trans	-121.3	147.9	179.6	-56	179.3	179.6	179.1	1	111.3	Y602 E630 D631 C632	Y602-R628 VanDerWaalsContact CD2-C 3.46Å; R628-E630 VanDerWaalsContact C-N 3.25Å; R628-E630 PolarHBondContact O-N 3.29Å; R628-D631 WeakPolarHBondContact CB-OD2 3.32Å; R628-D631 PolarHBondContact O-N 2.01Å; R628-C632 PolarHBondContact O-N 2.92Å
629	E	93.8	Very high	86.9	Confident	95 Å²	95	84.1 Å²	84.1	44%	0.444	40%	0.404	S	S	.	.	H	α-helix	trans	-58.4	-41.5	175.3	-166.5	175.1	166.6	0	0	111.3	Y602 C611 D631 C632 V633	Y602-E629 HydrophobicContact CD1-CB 3.62Å; Y602-E629 HydrophobicContact CD1-CG 3.71Å; Y602-E629 HydrophobicContact CD2-CB 4.24Å; Y602-E629 HydrophobicContact CE1-CB 3.46Å; Y602-E629 VanDerWaalsContact CE1-CB 3.46Å; Y602-E629 HydrophobicContact CE1-CG 3.75Å; Y602-E629 HydrophobicContact CE2-CB 4.12Å; Y602-E629 HydrophobicContact CG-CB 3.99Å; Y602-E629 HydrophobicContact CG-CG 4.42Å; C611-E629 HydrophobicContact CB-CG 4.23Å; E629-D631 VanDerWaalsContact C-N 3.27Å; E629-D631 PolarHBondContact O-N 2.79Å; E629-C632 WeakPolarHBondContact O-CB 3.36Å; E629-C632 PolarHBondContact O-N 3.31Å; E629-C632 VanDerWaalsContact O-N 3.13Å; E629-V633 HydrophobicContact CG-CG2 4.09Å; E629-V633 VanDerWaalsContact O-CG2 3.27Å; E629-V633 WeakPolarHBondContact O-CG2 3.31Å; E629-V633 PolarHBondContact O-N 3.48Å
630	E	88.8	Confident	85	Confident	141 Å²	141	92.6 Å²	92.6	66%	0.659	43%	0.43	S	S	*	.	H	α-helix	trans	-56.9	-39.5	180	-66.3	165.3	-179.4	0	0	112.3	R628 V633 K634	R628-E630 VanDerWaalsContact C-N 3.25Å; R628-E630 PolarHBondContact O-N 3.29Å; E630-V633 PolarHBondContact O-N 3.25Å; E630-K634 WeakPolarHBondContact O-CB 3.02Å; E630-K634 PolarHBondContact O-N 3Å
631	D	89.1	Confident	84.3	Confident	64 Å²	64	92.4 Å²	92.4	34%	0.342	43%	0.43	S	S	.	.	H	α-helix	trans	-68.5	-42.8	178.2	-65	-40.3	0	0	0	111.1	F626 R628 E629 Q635	F626-D631 HydrophobicContact CB-CB 4.34Å; F626-D631 HydrophobicContact CD1-CB 4.28Å; R628-D631 WeakPolarHBondContact CB-OD2 3.32Å; R628-D631 PolarHBondContact O-N 2.01Å; E629-D631 VanDerWaalsContact C-N 3.27Å; E629-D631 PolarHBondContact O-N 2.79Å; D631-Q635 WeakPolarHBondContact O-CB 3.29Å; D631-Q635 WeakPolarHBondContact O-CG 3.21Å; D631-Q635 PolarHBondContact O-N 2.79Å
632	C	93.9	Very high	84.2	Confident	0 Å²	0	92.7 Å²	92.7	0%	0	42%	0.423	C	S	.	.	H	α-helix	trans	-61.1	-48.8	173.1	179	0	0	0	0	111.2	F603 Y604 C611 F626 R628 E629 K634 Q635 C636	F603-C632 VanDerWaalsContact C-SG 3.56Å; Y604-C632 PolarHBondContact N-SG 3.18Å; C611-C632 HydrophobicContact CB-CB 3.68Å; C611-C632 WeakPolarHBondContact CB-SG 2.95Å; C611-C632 WeakPolarHBondContact SG-CB 3.07Å; C611-C632 PolarHBondContact SG-O 3.41Å; C611-C632 CovalentContact SG-SG 2.03Å; C611-C632 PolarHBondContact SG-SG 3.47Å; F626-C632 HydrophobicContact CB-CB 3.89Å; F626-C632 HydrophobicContact CD2-CB 3.34Å; F626-C632 HydrophobicContact CE2-CB 4.01Å; F626-C632 HydrophobicContact CG-CB 3.68Å; R628-C632 PolarHBondContact O-N 2.92Å; E629-C632 WeakPolarHBondContact O-CB 3.36Å; E629-C632 PolarHBondContact O-N 3.31Å; E629-C632 VanDerWaalsContact O-N 3.13Å; C632-K634 VanDerWaalsContact C-N 3.34Å; C632-K634 PolarHBondContact O-N 3.03Å; C632-Q635 PolarHBondContact O-N 3.18Å; C632-C636 VanDerWaalsContact O-CB 3.29Å; C632-C636 WeakPolarHBondContact O-CB 3.44Å; C632-C636 PolarHBondContact O-N 3.23Å
633	V	90.1	Very high	84	Confident	46 Å²	46	91.8 Å²	91.8	28%	0.279	42%	0.419	S	S	.	.	H	α-helix	trans	-61.2	-46.4	-178.9	171.3	0	0	0	0	109.5	C611 E629 E630 Q635 I637	C611-V633 HydrophobicContact CB-CG2 3.99Å; C611-V633 PolarHBondContact SG-N 2.76Å; E629-V633 HydrophobicContact CG-CG2 4.09Å; E629-V633 VanDerWaalsContact O-CG2 3.27Å; E629-V633 WeakPolarHBondContact O-CG2 3.31Å; E629-V633 PolarHBondContact O-N 3.48Å; E630-V633 PolarHBondContact O-N 3.25Å; V633-Q635 PolarHBondContact O-N 3.15Å; V633-I637 HydrophobicContact CG1-CB 4.09Å; V633-I637 HydrophobicContact CG1-CD1 4.48Å; V633-I637 HydrophobicContact CG2-CD1 4.08Å; V633-I637 CarbonylContact O-C 3.3Å; V633-I637 VanDerWaalsContact O-CA 3.27Å; V633-I637 WeakPolarHBondContact O-CA 3.35Å; V633-I637 WeakPolarHBondContact O-CB 3.28Å; V633-I637 PolarHBondContact O-N 2.95Å; V633-I637 VanDerWaalsContact O-O 3.04Å
634	K	83.7	Confident	84.1	Confident	176 Å²	176	87.1 Å²	87.1	77%	0.765	40%	0.395	S	S	*	.	H	α-helix	trans	-61.4	-42.8	178.6	-176.2	180	179	-177.3	0	112.3	E630 C632	E630-K634 WeakPolarHBondContact O-CB 3.02Å; E630-K634 PolarHBondContact O-N 3Å; C632-K634 VanDerWaalsContact C-N 3.34Å; C632-K634 PolarHBondContact O-N 3.03Å
635	Q	85.6	Confident	83.9	Confident	117 Å²	117	93.8 Å²	93.8	55%	0.547	42%	0.424	S	S	.	.	H	α-helix	trans	-80.4	-35.1	-177.2	-69.5	-169	44.2	0	0	113.4	F626 D631 C632 V633	F626-Q635 HydrophobicContact CE1-CB 4.15Å; F626-Q635 VanDerWaalsContact CE1-CD 3.48Å; F626-Q635 HydrophobicContact CE1-CG 4.27Å; F626-Q635 HydrophobicContact CZ-CB 4.22Å; D631-Q635 WeakPolarHBondContact O-CB 3.29Å; D631-Q635 WeakPolarHBondContact O-CG 3.21Å; D631-Q635 PolarHBondContact O-N 2.79Å; C632-Q635 PolarHBondContact O-N 3.18Å; V633-Q635 PolarHBondContact O-N 3.15Å
636	C	88.6	Confident	83.7	Confident	17 Å²	17	93.8 Å²	93.8	12%	0.115	42%	0.424	C	S	.	.	H	α-helix	trans	-113.2	-28.6	-169.3	-58	0	0	0	0	114.7	C586 Y604 C632	C586-C636 HydrophobicContact CB-CB 3.78Å; C586-C636 WeakPolarHBondContact CB-SG 3.45Å; C586-C636 WeakPolarHBondContact SG-CA 3.12Å; C586-C636 WeakPolarHBondContact SG-CB 3.23Å; C586-C636 CovalentContact SG-SG 2.05Å; C586-C636 PolarHBondContact SG-SG 2.87Å; Y604-C636 VanDerWaalsContact CB-CB 3.45Å; Y604-C636 VanDerWaalsContact CB-SG 3.59Å; Y604-C636 HydrophobicContact CD1-CB 4.12Å; Y604-C636 HydrophobicContact CD2-CB 3.57Å; Y604-C636 HydrophobicContact CE2-CB 4.34Å; Y604-C636 HydrophobicContact CG-CB 3.43Å; Y604-C636 VanDerWaalsContact CG-CB 3.43Å; C632-C636 VanDerWaalsContact O-CB 3.29Å; C632-C636 WeakPolarHBondContact O-CB 3.44Å; C632-C636 PolarHBondContact O-N 3.23Å
637	I	84	Confident	83.5	Confident	53 Å²	53	97.7 Å²	97.7	27%	0.272	45%	0.45	S	S	.	.			trans	-102.5	87.5	177.9	-52.3	-174.2	0	0	0	109.8	Y604 C611 V633 K639	Y604-I637 HydrophobicContact CD2-CG1 3.9Å; Y604-I637 HydrophobicContact CE2-CD1 4.36Å; Y604-I637 HydrophobicContact CE2-CG1 3.68Å; C611-I637 HydrophobicContact CB-CD1 4.47Å; V633-I637 HydrophobicContact CG1-CB 4.09Å; V633-I637 HydrophobicContact CG1-CD1 4.48Å; V633-I637 HydrophobicContact CG2-CD1 4.08Å; V633-I637 CarbonylContact O-C 3.3Å; V633-I637 VanDerWaalsContact O-CA 3.27Å; V633-I637 WeakPolarHBondContact O-CA 3.35Å; V633-I637 WeakPolarHBondContact O-CB 3.28Å; V633-I637 PolarHBondContact O-N 2.95Å; V633-I637 VanDerWaalsContact O-O 3.04Å; I637-K639 PolarHBondContact O-N 3.42Å; I637-K639 VanDerWaalsContact O-N 3.09Å
638	K	68	Low	83.6	Confident	181 Å²	181	96.2 Å²	96.2	79%	0.787	44%	0.442	S	S	*	.			trans	-70.4	106.5	165.6	-65.4	-172.3	178.2	-171.2	0	108.3	R640	K638-R640 PolarHBondContact O-N 3.49Å
639	K	51.6	Low	83.5	Confident	192 Å²	192	89.8 Å²	89.8	84%	0.835	42%	0.421	S	S	*	.			trans	-54.5	104.8	165.6	-78.8	-177.5	177.8	176.2	0	107	I637 E641	I637-K639 PolarHBondContact O-N 3.42Å; I637-K639 VanDerWaalsContact O-N 3.09Å; K639-E641 PolarHBondContact O-N 2.03Å; K639-E641 VanDerWaalsContact O-N 3.15Å
640	R	51.3	Low	83.5	Confident	212 Å²	212	88 Å²	88	80%	0.8	42%	0.418	S	S	*	.			trans	-66.7	112.4	167.5	-82.3	-173.9	171.2	-179.5	-4.9	106.1	K638 D642	K638-R640 PolarHBondContact O-N 3.49Å; R640-D642 PolarHBondContact O-N 2.87Å
641	E	67.1	Low	83.5	Confident	141 Å²	141	82.4 Å²	82.4	66%	0.659	40%	0.397	S	S	*	.			trans	-50.5	136.8	169.5	-71.4	-180	153.5	0	0	108.8	K639 P643 L646	K639-E641 PolarHBondContact O-N 2.03Å; K639-E641 VanDerWaalsContact O-N 3.15Å; E641-P643 WeakPolarHBondContact O-CD 3.06Å; E641-P643 VanDerWaalsContact O-N 3.1Å; E641-L646 HydrophobicContact CB-CD2 4.15Å; E641-L646 WeakPolarHBondContact OE2-CD2 3Å
642	D	81.2	Confident	83.3	Confident	38 Å²	38	89.4 Å²	89.4	20%	0.203	42%	0.419	C	S	.	.			trans	-61.2	116.6	178.7	-170.6	-22.6	0	0	0	108.3	R640 C644 K645 K697	R640-D642 PolarHBondContact O-N 2.87Å; D642-C644 PolarHBondContact O-N 3.44Å; D642-C644 VanDerWaalsContact O-N 3.1Å; D642-C644 WeakPolarHBondContact OD1-CB 3.24Å; D642-C644 PolarHBondContact OD1-N 3.5Å; D642-K645 HydrophobicContact CB-CB 4.45Å; D642-K645 HydrophobicContact CB-CD 4.1Å; D642-K645 HydrophobicContact CB-CG 3.98Å; D642-K645 WeakPolarHBondContact O-CB 3.06Å; D642-K645 PolarHBondContact O-N 2.87Å; D642-K697 IonicContact OD2-NZ 2.99Å; D642-K697 PolarHBondContact OD2-NZ 2.79Å
643	P	85	Confident	83	Confident	10 Å²	10	91.9 Å²	91.9	7%	0.065	44%	0.436	C	S	.	.	G	3₁₀ helix	trans	-52.1	-36.9	179.8	-30.1	38.6	0	0	0	112.2	E641 K645 L646 E681 N682	E641-P643 WeakPolarHBondContact O-CD 3.06Å; E641-P643 VanDerWaalsContact O-N 3.1Å; P643-K645 PolarHBondContact O-N 3.08Å; P643-K645 VanDerWaalsContact O-N 3.08Å; P643-L646 PolarHBondContact O-N 3.31Å; P643-E681 HydrophobicContact CB-CB 3.63Å; P643-E681 HydrophobicContact CG-CB 3.63Å; P643-E681 WeakPolarHBondContact CG-OE2 3.49Å; P643-N682 WeakPolarHBondContact O-CB 3.04Å; P643-N682 PolarHBondContact O-ND2 3.35Å
644	C	92.4	Very high	82.8	Confident	8 Å²	8	93.9 Å²	93.9	5%	0.054	46%	0.457	C	S	.	.	G	3₁₀ helix	trans	-66.5	-13.3	-178.4	-53	0	0	0	0	113	D642 Y662 C694	D642-C644 PolarHBondContact O-N 3.44Å; D642-C644 VanDerWaalsContact O-N 3.1Å; D642-C644 WeakPolarHBondContact OD1-CB 3.24Å; D642-C644 PolarHBondContact OD1-N 3.5Å; C644-Y662 HydrophobicContact CB-CD1 4.05Å; C644-Y662 HydrophobicContact CB-CG 4.33Å; C644-Y662 WeakPolarHBondContact O-CD1 3.45Å; C644-C694 HydrophobicContact CB-CB 3.84Å; C644-C694 WeakPolarHBondContact CB-SG 3Å; C644-C694 WeakPolarHBondContact SG-CA 3.13Å; C644-C694 WeakPolarHBondContact SG-CB 3.31Å; C644-C694 CovalentContact SG-SG 2.04Å; C644-C694 PolarHBondContact SG-SG 2.94Å
645	K	90.4	Very high	82.6	Confident	141 Å²	141	90 Å²	90	61%	0.613	44%	0.444	S	S	*	.	G	3₁₀ helix	trans	-95.6	-10.5	176.3	-61.1	-173.7	-179.4	-173.6	0	113.7	D642 P643 M664	D642-K645 HydrophobicContact CB-CB 4.45Å; D642-K645 HydrophobicContact CB-CD 4.1Å; D642-K645 HydrophobicContact CB-CG 3.98Å; D642-K645 WeakPolarHBondContact O-CB 3.06Å; D642-K645 PolarHBondContact O-N 2.87Å; P643-K645 PolarHBondContact O-N 3.08Å; P643-K645 VanDerWaalsContact O-N 3.08Å; K645-M664 HydrophobicContact CB-SD 4Å; K645-M664 HydrophobicContact CG-SD 3.82Å
646	L	90.3	Very high	82.8	Confident	32 Å²	32	93.2 Å²	93.2	17%	0.168	45%	0.453	C	S	.	.	S	Bend	trans	-77.3	148.4	-179.9	-54.8	173.6	0	0	0	109.9	E641 P643 N680 E681 N682	E641-L646 HydrophobicContact CB-CD2 4.15Å; E641-L646 WeakPolarHBondContact OE2-CD2 3Å; P643-L646 PolarHBondContact O-N 3.31Å; L646-N680 HydrophobicContact CD1-CB 3.94Å; L646-E681 HydrophobicContact CD1-CB 4.26Å; L646-N682 HydrophobicContact CB-CB 4.1Å; L646-N682 PolarHBondContact O-ND2 3.39Å
647	P	92.5	Very high	83.1	Confident	96 Å²	96	96.6 Å²	96.6	62%	0.623	47%	0.466	S	S	*	.	P	Polyproline II helix	trans	-66.4	162	173.8	28.9	-35.3	0	0	0	111.1	A649 N680	P647-A649 PolarHBondContact O-N 2.85Å; P647-N680 PolarHBondContact O-ND2 3.16Å; P647-N680 PolarHBondContact O-OD1 2.06Å
648	K	93.7	Very high	83.6	Confident	109 Å²	109	99.7 Å²	99.7	47%	0.474	48%	0.479	S	S	.	.	P	Polyproline II helix	trans	-59	132.9	165.6	61.6	-178.7	173.6	-169.6	0	110.1	P650 F661 F672	K648-P650 WeakPolarHBondContact O-CD 3.38Å; K648-F661 HydrophobicContact CB-CB 4.26Å; K648-F661 HydrophobicContact CB-CD1 3.72Å; K648-F661 HydrophobicContact CB-CD2 3.65Å; K648-F661 HydrophobicContact CB-CE1 3.94Å; K648-F661 HydrophobicContact CB-CE2 3.85Å; K648-F661 HydrophobicContact CB-CG 3.59Å; K648-F661 HydrophobicContact CB-CZ 4.01Å; K648-F661 HydrophobicContact CD-CD1 4.2Å; K648-F661 HydrophobicContact CD-CE1 3.63Å; K648-F661 HydrophobicContact CD-CE2 4.3Å; K648-F661 HydrophobicContact CD-CZ 3.7Å; K648-F661 HydrophobicContact CG-CD2 4.49Å; K648-F661 HydrophobicContact CG-CE1 4.27Å; K648-F661 HydrophobicContact CG-CE2 4.2Å; K648-F661 HydrophobicContact CG-CZ 4.1Å; K648-F672 HydrophobicContact CB-CD2 4.21Å; K648-F672 HydrophobicContact CB-CG 4.22Å; K648-F672 HydrophobicContact CD-CB 4.12Å
649	A	93.4	Very high	85	Confident	17 Å²	17	93.1 Å²	93.1	14%	0.14	45%	0.449	C	S	.	.			trans	-120	91	176.8	0	0	0	0	0	109.8	P647 G651 F672 N680	P647-A649 PolarHBondContact O-N 2.85Å; A649-G651 PolarHBondContact O-N 2.88Å; A649-F672 WeakPolarHBondContact O-CE2 3.44Å; A649-N680 HydrophobicContact CB-CB 4.21Å; A649-N680 WeakPolarHBondContact CB-ND2 3.37Å
650	P	92.7	Very high	87.2	Confident	58 Å²	58	85.4 Å²	85.4	38%	0.377	42%	0.415	S	S	.	.			trans	-57.5	-33.9	174.7	-24.5	34.6	0	0	0	112	K648 F672 V673 Y674 T675	K648-P650 WeakPolarHBondContact O-CD 3.38Å; P650-F672 HydrophobicContact CG-CD2 4.45Å; P650-V673 WeakPolarHBondContact CA-O 3.18Å; P650-V673 WeakPolarHBondContact CB-O 3.38Å; P650-Y674 WeakPolarHBondContact O-CD2 3.13Å; P650-T675 VanDerWaalsContact O-CB 3.28Å; P650-T675 WeakPolarHBondContact O-CB 3.38Å; P650-T675 WeakPolarHBondContact O-CG2 3.25Å; P650-T675 PolarHBondContact O-N 2.66Å; P650-T675 PolarHBondContact O-OG1 2.8Å
651	G	89.2	Confident	89.4	Confident	22 Å²	22	75.8 Å²	75.8	23%	0.227	38%	0.379	C	S	.	.			trans	71.5	-179.4	-170.4	0	0	0	0	0	113.1	A649 T675 C677	A649-G651 PolarHBondContact O-N 2.88Å; G651-T675 WeakPolarHBondContact CA-OG1 3.42Å; G651-T675 WeakPolarHBondContact O-CG2 3.32Å; G651-T675 PolarHBondContact O-OG1 3.32Å; G651-C677 VanDerWaalsContact CA-O 3.31Å; G651-C677 WeakPolarHBondContact CA-O 3.33Å
652	R	83.8	Confident	90.8	Very high	212 Å²	212	71.4 Å²	71.4	80%	0.8	36%	0.357	S	S	*	.	S	Bend	trans	-118	16.2	-173.6	-71.2	-175.7	-93.7	-146.5	-3.6	115.2	T675 E678	R652-T675 PolarHBondContact N-OG1 3.09Å; R652-E678 IonicContact CZ-OE2 3.2Å; R652-E678 IonicContact NE-OE2 3.66Å; R652-E678 PolarHBondContact NE-OE2 2.95Å; R652-E678 IonicContact NH2-OE2 3.38Å
653	C	88.7	Confident	91.5	Very high	51 Å²	51	71 Å²	71	35%	0.345	36%	0.355	S	S	.	.	S	Bend	trans	-81.2	178.2	178	-84.1	0	0	0	0	113.2	T675 C677	C653-T675 CarbonylContact C-O 3.52Å; C653-T675 WeakPolarHBondContact CB-O 3.33Å; C653-T675 PolarHBondContact N-OG1 3.5Å; C653-T675 WeakPolarHBondContact O-CB 3.3Å; C653-T675 WeakPolarHBondContact O-CG2 3.33Å; C653-C677 HydrophobicContact CB-CB 3.86Å; C653-C677 WeakPolarHBondContact CB-SG 3.44Å; C653-C677 WeakPolarHBondContact SG-CB 3.21Å; C653-C677 CovalentContact SG-SG 2Å; C653-C677 PolarHBondContact SG-SG 2.88Å
654	A	84.8	Confident	91.6	Very high	88 Å²	88	76.2 Å²	76.2	73%	0.727	38%	0.38	S	S	*	.	S	Bend	trans	-102.9	10.3	-173.7	0	0	0	0	0	114.8
655	N	80.6	Confident	91.4	Very high	94 Å²	94	85.4 Å²	85.4	50%	0.503	42%	0.419	S	S	.	.			trans	-95.5	164.6	172.4	-65	-59.2	0	0	0	110.1	F657 T675	N655-F657 HydrophobicContact CB-CD2 4.06Å; N655-F657 HydrophobicContact CB-CE2 3.38Å; N655-F657 HydrophobicContact CB-CZ 3.84Å; N655-T675 WeakPolarHBondContact CA-O 3.39Å; N655-T675 WeakPolarHBondContact CB-O 3.43Å; N655-T675 PolarHBondContact N-O 3.39Å; N655-T675 CarbonylContact O-C 3.44Å; N655-T675 WeakPolarHBondContact O-CA 3.48Å
656	Y	90.1	Very high	91.5	Very high	185 Å²	185	81.8 Å²	81.8	73%	0.725	41%	0.409	S	S	*	.			trans	-134	97.6	178.2	-67	-100.1	0	0	0	108.7	V673	Y656-V673 HydrophobicContact CD1-CG1 3.46Å; Y656-V673 VanDerWaalsContact CD1-CG1 3.46Å; Y656-V673 HydrophobicContact CE1-CG1 4.28Å; Y656-V673 HydrophobicContact CG-CG1 4.2Å
657	F	93.6	Very high	91.6	Very high	88 Å²	88	81.6 Å²	81.6	39%	0.386	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	123.4	175.8	-57.2	-74	0	0	0	109.2	N655 R659 Y674	N655-F657 HydrophobicContact CB-CD2 4.06Å; N655-F657 HydrophobicContact CB-CE2 3.38Å; N655-F657 HydrophobicContact CB-CZ 3.84Å; F657-R659 HydrophobicContact CB-CG 4.26Å; F657-R659 PolarHBondContact O-N 2.88Å; F657-Y674 HydrophobicContact CD2-CD1 4.12Å; F657-Y674 PolarHBondContact N-O 3.31Å; F657-Y674 PolarHBondContact O-N 3.04Å
658	Q	95.6	Very high	91.7	Very high	119 Å²	119	83.4 Å²	83.4	56%	0.556	41%	0.413	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.8	125.1	165.9	-170.9	-178.6	-92.9	0	0	108.7	K671	Q658-K671 HydrophobicContact CG-CD 4.47Å
659	R	97.7	Very high	91.9	Very high	42 Å²	42	79 Å²	79	16%	0.158	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	170.3	179.1	-63.2	-67.3	-179.5	84.4	4.1	109.6	F657 K671 F672 Y674 N683 F684	F657-R659 HydrophobicContact CB-CG 4.26Å; F657-R659 PolarHBondContact O-N 2.88Å; R659-K671 CarbonylContact O-C 3.55Å; R659-K671 VanDerWaalsContact O-CA 3.3Å; R659-K671 WeakPolarHBondContact O-CA 3.4Å; R659-F672 HydrophobicContact CB-CD1 3.99Å; R659-F672 HydrophobicContact CB-CE1 3.5Å; R659-F672 HydrophobicContact CB-CZ 3.89Å; R659-F672 PolarHBondContact N-O 3.33Å; R659-F672 PolarHBondContact O-N 3.26Å; R659-F672 VanDerWaalsContact O-O 3.13Å; R659-Y674 VanDerWaalsContact CG-CB 3.45Å; R659-Y674 HydrophobicContact CG-CD1 4.35Å; R659-Y674 HydrophobicContact CG-CG 4.25Å; R659-N683 VanDerWaalsContact CB-OD1 3.32Å; R659-N683 WeakPolarHBondContact CB-OD1 3.31Å; R659-N683 WeakPolarHBondContact CD-OD1 3.07Å; R659-N683 WeakPolarHBondContact CG-OD1 3.49Å; R659-N683 PolarHBondContact NH1-OD1 2.83Å; R659-F684 CarbonylContact C-O 3.52Å; R659-F684 WeakPolarHBondContact CA-O 3.16Å
660	Y	97.4	Very high	92.1	Very high	30 Å²	30	81 Å²	81	12%	0.118	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	143.7	176.3	-62.4	-98.8	0	0	0	110.1	E670 K671 F684 L687	Y660-E670 CarbonylContact C-O 3.55Å; Y660-E670 VanDerWaalsContact CA-O 3.24Å; Y660-E670 WeakPolarHBondContact CA-O 3.22Å; Y660-K671 HydrophobicContact CD1-CG 3.78Å; Y660-K671 HydrophobicContact CE1-CB 4.47Å; Y660-K671 HydrophobicContact CE1-CD 4.15Å; Y660-K671 HydrophobicContact CE1-CG 3.27Å; Y660-K671 WeakPolarHBondContact OH-CE 3.24Å; Y660-F684 PolarHBondContact N-O 2.76Å; Y660-F684 WeakPolarHBondContact O-CD2 2.99Å; Y660-F684 PolarHBondContact O-N 2.83Å; Y660-L687 HydrophobicContact CD1-CB 3.96Å; Y660-L687 HydrophobicContact CD1-CD1 3.8Å; Y660-L687 HydrophobicContact CD1-CG 4.47Å; Y660-L687 HydrophobicContact CE1-CB 3.63Å; Y660-L687 HydrophobicContact CE1-CD1 3.98Å; Y660-L687 HydrophobicContact CE1-CG 4.27Å; Y660-L687 HydrophobicContact CE2-CB 4.31Å; Y660-L687 HydrophobicContact CG-CB 4.41Å
661	F	97.4	Very high	92.3	Very high	10 Å²	10	84.2 Å²	84.2	4%	0.044	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	148.6	171.3	80.6	-73.5	0	0	0	109	K648 N663 C669 E670 F672 N682	K648-F661 HydrophobicContact CB-CB 4.26Å; K648-F661 HydrophobicContact CB-CD1 3.72Å; K648-F661 HydrophobicContact CB-CD2 3.65Å; K648-F661 HydrophobicContact CB-CE1 3.94Å; K648-F661 HydrophobicContact CB-CE2 3.85Å; K648-F661 HydrophobicContact CB-CG 3.59Å; K648-F661 HydrophobicContact CB-CZ 4.01Å; K648-F661 HydrophobicContact CD-CD1 4.2Å; K648-F661 HydrophobicContact CD-CE1 3.63Å; K648-F661 HydrophobicContact CD-CE2 4.3Å; K648-F661 HydrophobicContact CD-CZ 3.7Å; K648-F661 HydrophobicContact CG-CD2 4.49Å; K648-F661 HydrophobicContact CG-CE1 4.27Å; K648-F661 HydrophobicContact CG-CE2 4.2Å; K648-F661 HydrophobicContact CG-CZ 4.1Å; F661-N663 HydrophobicContact CD2-CB 4.42Å; F661-N663 HydrophobicContact CE2-CB 3.61Å; F661-N663 HydrophobicContact CZ-CB 3.78Å; F661-N663 PolarHBondContact O-N 2.59Å; F661-C669 CarbonylContact O-C 3.6Å; F661-C669 WeakPolarHBondContact O-CA 3.34Å; F661-E670 HydrophobicContact CD1-CB 4.2Å; F661-E670 WeakPolarHBondContact CD1-O 3.2Å; F661-E670 HydrophobicContact CE1-CB 3.6Å; F661-E670 HydrophobicContact CZ-CB 4.15Å; F661-E670 PolarHBondContact N-O 2.85Å; F661-E670 PolarHBondContact O-N 3.1Å; F661-F672 HydrophobicContact CB-CD1 3.98Å; F661-F672 HydrophobicContact CB-CE1 3.86Å; F661-F672 HydrophobicContact CD1-CB 4.14Å; F661-F672 AromaticContact CD1-CD1 3.71Å; F661-F672 HydrophobicContact CD1-CD1 3.71Å; F661-F672 HydrophobicContact CD1-CE1 4.45Å; F661-F672 HydrophobicContact CD1-CG 4.15Å; F661-F672 HydrophobicContact CE1-CB 4.39Å; F661-F672 HydrophobicContact CG-CD1 4.25Å; F661-N682 WeakPolarHBondContact CA-OD1 3.16Å; F661-N682 HydrophobicContact CB-CB 4.32Å; F661-N682 WeakPolarHBondContact CB-O 3.15Å
662	Y	96.6	Very high	92.7	Very high	49 Å²	49	83.8 Å²	83.8	19%	0.192	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	117.4	172	-176.7	-99.1	0	0	0	109.4	C644 M664 G667 N682 C694 F695	C644-Y662 HydrophobicContact CB-CD1 4.05Å; C644-Y662 HydrophobicContact CB-CG 4.33Å; C644-Y662 WeakPolarHBondContact O-CD1 3.45Å; Y662-M664 HydrophobicContact CD1-CG 4.09Å; Y662-M664 HydrophobicContact CE1-CG 3.97Å; Y662-G667 VanDerWaalsContact CE2-O 3.31Å; Y662-G667 WeakPolarHBondContact CE2-O 3.28Å; Y662-N682 PolarHBondContact N-ND2 3.14Å; Y662-N682 PolarHBondContact N-OD1 3.3Å; Y662-N682 PolarHBondContact O-ND2 2.85Å; Y662-C694 VanDerWaalsContact CB-SG 3.55Å; Y662-C694 HydrophobicContact CD1-CB 4.34Å; Y662-C694 HydrophobicContact CD2-CB 3.44Å; Y662-C694 VanDerWaalsContact CD2-CB 3.44Å; Y662-C694 HydrophobicContact CE2-CB 4.07Å; Y662-C694 HydrophobicContact CG-CB 3.6Å; Y662-F695 HydrophobicContact CD2-CD1 4.02Å; Y662-F695 AromaticContact CD2-CE1 3.76Å; Y662-F695 HydrophobicContact CD2-CE1 3.76Å; Y662-F695 AromaticContact CE2-CD1 3.64Å; Y662-F695 HydrophobicContact CE2-CD1 3.64Å; Y662-F695 AromaticContact CE2-CE1 3.51Å; Y662-F695 HydrophobicContact CE2-CE1 3.51Å
663	N	95.2	Very high	93.2	Very high	30 Å²	30	77.3 Å²	77.3	16%	0.16	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	104.8	176.9	-175.9	-14.3	0	0	0	109.5	F661 K665 T666 G667 F668 E670	F661-N663 HydrophobicContact CD2-CB 4.42Å; F661-N663 HydrophobicContact CE2-CB 3.61Å; F661-N663 HydrophobicContact CZ-CB 3.78Å; F661-N663 PolarHBondContact O-N 2.59Å; N663-K665 PolarHBondContact O-N 3.44Å; N663-K665 VanDerWaalsContact O-N 3.14Å; N663-K665 WeakPolarHBondContact OD1-CB 3.35Å; N663-K665 PolarHBondContact OD1-N 2.87Å; N663-T666 WeakPolarHBondContact CB-OG1 3.28Å; N663-T666 PolarHBondContact O-N 2.8Å; N663-T666 PolarHBondContact O-OG1 3.16Å; N663-G667 WeakPolarHBondContact O-CA 3.38Å; N663-G667 PolarHBondContact O-N 3.29Å; N663-F668 PolarHBondContact N-O 3.35Å; N663-E670 HydrophobicContact CB-CG 4.26Å; N663-E670 WeakPolarHBondContact CB-OE1 3.36Å; N663-E670 PolarHBondContact ND2-OE1 2.86Å; N663-E670 PolarHBondContact ND2-OE2 2.93Å
664	M	88.2	Confident	93.5	Very high	120 Å²	120	76.3 Å²	76.3	59%	0.591	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-24	178.3	-78.7	-160.9	65.6	0	0	114.5	K645 Y662	K645-M664 HydrophobicContact CB-SD 4Å; K645-M664 HydrophobicContact CG-SD 3.82Å; Y662-M664 HydrophobicContact CD1-CG 4.09Å; Y662-M664 HydrophobicContact CE1-CG 3.97Å
665	K	87.6	Confident	93.8	Very high	200 Å²	200	72.8 Å²	72.8	87%	0.87	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-34.1	179.9	-66.7	-173.8	177.8	-176	0	112.4	N663	N663-K665 PolarHBondContact O-N 3.44Å; N663-K665 VanDerWaalsContact O-N 3.14Å; N663-K665 WeakPolarHBondContact OD1-CB 3.35Å; N663-K665 PolarHBondContact OD1-N 2.87Å
666	T	93.6	Very high	93.9	Very high	65 Å²	65	69.7 Å²	69.7	40%	0.399	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.1	-20	-178.7	62.9	0	0	0	0	111.9	N663 F668 E670	N663-T666 WeakPolarHBondContact CB-OG1 3.28Å; N663-T666 PolarHBondContact O-N 2.8Å; N663-T666 PolarHBondContact O-OG1 3.16Å; T666-F668 WeakPolarHBondContact O-CD2 3.28Å; T666-F668 VanDerWaalsContact O-CE2 3.28Å; T666-F668 WeakPolarHBondContact O-CE2 3.32Å; T666-F668 PolarHBondContact OG1-N 3.45Å; T666-E670 WeakPolarHBondContact CB-OE1 3.28Å; T666-E670 WeakPolarHBondContact CG2-OE1 3.47Å; T666-E670 PolarHBondContact OG1-OE1 3.35Å
667	G	92.1	Very high	93.7	Very high	28 Å²	28	62.6 Å²	62.6	29%	0.289	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.9	5.9	-174.5	0	0	0	0	0	113.7	Y662 N663 F695	Y662-G667 VanDerWaalsContact CE2-O 3.31Å; Y662-G667 WeakPolarHBondContact CE2-O 3.28Å; N663-G667 WeakPolarHBondContact O-CA 3.38Å; N663-G667 PolarHBondContact O-N 3.29Å; G667-F695 WeakPolarHBondContact O-CE1 3.45Å
668	F	94.6	Very high	93.2	Very high	135 Å²	135	63.6 Å²	63.6	59%	0.592	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114	156.5	-175.1	-62.9	-74.6	0	0	0	112.9	N663 T666 F695	N663-F668 PolarHBondContact N-O 3.35Å; T666-F668 WeakPolarHBondContact O-CD2 3.28Å; T666-F668 VanDerWaalsContact O-CE2 3.28Å; T666-F668 WeakPolarHBondContact O-CE2 3.32Å; T666-F668 PolarHBondContact OG1-N 3.45Å; F668-F695 HydrophobicContact CD1-CZ 4.42Å
669	C	97.5	Very high	92.7	Very high	15 Å²	15	59.4 Å²	59.4	10%	0.101	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	115.1	167	-75.8	0	0	0	0	110.2	F661 L687 C690 Q691	F661-C669 CarbonylContact O-C 3.6Å; F661-C669 WeakPolarHBondContact O-CA 3.34Å; C669-L687 HydrophobicContact CB-CD1 3.5Å; C669-L687 VanDerWaalsContact CB-CD1 3.5Å; C669-C690 HydrophobicContact CB-CB 3.68Å; C669-C690 WeakPolarHBondContact CB-SG 3.41Å; C669-C690 WeakPolarHBondContact SG-CB 3.41Å; C669-C690 CovalentContact SG-SG 2.03Å; C669-C690 PolarHBondContact SG-SG 2.89Å; C669-Q691 HydrophobicContact CB-CG 4.24Å; C669-Q691 PolarHBondContact SG-N 2.91Å; C669-Q691 VanDerWaalsContact SG-N 3.44Å
670	E	97.3	Very high	92.4	Very high	59 Å²	59	59.5 Å²	59.5	28%	0.276	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	147.9	-174.6	-71.7	172.8	-159.2	0	0	111.4	Y660 F661 N663 T666	Y660-E670 CarbonylContact C-O 3.55Å; Y660-E670 VanDerWaalsContact CA-O 3.24Å; Y660-E670 WeakPolarHBondContact CA-O 3.22Å; F661-E670 HydrophobicContact CD1-CB 4.2Å; F661-E670 WeakPolarHBondContact CD1-O 3.2Å; F661-E670 HydrophobicContact CE1-CB 3.6Å; F661-E670 HydrophobicContact CZ-CB 4.15Å; F661-E670 PolarHBondContact N-O 2.85Å; F661-E670 PolarHBondContact O-N 3.1Å; N663-E670 HydrophobicContact CB-CG 4.26Å; N663-E670 WeakPolarHBondContact CB-OE1 3.36Å; N663-E670 PolarHBondContact ND2-OE1 2.86Å; N663-E670 PolarHBondContact ND2-OE2 2.93Å; T666-E670 WeakPolarHBondContact CB-OE1 3.28Å; T666-E670 WeakPolarHBondContact CG2-OE1 3.47Å; T666-E670 PolarHBondContact OG1-OE1 3.35Å
671	K	97	Very high	92.1	Very high	126 Å²	126	62.9 Å²	62.9	55%	0.548	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	142.3	174.5	-67.6	175.9	-176.6	-179	0	110.6	Q658 R659 Y660	Q658-K671 HydrophobicContact CG-CD 4.47Å; R659-K671 CarbonylContact O-C 3.55Å; R659-K671 VanDerWaalsContact O-CA 3.3Å; R659-K671 WeakPolarHBondContact O-CA 3.4Å; Y660-K671 HydrophobicContact CD1-CG 3.78Å; Y660-K671 HydrophobicContact CE1-CB 4.47Å; Y660-K671 HydrophobicContact CE1-CD 4.15Å; Y660-K671 HydrophobicContact CE1-CG 3.27Å; Y660-K671 WeakPolarHBondContact OH-CE 3.24Å
672	F	96.6	Very high	92	Very high	14 Å²	14	62.4 Å²	62.4	6%	0.061	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	162.3	165	79.4	-71.6	0	0	0	110.8	K648 A649 P650 R659 F661 N683	K648-F672 HydrophobicContact CB-CD2 4.21Å; K648-F672 HydrophobicContact CB-CG 4.22Å; K648-F672 HydrophobicContact CD-CB 4.12Å; A649-F672 WeakPolarHBondContact O-CE2 3.44Å; P650-F672 HydrophobicContact CG-CD2 4.45Å; R659-F672 HydrophobicContact CB-CD1 3.99Å; R659-F672 HydrophobicContact CB-CE1 3.5Å; R659-F672 HydrophobicContact CB-CZ 3.89Å; R659-F672 PolarHBondContact N-O 3.33Å; R659-F672 PolarHBondContact O-N 3.26Å; R659-F672 VanDerWaalsContact O-O 3.13Å; F661-F672 HydrophobicContact CB-CD1 3.98Å; F661-F672 HydrophobicContact CB-CE1 3.86Å; F661-F672 HydrophobicContact CD1-CB 4.14Å; F661-F672 AromaticContact CD1-CD1 3.71Å; F661-F672 HydrophobicContact CD1-CD1 3.71Å; F661-F672 HydrophobicContact CD1-CE1 4.45Å; F661-F672 HydrophobicContact CD1-CG 4.15Å; F661-F672 HydrophobicContact CE1-CB 4.39Å; F661-F672 HydrophobicContact CG-CD1 4.25Å; F672-N683 HydrophobicContact CZ-CB 4.04Å
673	V	94.9	Very high	92	Very high	75 Å²	75	61.3 Å²	61.3	46%	0.455	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	119.1	174.3	177	0	0	0	0	108.5	P650 Y656	P650-V673 WeakPolarHBondContact CA-O 3.18Å; P650-V673 WeakPolarHBondContact CB-O 3.38Å; Y656-V673 HydrophobicContact CD1-CG1 3.46Å; Y656-V673 VanDerWaalsContact CD1-CG1 3.46Å; Y656-V673 HydrophobicContact CE1-CG1 4.28Å; Y656-V673 HydrophobicContact CG-CG1 4.2Å
674	Y	95.7	Very high	92	Very high	30 Å²	30	61.1 Å²	61.1	12%	0.118	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	129	170.7	176.2	-122.4	0	0	0	110.6	P650 F657 R659 G676 C677 N683	P650-Y674 WeakPolarHBondContact O-CD2 3.13Å; F657-Y674 HydrophobicContact CD2-CD1 4.12Å; F657-Y674 PolarHBondContact N-O 3.31Å; F657-Y674 PolarHBondContact O-N 3.04Å; R659-Y674 VanDerWaalsContact CG-CB 3.45Å; R659-Y674 HydrophobicContact CG-CD1 4.35Å; R659-Y674 HydrophobicContact CG-CG 4.25Å; Y674-G676 VanDerWaalsContact CE1-C 3.44Å; Y674-G676 PolarHBondContact O-N 3.42Å; Y674-G676 PolarHBondContact OH-O 2.91Å; Y674-G676 VanDerWaalsContact OH-O 3.08Å; Y674-C677 WeakPolarHBondContact CE2-O 3.46Å; Y674-C677 WeakPolarHBondContact OH-CA 3Å; Y674-C677 PolarHBondContact OH-N 2.98Å; Y674-N683 WeakPolarHBondContact CD2-ND2 3.2Å; Y674-N683 WeakPolarHBondContact CE2-ND2 3.5Å
675	T	90.8	Very high	92.3	Very high	15 Å²	15	62.4 Å²	62.4	9%	0.092	32%	0.322	C	S	.	.			trans	-81.3	-2.8	-171.3	61.4	0	0	0	0	114.9	P650 G651 R652 C653 N655	P650-T675 VanDerWaalsContact O-CB 3.28Å; P650-T675 WeakPolarHBondContact O-CB 3.38Å; P650-T675 WeakPolarHBondContact O-CG2 3.25Å; P650-T675 PolarHBondContact O-N 2.66Å; P650-T675 PolarHBondContact O-OG1 2.8Å; G651-T675 WeakPolarHBondContact CA-OG1 3.42Å; G651-T675 WeakPolarHBondContact O-CG2 3.32Å; G651-T675 PolarHBondContact O-OG1 3.32Å; R652-T675 PolarHBondContact N-OG1 3.09Å; C653-T675 CarbonylContact C-O 3.52Å; C653-T675 WeakPolarHBondContact CB-O 3.33Å; C653-T675 PolarHBondContact N-OG1 3.5Å; C653-T675 WeakPolarHBondContact O-CB 3.3Å; C653-T675 WeakPolarHBondContact O-CG2 3.33Å; N655-T675 WeakPolarHBondContact CA-O 3.39Å; N655-T675 WeakPolarHBondContact CB-O 3.43Å; N655-T675 PolarHBondContact N-O 3.39Å; N655-T675 CarbonylContact O-C 3.44Å; N655-T675 WeakPolarHBondContact O-CA 3.48Å
676	G	83.3	Confident	92.7	Very high	29 Å²	29	55.3 Å²	55.3	30%	0.299	30%	0.296	S	S	.	.	S	Bend	trans	100.6	-18.8	-179.8	0	0	0	0	0	114.7	Y674	Y674-G676 VanDerWaalsContact CE1-C 3.44Å; Y674-G676 PolarHBondContact O-N 3.42Å; Y674-G676 PolarHBondContact OH-O 2.91Å; Y674-G676 VanDerWaalsContact OH-O 3.08Å
677	C	84.2	Confident	92.8	Very high	35 Å²	35	54.5 Å²	54.5	24%	0.236	29%	0.289	C	S	.	.	S	Bend	trans	-140.6	177.3	174.1	75	0	0	0	0	112	G651 C653 Y674 G679	G651-C677 VanDerWaalsContact CA-O 3.31Å; G651-C677 WeakPolarHBondContact CA-O 3.33Å; C653-C677 HydrophobicContact CB-CB 3.86Å; C653-C677 WeakPolarHBondContact CB-SG 3.44Å; C653-C677 WeakPolarHBondContact SG-CB 3.21Å; C653-C677 CovalentContact SG-SG 2Å; C653-C677 PolarHBondContact SG-SG 2.88Å; Y674-C677 WeakPolarHBondContact CE2-O 3.46Å; Y674-C677 WeakPolarHBondContact OH-CA 3Å; Y674-C677 PolarHBondContact OH-N 2.98Å; C677-G679 PolarHBondContact O-N 3.26Å
678	E	83.3	Confident	92.8	Very high	109 Å²	109	58.9 Å²	58.9	51%	0.509	30%	0.302	S	S	.	.	S	Bend	trans	54.5	22.3	177.9	-64.4	-172.7	178.6	0	0	114.5	R652	R652-E678 IonicContact CZ-OE2 3.2Å; R652-E678 IonicContact NE-OE2 3.66Å; R652-E678 PolarHBondContact NE-OE2 2.95Å; R652-E678 IonicContact NH2-OE2 3.38Å
679	G	85.2	Confident	92.9	Very high	31 Å²	31	56.8 Å²	56.8	32%	0.32	29%	0.294	S	S	.	.			trans	-80	160.5	173.8	0	0	0	0	0	111.1	C677	C677-G679 PolarHBondContact O-N 3.26Å
680	N	91.1	Very high	92.8	Very high	44 Å²	44	56.1 Å²	56.1	24%	0.235	29%	0.289	C	S	.	.			trans	-108.3	-179.6	166.8	65.2	30.2	0	0	0	110.2	L646 P647 A649 N682 N683	L646-N680 HydrophobicContact CD1-CB 3.94Å; P647-N680 PolarHBondContact O-ND2 3.16Å; P647-N680 PolarHBondContact O-OD1 2.06Å; A649-N680 HydrophobicContact CB-CB 4.21Å; A649-N680 WeakPolarHBondContact CB-ND2 3.37Å; N680-N682 PolarHBondContact O-N 2.91Å; N680-N682 WeakPolarHBondContact OD1-CB 3.04Å; N680-N682 PolarHBondContact OD1-N 2.83Å; N680-N682 VanDerWaalsContact OD1-N 3.09Å; N680-N683 WeakPolarHBondContact O-CB 2.79Å
681	E	91.6	Very high	92.7	Very high	101 Å²	101	56.6 Å²	56.6	47%	0.472	29%	0.291	S	S	.	.	S	Bend	trans	-69.5	-13.1	-174.5	-61.2	-171.8	174.2	0	0	113.5	P643 L646 N683	P643-E681 HydrophobicContact CB-CB 3.63Å; P643-E681 HydrophobicContact CG-CB 3.63Å; P643-E681 WeakPolarHBondContact CG-OE2 3.49Å; L646-E681 HydrophobicContact CD1-CB 4.26Å; E681-N683 PolarHBondContact O-N 2.89Å
682	N	95.3	Very high	92.3	Very high	0 Å²	0	54 Å²	54	0%	0	29%	0.294	C	S	.	.			trans	-78.1	54.8	172.7	-153.9	-2.6	0	0	0	111.4	P643 L646 F661 Y662 N680 F684	P643-N682 WeakPolarHBondContact O-CB 3.04Å; P643-N682 PolarHBondContact O-ND2 3.35Å; L646-N682 HydrophobicContact CB-CB 4.1Å; L646-N682 PolarHBondContact O-ND2 3.39Å; F661-N682 WeakPolarHBondContact CA-OD1 3.16Å; F661-N682 HydrophobicContact CB-CB 4.32Å; F661-N682 WeakPolarHBondContact CB-O 3.15Å; Y662-N682 PolarHBondContact N-ND2 3.14Å; Y662-N682 PolarHBondContact N-OD1 3.3Å; Y662-N682 PolarHBondContact O-ND2 2.85Å; N680-N682 PolarHBondContact O-N 2.91Å; N680-N682 WeakPolarHBondContact OD1-CB 3.04Å; N680-N682 PolarHBondContact OD1-N 2.83Å; N680-N682 VanDerWaalsContact OD1-N 3.09Å; N682-F684 WeakPolarHBondContact OD1-CE2 3.45Å
683	N	96.4	Very high	92	Very high	27 Å²	27	60 Å²	60	14%	0.144	32%	0.316	C	S	.	.			trans	-145.9	87.8	-169.3	-174.6	-25.8	0	0	0	110	R659 F672 Y674 N680 E681	R659-N683 VanDerWaalsContact CB-OD1 3.32Å; R659-N683 WeakPolarHBondContact CB-OD1 3.31Å; R659-N683 WeakPolarHBondContact CD-OD1 3.07Å; R659-N683 WeakPolarHBondContact CG-OD1 3.49Å; R659-N683 PolarHBondContact NH1-OD1 2.83Å; F672-N683 HydrophobicContact CZ-CB 4.04Å; Y674-N683 WeakPolarHBondContact CD2-ND2 3.2Å; Y674-N683 WeakPolarHBondContact CE2-ND2 3.5Å; N680-N683 WeakPolarHBondContact O-CB 2.79Å; E681-N683 PolarHBondContact O-N 2.89Å
684	F	96.1	Very high	91.9	Very high	26 Å²	26	57 Å²	57	11%	0.114	30%	0.298	C	S	.	.	B	Isolated β-bridge	trans	-98.8	143	-176.6	-55.9	-79	0	0	0	111	R659 Y660 N682 Q689 C690 R693	R659-F684 CarbonylContact C-O 3.52Å; R659-F684 WeakPolarHBondContact CA-O 3.16Å; Y660-F684 PolarHBondContact N-O 2.76Å; Y660-F684 WeakPolarHBondContact O-CD2 2.99Å; Y660-F684 PolarHBondContact O-N 2.83Å; N682-F684 WeakPolarHBondContact OD1-CE2 3.45Å; F684-Q689 HydrophobicContact CB-CB 4.04Å; F684-Q689 HydrophobicContact CD1-CB 4.21Å; F684-Q689 HydrophobicContact CG-CB 4.49Å; F684-C690 HydrophobicContact CB-CB 3.85Å; F684-C690 HydrophobicContact CD2-CB 3.41Å; F684-C690 VanDerWaalsContact CD2-CB 3.41Å; F684-C690 HydrophobicContact CE2-CB 4.11Å; F684-C690 HydrophobicContact CG-CB 3.7Å; F684-R693 HydrophobicContact CE1-CB 3.71Å; F684-R693 HydrophobicContact CE1-CG 3.71Å; F684-R693 HydrophobicContact CZ-CB 3.85Å; F684-R693 HydrophobicContact CZ-CG 3.68Å
685	K	94.3	Very high	91.5	Very high	147 Å²	147	59.6 Å²	59.6	64%	0.639	31%	0.31	S	S	*	.	S	Bend	trans	-73.5	-31.2	-179.6	-67	-179.1	178.1	179.5	0	112.1
686	T	96.2	Very high	90.2	Very high	50 Å²	50	65.7 Å²	65.7	31%	0.307	34%	0.342	S	S	.	.	S	Bend	trans	-130.1	161.5	-179.8	83.3	0	0	0	0	111.6	E688 Q689 C690	T686-E688 VanDerWaalsContact C-N 3.32Å; T686-E688 WeakPolarHBondContact CB-OE2 3.23Å; T686-E688 PolarHBondContact OG1-OE2 3.3Å; T686-Q689 PolarHBondContact O-N 2.79Å; T686-Q689 WeakPolarHBondContact OG1-CG 3.35Å; T686-Q689 PolarHBondContact OG1-N 2.81Å; T686-C690 PolarHBondContact O-N 3.06Å
687	L	96	Very high	88.7	Confident	48 Å²	48	74.3 Å²	74.3	25%	0.251	37%	0.371	S	S	.	.	H	α-helix	trans	-63	-42.4	178	177.9	58.3	0	0	0	110.6	Y660 C669 Q689 C690 Q691	Y660-L687 HydrophobicContact CD1-CB 3.96Å; Y660-L687 HydrophobicContact CD1-CD1 3.8Å; Y660-L687 HydrophobicContact CD1-CG 4.47Å; Y660-L687 HydrophobicContact CE1-CB 3.63Å; Y660-L687 HydrophobicContact CE1-CD1 3.98Å; Y660-L687 HydrophobicContact CE1-CG 4.27Å; Y660-L687 HydrophobicContact CE2-CB 4.31Å; Y660-L687 HydrophobicContact CG-CB 4.41Å; C669-L687 HydrophobicContact CB-CD1 3.5Å; C669-L687 VanDerWaalsContact CB-CD1 3.5Å; L687-Q689 VanDerWaalsContact C-N 3.3Å; L687-Q689 PolarHBondContact O-N 3.46Å; L687-C690 WeakPolarHBondContact O-CB 3.29Å; L687-C690 PolarHBondContact O-N 3.48Å; L687-C690 VanDerWaalsContact O-N 3.1Å; L687-Q691 HydrophobicContact CD1-CG 4.07Å; L687-Q691 HydrophobicContact CG-CG 4.27Å; L687-Q691 WeakPolarHBondContact O-CG 3.34Å; L687-Q691 PolarHBondContact O-N 3.26Å
688	E	92	Very high	89	Confident	121 Å²	121	76.3 Å²	76.3	57%	0.565	38%	0.378	S	S	*	.	H	α-helix	trans	-62.1	-38.2	-179.3	-57	70.8	-151.5	0	0	111	T686 Q691 A692	T686-E688 VanDerWaalsContact C-N 3.32Å; T686-E688 WeakPolarHBondContact CB-OE2 3.23Å; T686-E688 PolarHBondContact OG1-OE2 3.3Å; E688-Q691 PolarHBondContact O-N 3.39Å; E688-A692 WeakPolarHBondContact O-CB 3.23Å; E688-A692 PolarHBondContact O-N 2.87Å
689	Q	95.6	Very high	89.3	Confident	91 Å²	91	74.5 Å²	74.5	43%	0.425	37%	0.371	S	S	.	.	H	α-helix	trans	-63.8	-41.1	174.9	-73.7	175.7	1.8	0	0	112.1	F684 T686 L687 R693	F684-Q689 HydrophobicContact CB-CB 4.04Å; F684-Q689 HydrophobicContact CD1-CB 4.21Å; F684-Q689 HydrophobicContact CG-CB 4.49Å; T686-Q689 PolarHBondContact O-N 2.79Å; T686-Q689 WeakPolarHBondContact OG1-CG 3.35Å; T686-Q689 PolarHBondContact OG1-N 2.81Å; L687-Q689 VanDerWaalsContact C-N 3.3Å; L687-Q689 PolarHBondContact O-N 3.46Å; Q689-R693 VanDerWaalsContact O-CB 3.26Å; Q689-R693 WeakPolarHBondContact O-CB 3.25Å; Q689-R693 PolarHBondContact O-N 3.13Å; Q689-R693 VanDerWaalsContact O-N 3.17Å
690	C	97	Very high	89.5	Confident	0 Å²	0	76.9 Å²	76.9	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-66.7	-48.5	176.6	-179.5	0	0	0	0	111.1	C669 F684 T686 L687 R693 C694	C669-C690 HydrophobicContact CB-CB 3.68Å; C669-C690 WeakPolarHBondContact CB-SG 3.41Å; C669-C690 WeakPolarHBondContact SG-CB 3.41Å; C669-C690 CovalentContact SG-SG 2.03Å; C669-C690 PolarHBondContact SG-SG 2.89Å; F684-C690 HydrophobicContact CB-CB 3.85Å; F684-C690 HydrophobicContact CD2-CB 3.41Å; F684-C690 VanDerWaalsContact CD2-CB 3.41Å; F684-C690 HydrophobicContact CE2-CB 4.11Å; F684-C690 HydrophobicContact CG-CB 3.7Å; T686-C690 PolarHBondContact O-N 3.06Å; L687-C690 WeakPolarHBondContact O-CB 3.29Å; L687-C690 PolarHBondContact O-N 3.48Å; L687-C690 VanDerWaalsContact O-N 3.1Å; C690-R693 PolarHBondContact O-N 3.02Å; C690-C694 WeakPolarHBondContact O-CB 3.19Å; C690-C694 PolarHBondContact O-N 3.02Å
691	Q	93.3	Very high	89.4	Confident	70 Å²	70	78.9 Å²	78.9	33%	0.327	38%	0.382	S	S	.	.	H	α-helix	trans	-63.6	-47.5	-179.5	-68.2	177.6	-29.5	0	0	111.5	C669 L687 E688 R693 C694 F695	C669-Q691 HydrophobicContact CB-CG 4.24Å; C669-Q691 PolarHBondContact SG-N 2.91Å; C669-Q691 VanDerWaalsContact SG-N 3.44Å; L687-Q691 HydrophobicContact CD1-CG 4.07Å; L687-Q691 HydrophobicContact CG-CG 4.27Å; L687-Q691 WeakPolarHBondContact O-CG 3.34Å; L687-Q691 PolarHBondContact O-N 3.26Å; E688-Q691 PolarHBondContact O-N 3.39Å; Q691-R693 PolarHBondContact O-N 3.09Å; Q691-C694 PolarHBondContact O-N 3.44Å; Q691-F695 HydrophobicContact CB-CD2 3.89Å; Q691-F695 HydrophobicContact CB-CE2 4.18Å; Q691-F695 HydrophobicContact CB-CG 4.21Å; Q691-F695 HydrophobicContact CG-CD2 3.83Å; Q691-F695 HydrophobicContact CG-CE1 4.43Å; Q691-F695 HydrophobicContact CG-CE2 3.57Å; Q691-F695 HydrophobicContact CG-CG 4.4Å; Q691-F695 HydrophobicContact CG-CZ 3.91Å; Q691-F695 VanDerWaalsContact O-CB 3.29Å; Q691-F695 WeakPolarHBondContact O-CB 3.46Å; Q691-F695 PolarHBondContact O-N 2.88Å
692	A	89.2	Confident	89.3	Confident	72 Å²	72	77.5 Å²	77.5	60%	0.595	38%	0.376	S	S	*	.	H	α-helix	trans	-59.3	-33.6	176.8	0	0	0	0	0	112.4	E688	E688-A692 WeakPolarHBondContact O-CB 3.23Å; E688-A692 PolarHBondContact O-N 2.87Å
693	R	91.1	Very high	88.9	Confident	140 Å²	140	82.7 Å²	82.7	53%	0.528	40%	0.401	S	S	.	.	H	α-helix	trans	-80.1	-35	178.8	-174.4	58.4	173	-179.2	0.7	113.3	F684 Q689 C690 Q691	F684-R693 HydrophobicContact CE1-CB 3.71Å; F684-R693 HydrophobicContact CE1-CG 3.71Å; F684-R693 HydrophobicContact CZ-CB 3.85Å; F684-R693 HydrophobicContact CZ-CG 3.68Å; Q689-R693 VanDerWaalsContact O-CB 3.26Å; Q689-R693 WeakPolarHBondContact O-CB 3.25Å; Q689-R693 PolarHBondContact O-N 3.13Å; Q689-R693 VanDerWaalsContact O-N 3.17Å; C690-R693 PolarHBondContact O-N 3.02Å; Q691-R693 PolarHBondContact O-N 3.09Å
694	C	92.9	Very high	88.3	Confident	12 Å²	12	86.6 Å²	86.6	8%	0.081	42%	0.42	C	S	.	.	H	α-helix	trans	-116.9	-16.7	-165.3	-58.1	0	0	0	0	115.6	C644 Y662 C690 Q691	C644-C694 HydrophobicContact CB-CB 3.84Å; C644-C694 WeakPolarHBondContact CB-SG 3Å; C644-C694 WeakPolarHBondContact SG-CA 3.13Å; C644-C694 WeakPolarHBondContact SG-CB 3.31Å; C644-C694 CovalentContact SG-SG 2.04Å; C644-C694 PolarHBondContact SG-SG 2.94Å; Y662-C694 VanDerWaalsContact CB-SG 3.55Å; Y662-C694 HydrophobicContact CD1-CB 4.34Å; Y662-C694 HydrophobicContact CD2-CB 3.44Å; Y662-C694 VanDerWaalsContact CD2-CB 3.44Å; Y662-C694 HydrophobicContact CE2-CB 4.07Å; Y662-C694 HydrophobicContact CG-CB 3.6Å; C690-C694 WeakPolarHBondContact O-CB 3.19Å; C690-C694 PolarHBondContact O-N 3.02Å; Q691-C694 PolarHBondContact O-N 3.44Å
695	F	87.1	Confident	87.7	Confident	84 Å²	84	91.3 Å²	91.3	37%	0.368	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-18.9	-179.3	-71.6	6.2	0	0	0	114	Y662 G667 F668 Q691 K697	Y662-F695 HydrophobicContact CD2-CD1 4.02Å; Y662-F695 AromaticContact CD2-CE1 3.76Å; Y662-F695 HydrophobicContact CD2-CE1 3.76Å; Y662-F695 AromaticContact CE2-CD1 3.64Å; Y662-F695 HydrophobicContact CE2-CD1 3.64Å; Y662-F695 AromaticContact CE2-CE1 3.51Å; Y662-F695 HydrophobicContact CE2-CE1 3.51Å; G667-F695 WeakPolarHBondContact O-CE1 3.45Å; F668-F695 HydrophobicContact CD1-CZ 4.42Å; Q691-F695 HydrophobicContact CB-CD2 3.89Å; Q691-F695 HydrophobicContact CB-CE2 4.18Å; Q691-F695 HydrophobicContact CB-CG 4.21Å; Q691-F695 HydrophobicContact CG-CD2 3.83Å; Q691-F695 HydrophobicContact CG-CE1 4.43Å; Q691-F695 HydrophobicContact CG-CE2 3.57Å; Q691-F695 HydrophobicContact CG-CG 4.4Å; Q691-F695 HydrophobicContact CG-CZ 3.91Å; Q691-F695 VanDerWaalsContact O-CB 3.29Å; Q691-F695 WeakPolarHBondContact O-CB 3.46Å; Q691-F695 PolarHBondContact O-N 2.88Å; F695-K697 PolarHBondContact O-N 3.37Å
696	N	63.8	Low	87.2	Confident	143 Å²	143	86.7 Å²	86.7	77%	0.765	43%	0.427	S	S	*	.			trans	-95.2	49.1	-178.7	-80.5	-12.8	0	0	0	113.2
697	K	51.8	Low	86.3	Confident	209 Å²	209	90 Å²	90	91%	0.909	44%	0.438	S	S	*	.			trans	-135.1	0	174	-78.8	-166.2	-176.3	176.7	0	113.2	D642 F695	D642-K697 IonicContact OD2-NZ 2.99Å; D642-K697 PolarHBondContact OD2-NZ 2.79Å; F695-K697 PolarHBondContact O-N 3.37Å

Retrieved 697 of 697 residues in 386.6 ms (Link to these results)

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