A0A077YVA8_TRITR Loading...

WD40 domain containing protein

AlphaFold DB , UniProt , Accession A0A077YVA8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 286 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	35	Very low	29.6	Very low	246 Å²	246	153.1 Å²	153.1	100%	1.212	77%	0.767	S	S	*	*				0	90.4	0	-108.7	173.9	173.3	0	0	107.3
2	Y	26.5	Very low	30.9	Very low	237 Å²	237	149.8 Å²	149.8	93%	0.929	75%	0.754	S	S	*	*			trans	-114.2	100.6	178.1	-107.4	-91.2	0	0	0	106.7
3	D	34.8	Very low	32.1	Very low	115 Å²	115	143.5 Å²	143.5	62%	0.615	73%	0.731	S	S	*	*			trans	-93.4	91.2	171.9	-179.6	13.9	0	0	0	107.8	R5	D3-R5 VanDerWaalsContact C-N 3.32Å; D3-R5 PolarHBondContact O-N 2.96Å; D3-R5 IonicContact OD2-CZ 3.65Å; D3-R5 IonicContact OD2-NE 2.93Å; D3-R5 PolarHBondContact OD2-NE 3.18Å; D3-R5 IonicContact OD2-NH2 3.45Å; D3-R5 PolarHBondContact OD2-NH2 3.19Å
4	S	33.2	Very low	33.5	Very low	95 Å²	95	134.7 Å²	134.7	66%	0.664	69%	0.687	S	S	*	*			trans	-77.4	83.4	174.2	65.7	0	0	0	0	109.2	R6	S4-R6 PolarHBondContact O-N 2.94Å
5	R	30.3	Very low	35	Very low	206 Å²	206	129.5 Å²	129.5	78%	0.777	66%	0.664	S	S	*	*			trans	-63.6	118.8	174	-67.2	-175.9	-173.2	179.8	2	109.7	D3	D3-R5 VanDerWaalsContact C-N 3.32Å; D3-R5 PolarHBondContact O-N 2.96Å; D3-R5 IonicContact OD2-CZ 3.65Å; D3-R5 IonicContact OD2-NE 2.93Å; D3-R5 PolarHBondContact OD2-NE 3.18Å; D3-R5 IonicContact OD2-NH2 3.45Å; D3-R5 PolarHBondContact OD2-NH2 3.19Å
6	R	26.8	Very low	36.1	Very low	230 Å²	230	121.9 Å²	121.9	87%	0.868	63%	0.625	S	S	*	*			trans	-74.6	118.8	-171.8	-64.5	174.8	-178.5	175.5	-0.8	109.9	S4 V8	S4-R6 PolarHBondContact O-N 2.94Å; R6-V8 PolarHBondContact O-N 2.72Å
7	N	24.9	Very low	37.4	Very low	158 Å²	158	117.2 Å²	117.2	85%	0.845	61%	0.606	S	S	*	*			trans	-72.1	107.7	165.9	-71.7	-42.2	0	0	0	108.7	C9	N7-C9 PolarHBondContact O-N 2.96Å
8	V	26.1	Very low	38.3	Very low	123 Å²	123	111.2 Å²	111.2	75%	0.745	57%	0.574	S	S	*	*			trans	-79.4	94.4	162.2	-178.4	0	0	0	0	106	R6 L10	R6-V8 PolarHBondContact O-N 2.72Å; V8-L10 HydrophobicContact CG1-CG 4.22Å; V8-L10 PolarHBondContact O-N 3.34Å; V8-L10 VanDerWaalsContact O-N 3.1Å
9	C	25.2	Very low	38.4	Very low	109 Å²	109	109.2 Å²	109.2	74%	0.736	56%	0.564	S	S	*	*			trans	-76.7	94.7	178.1	-151	0	0	0	0	108.3	N7 A11	N7-C9 PolarHBondContact O-N 2.96Å; C9-A11 PolarHBondContact O-N 3.04Å
10	L	32.1	Very low	39	Very low	105 Å²	105	112.3 Å²	112.3	55%	0.55	57%	0.568	S	S	.	*			trans	-84.2	41.3	167.4	-69.5	173.1	0	0	0	110.6	V8 N12 H195	V8-L10 HydrophobicContact CG1-CG 4.22Å; V8-L10 PolarHBondContact O-N 3.34Å; V8-L10 VanDerWaalsContact O-N 3.1Å; L10-N12 PolarHBondContact O-N 2.82Å; L10-H195 PolarHBondContact O-CE1 2.84Å
11	A	31.2	Very low	39	Very low	60 Å²	60	115.8 Å²	115.8	50%	0.496	58%	0.58	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70.4	124.2	174.1	0	0	0	0	0	109	C9	C9-A11 PolarHBondContact O-N 3.04Å
12	N	45.1	Very low	39.1	Very low	113 Å²	113	107.3 Å²	107.3	60%	0.604	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.4	33.8	166.1	-46.8	-33	0	0	0	118.5	L10 L14	L10-N12 PolarHBondContact O-N 2.82Å; N12-L14 PolarHBondContact O-N 3.2Å
13	C	46.1	Very low	39.6	Very low	68 Å²	68	101.4 Å²	101.4	46%	0.459	53%	0.53	S	S	.	.			trans	-82.9	110.2	167.8	-78.6	0	0	0	0	111
14	L	51.1	Low	39.5	Very low	21 Å²	21	103.4 Å²	103.4	11%	0.11	53%	0.53	C	S	.	.			trans	-77.4	120.6	157.6	-164.2	92.9	0	0	0	107	N12 V16 L141 C142 G155 I161 I198	N12-L14 PolarHBondContact O-N 3.2Å; L14-V16 HydrophobicContact CD2-CG2 4.06Å; L14-L141 HydrophobicContact CB-CD1 4.46Å; L14-C142 VanDerWaalsContact O-CB 3.31Å; L14-C142 WeakPolarHBondContact O-CB 3.25Å; L14-C142 PolarHBondContact O-SG 3.29Å; L14-G155 VanDerWaalsContact CD2-CA 3.47Å; L14-I161 HydrophobicContact CD2-CG1 4.07Å; L14-I198 HydrophobicContact CD1-CD1 3.91Å
15	T	56.5	Low	39.5	Very low	56 Å²	56	101 Å²	101	34%	0.344	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	117.7	171.2	-54.9	0	0	0	0	107.8	C17	T15-C17 WeakPolarHBondContact CG2-SG 2.94Å
16	V	52.8	Low	39.6	Very low	8 Å²	8	94.4 Å²	94.4	5%	0.048	49%	0.491	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	125.2	166.9	178.2	0	0	0	0	107	L14 D144 A153 I161 F200	L14-V16 HydrophobicContact CD2-CG2 4.06Å; V16-D144 HydrophobicContact CB-CB 4.03Å; V16-D144 HydrophobicContact CG1-CB 3.89Å; V16-D144 VanDerWaalsContact O-CB 3.26Å; V16-D144 WeakPolarHBondContact O-CB 3.33Å; V16-D144 VanDerWaalsContact O-OD2 3.07Å; V16-A153 HydrophobicContact CG1-CB 3.96Å; V16-I161 HydrophobicContact CG2-CD1 4.24Å; V16-I161 HydrophobicContact CG2-CG1 4.37Å; V16-F200 HydrophobicContact CG1-CD2 3.58Å; V16-F200 HydrophobicContact CG1-CE2 3.34Å; V16-F200 HydrophobicContact CG1-CZ 4.43Å
17	C	57.5	Low	39.9	Very low	43 Å²	43	88.1 Å²	88.1	29%	0.291	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	121.3	174.5	-69.4	0	0	0	0	109.4	T15 D144 F200	T15-C17 WeakPolarHBondContact CG2-SG 2.94Å; C17-D144 VanDerWaalsContact C-OD2 3.29Å; C17-D144 WeakPolarHBondContact CA-OD2 3.16Å; C17-F200 PolarHBondContact O-N 3.41Å
18	F	53.5	Low	40.3	Very low	9 Å²	9	82 Å²	82	4%	0.039	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	141	158	-71.1	-85.6	0	0	0	109.2	R20 D144 W145 P147 A153 F200	F18-R20 VanDerWaalsContact C-N 3.3Å; F18-R20 PolarHBondContact O-N 2.87Å; F18-D144 HydrophobicContact CD2-CB 4.1Å; F18-D144 VanDerWaalsContact CD2-OD2 3.29Å; F18-D144 WeakPolarHBondContact CD2-OD2 3.02Å; F18-D144 HydrophobicContact CE2-CB 4.29Å; F18-D144 WeakPolarHBondContact CE2-O 3.47Å; F18-D144 PolarHBondContact N-OD2 2.86Å; F18-W145 WeakPolarHBondContact CD2-O 2.91Å; F18-W145 WeakPolarHBondContact CG-O 3.49Å; F18-P147 HydrophobicContact CB-CG 4.02Å; F18-A153 HydrophobicContact CE2-CB 4.01Å; F18-A153 HydrophobicContact CZ-CB 4.05Å; F18-F200 HydrophobicContact CD1-CB 3.41Å; F18-F200 VanDerWaalsContact CD1-CB 3.41Å; F18-F200 HydrophobicContact CD1-CG 4.11Å; F18-F200 HydrophobicContact CE1-CB 3.5Å; F18-F200 AromaticContact CE1-CD1 3.98Å; F18-F200 HydrophobicContact CE1-CD1 3.98Å; F18-F200 HydrophobicContact CE1-CD2 4.44Å; F18-F200 AromaticContact CE1-CG 3.74Å; F18-F200 HydrophobicContact CE1-CG 3.74Å; F18-F200 HydrophobicContact CG-CB 4.14Å; F18-F200 HydrophobicContact CZ-CB 4.29Å; F18-F200 HydrophobicContact CZ-CD1 4.29Å; F18-F200 HydrophobicContact CZ-CD2 4.42Å; F18-F200 HydrophobicContact CZ-CG 4.09Å
19	N	41.2	Very low	40.7	Very low	72 Å²	72	79 Å²	79	39%	0.385	44%	0.435	S	S	.	.	S	Bend	trans	-65	79.3	-176.3	-164.7	-7.4	0	0	0	112.7
20	R	50	Low	41.1	Very low	171 Å²	171	79.6 Å²	79.6	65%	0.645	44%	0.437	S	S	*	.	S	Bend	trans	-160.4	166.7	166.1	-79.8	-150	179.3	172.5	-5.9	111.7	F18 T22 P147	F18-R20 VanDerWaalsContact C-N 3.3Å; F18-R20 PolarHBondContact O-N 2.87Å; R20-T22 PolarHBondContact O-N 3.3Å; R20-P147 HydrophobicContact CG-CB 3.99Å; R20-P147 HydrophobicContact CG-CG 4.15Å
21	K	39.1	Very low	41.1	Very low	187 Å²	187	79.1 Å²	79.1	81%	0.813	44%	0.438	S	S	*	.			trans	-55.5	93.8	170.7	-67.4	-179	178.1	-177.5	0	110.4	V23	K21-V23 PolarHBondContact O-N 3.23Å; K21-V23 VanDerWaalsContact O-N 3.13Å
22	T	37.6	Very low	41.1	Very low	67 Å²	67	88.1 Å²	88.1	41%	0.411	46%	0.459	S	S	.	.			trans	-49.2	118.5	164.1	-52.3	0	0	0	0	107.7	R20	R20-T22 PolarHBondContact O-N 3.3Å
23	V	37.1	Very low	40.7	Very low	114 Å²	114	88.3 Å²	88.3	69%	0.691	46%	0.455	S	S	*	.			trans	-68.3	-49.5	-175	-179.8	0	0	0	0	108.9	K21	K21-V23 PolarHBondContact O-N 3.23Å; K21-V23 VanDerWaalsContact O-N 3.13Å
24	Y	33.1	Very low	40	Very low	157 Å²	157	93.9 Å²	93.9	62%	0.616	47%	0.474	S	S	*	.			trans	-158.4	149.7	167	-65.8	-72.5	0	0	0	110.8	F26	Y24-F26 HydrophobicContact CD1-CE2 4.41Å; Y24-F26 AromaticContact CD1-CZ 3.95Å; Y24-F26 HydrophobicContact CD1-CZ 3.95Å; Y24-F26 HydrophobicContact CG-CE2 4.24Å; Y24-F26 HydrophobicContact CG-CZ 4.24Å
25	S	32.3	Very low	39.1	Very low	45 Å²	45	100 Å²	100	32%	0.315	51%	0.507	S	S	.	.			trans	-147	135.5	174.3	152.4	0	0	0	0	108	W60	S25-W60 WeakPolarHBondContact OG-CH2 3.14Å; S25-W60 WeakPolarHBondContact OG-CZ2 3.43Å
26	F	32.2	Very low	38	Very low	67 Å²	67	105 Å²	105	29%	0.294	53%	0.531	S	S	.	.			trans	-140.5	129.4	179	-54.6	-80.3	0	0	0	110.7	Y24 S98 F104	Y24-F26 HydrophobicContact CD1-CE2 4.41Å; Y24-F26 AromaticContact CD1-CZ 3.95Å; Y24-F26 HydrophobicContact CD1-CZ 3.95Å; Y24-F26 HydrophobicContact CG-CE2 4.24Å; Y24-F26 HydrophobicContact CG-CZ 4.24Å; F26-S98 WeakPolarHBondContact CZ-OG 3.2Å; F26-F104 HydrophobicContact CD2-CE1 4.43Å; F26-F104 HydrophobicContact CD2-CE2 4.01Å; F26-F104 AromaticContact CD2-CZ 3.55Å; F26-F104 HydrophobicContact CD2-CZ 3.55Å; F26-F104 HydrophobicContact CE2-CE1 4.31Å; F26-F104 AromaticContact CE2-CZ 3.83Å; F26-F104 HydrophobicContact CE2-CZ 3.83Å
27	P	34	Very low	37.4	Very low	97 Å²	97	109.2 Å²	109.2	63%	0.63	57%	0.566	S	S	*	*			trans	-75.1	136.6	165.6	30.1	-31.3	0	0	0	110
28	I	32.3	Very low	36.6	Very low	31 Å²	31	114.1 Å²	114.1	16%	0.159	59%	0.589	C	S	.	*			trans	-107.8	132.2	174.9	-58.7	177.1	0	0	0	109.1	V58 I102	I28-V58 HydrophobicContact CD1-CB 4.4Å; I28-V58 HydrophobicContact CD1-CG1 4.1Å; I28-I102 HydrophobicContact CG2-CG2 4.19Å
29	A	33.7	Very low	35.8	Very low	60 Å²	60	121.1 Å²	121.1	50%	0.496	63%	0.628	S	S	.	*			trans	-77.5	139.9	176.9	0	0	0	0	0	111
30	P	35.1	Very low	35.6	Very low	121 Å²	121	126.3 Å²	126.3	79%	0.786	65%	0.649	S	S	*	*			trans	-67.7	134.4	-179.1	25.1	-32	0	0	0	111.8
31	V	31.5	Very low	35.1	Very low	94 Å²	94	125 Å²	125	57%	0.57	66%	0.66	S	S	*	*			trans	-108	147.9	174.7	-179	0	0	0	0	109.9	S56	V31-S56 WeakPolarHBondContact O-CB 3.48Å
32	R	31.5	Very low	35.6	Very low	249 Å²	249	118.4 Å²	118.4	94%	0.94	64%	0.637	S	S	*	*			trans	-76	141.2	-170.4	-122.2	177.2	-178.2	173.1	-0.3	113.3
33	K	36.1	Very low	36.7	Very low	118 Å²	118	118.3 Å²	118.3	51%	0.513	64%	0.639	S	S	.	*			trans	-66.4	154.3	-173.2	-79.3	-177.7	168.6	-174.7	0	116.1	N77	K33-N77 PolarHBondContact NZ-ND2 2.61Å
34	Q	32.9	Very low	37.4	Very low	184 Å²	184	117.6 Å²	117.6	86%	0.86	63%	0.631	S	S	*	*			trans	-127.2	143.6	151.3	-108.8	175.8	-0.7	0	0	110.3
35	N	32	Very low	38.2	Very low	151 Å²	151	112.5 Å²	112.5	81%	0.807	62%	0.621	S	S	*	*			trans	-85	143.4	-171.7	-67	-32.2	0	0	0	112
36	L	33.2	Very low	39.5	Very low	161 Å²	161	114.8 Å²	114.8	84%	0.843	63%	0.63	S	S	*	*			trans	-143.4	146.9	169.8	-107.1	129	0	0	0	111.1
37	A	40.4	Very low	40.7	Very low	95 Å²	95	113.9 Å²	113.9	79%	0.785	63%	0.628	S	S	*	*			trans	-87.4	154.4	-162.5	0	0	0	0	0	114.7
38	D	40.2	Very low	41.8	Very low	146 Å²	146	110 Å²	110	78%	0.781	60%	0.601	S	S	*	*			trans	-82.3	132.7	-174.8	-56.7	-55.7	0	0	0	112.8
39	N	37.3	Very low	43.1	Very low	157 Å²	157	110.8 Å²	110.8	84%	0.84	61%	0.608	S	S	*	*				172.1	148.3	125.2	-87.7	-29.2	0	0	0	110.3
40	E	35.4	Very low	44.5	Very low	180 Å²	180	113 Å²	113	84%	0.841	61%	0.608	S	S	*	*	S	Bend	trans	87.4	126.6	-174	-54.8	-169.7	166.6	0	0	115.7	P42	E40-P42 WeakPolarHBondContact O-CD 3.41Å; E40-P42 WeakPolarHBondContact O-CG 3.41Å; E40-P42 VanDerWaalsContact O-N 3.1Å
41	T	40.7	Very low	45.8	Very low	143 Å²	143	110.9 Å²	110.9	88%	0.877	58%	0.584	S	S	*	*			trans	-64.8	102.9	176	39.1	0	0	0	0	109.3
42	P	50.4	Low	47.1	Very low	49 Å²	49	110 Å²	110	32%	0.318	57%	0.573	S	S	.	*			trans	-72.6	150.4	-175.7	-5.1	22.6	0	0	0	108.6	E40 N46 I47	E40-P42 WeakPolarHBondContact O-CD 3.41Å; E40-P42 WeakPolarHBondContact O-CG 3.41Å; E40-P42 VanDerWaalsContact O-N 3.1Å; P42-N46 HydrophobicContact CB-CB 3.53Å; P42-I47 HydrophobicContact CB-CG1 3.91Å; P42-I47 HydrophobicContact CG-CG1 3.89Å
43	S	58.8	Low	48.5	Very low	65 Å²	65	101.6 Å²	101.6	46%	0.455	55%	0.552	S	S	.	*			trans	-52.5	148.3	167	84.4	0	0	0	0	108.9	A45 N46 I47	S43-A45 PolarHBondContact O-N 2.68Å; S43-N46 WeakPolarHBondContact O-CA 3.12Å; S43-N46 WeakPolarHBondContact O-CB 3.41Å; S43-N46 PolarHBondContact O-N 2.95Å; S43-N46 PolarHBondContact OG-N 3.46Å; S43-I47 PolarHBondContact O-N 3.38Å
44	L	52	Low	49.9	Very low	99 Å²	99	97.9 Å²	97.9	52%	0.518	54%	0.541	S	S	.	.	H	α-helix	trans	-52.2	-34.5	179	-173.5	63.5	0	0	0	111.4	I47 I48 A130	L44-I47 PolarHBondContact O-N 3.11Å; L44-I48 HydrophobicContact CG-CD1 3.96Å; L44-I48 WeakPolarHBondContact O-CB 3.43Å; L44-I48 VanDerWaalsContact O-CD1 3.25Å; L44-I48 WeakPolarHBondContact O-CD1 3.25Å; L44-I48 WeakPolarHBondContact O-CG1 3.27Å; L44-I48 PolarHBondContact O-N 3.02Å; L44-A130 HydrophobicContact CD2-CB 3.54Å; L44-A130 HydrophobicContact CG-CB 4.23Å
45	A	50.4	Low	51.2	Low	51 Å²	51	92.3 Å²	92.3	42%	0.421	52%	0.521	S	S	.	.	H	α-helix	trans	-61.3	-45.3	172.5	0	0	0	0	0	112.5	S43 I48 V49	S43-A45 PolarHBondContact O-N 2.68Å; A45-I48 WeakPolarHBondContact O-CB 3.15Å; A45-I48 PolarHBondContact O-N 3Å; A45-V49 WeakPolarHBondContact O-CG2 3.38Å; A45-V49 PolarHBondContact O-N 3.21Å
46	N	58.9	Low	52.9	Low	93 Å²	93	86 Å²	86	50%	0.497	49%	0.489	S	S	.	.	H	α-helix	trans	-64	-40.5	175	-72	-1.3	0	0	0	111.7	P42 S43 I48 V49 Q50	P42-N46 HydrophobicContact CB-CB 3.53Å; S43-N46 WeakPolarHBondContact O-CA 3.12Å; S43-N46 WeakPolarHBondContact O-CB 3.41Å; S43-N46 PolarHBondContact O-N 2.95Å; S43-N46 PolarHBondContact OG-N 3.46Å; N46-I48 VanDerWaalsContact C-N 3.28Å; N46-I48 PolarHBondContact O-N 3.4Å; N46-V49 PolarHBondContact O-N 3.34Å; N46-Q50 WeakPolarHBondContact O-CB 3.47Å; N46-Q50 PolarHBondContact O-N 3.21Å
47	I	58.9	Low	55.1	Low	48 Å²	48	79.7 Å²	79.7	25%	0.246	46%	0.456	C	S	.	.	H	α-helix	trans	-59.8	-43.6	174	-62.7	176.1	0	0	0	109.9	P42 S43 L44 R51	P42-I47 HydrophobicContact CB-CG1 3.91Å; P42-I47 HydrophobicContact CG-CG1 3.89Å; S43-I47 PolarHBondContact O-N 3.38Å; L44-I47 PolarHBondContact O-N 3.11Å; I47-R51 HydrophobicContact CG2-CG 4.2Å; I47-R51 WeakPolarHBondContact O-CB 3.03Å; I47-R51 WeakPolarHBondContact O-CG 3.35Å; I47-R51 PolarHBondContact O-N 2.89Å
48	I	55.6	Low	57.1	Low	15 Å²	15	75.9 Å²	75.9	8%	0.077	42%	0.423	C	S	.	.	H	α-helix	trans	-62.9	-51.6	178.3	-73	158.6	0	0	0	110.4	L44 A45 N46 Q50 R51 F52 F85 A130	L44-I48 HydrophobicContact CG-CD1 3.96Å; L44-I48 WeakPolarHBondContact O-CB 3.43Å; L44-I48 VanDerWaalsContact O-CD1 3.25Å; L44-I48 WeakPolarHBondContact O-CD1 3.25Å; L44-I48 WeakPolarHBondContact O-CG1 3.27Å; L44-I48 PolarHBondContact O-N 3.02Å; A45-I48 WeakPolarHBondContact O-CB 3.15Å; A45-I48 PolarHBondContact O-N 3Å; N46-I48 VanDerWaalsContact C-N 3.28Å; N46-I48 PolarHBondContact O-N 3.4Å; I48-Q50 PolarHBondContact O-N 2.89Å; I48-R51 PolarHBondContact O-N 3.34Å; I48-F52 HydrophobicContact CG2-CD2 3.45Å; I48-F52 VanDerWaalsContact CG2-CD2 3.45Å; I48-F52 HydrophobicContact CG2-CE2 3.43Å; I48-F52 VanDerWaalsContact CG2-CE2 3.43Å; I48-F52 WeakPolarHBondContact O-CB 3.46Å; I48-F52 WeakPolarHBondContact O-CD2 3.2Å; I48-F52 PolarHBondContact O-N 3.06Å; I48-F85 HydrophobicContact CD1-CE1 3.84Å; I48-F85 HydrophobicContact CG1-CE1 4.2Å; I48-F85 HydrophobicContact CG1-CZ 4.42Å; I48-F85 HydrophobicContact CG2-CE1 3.83Å; I48-F85 HydrophobicContact CG2-CZ 3.92Å; I48-A130 HydrophobicContact CD1-CB 3.9Å
49	V	59.8	Low	59.2	Low	48 Å²	48	71.1 Å²	71.1	29%	0.291	40%	0.399	S	S	.	.	H	α-helix	trans	-57.5	-51.4	178.1	176.5	0	0	0	0	110.4	A45 N46 R51 F52 S53 L121	A45-V49 WeakPolarHBondContact O-CG2 3.38Å; A45-V49 PolarHBondContact O-N 3.21Å; N46-V49 PolarHBondContact O-N 3.34Å; V49-R51 VanDerWaalsContact C-N 3.32Å; V49-R51 PolarHBondContact O-N 3.08Å; V49-F52 PolarHBondContact O-N 3.04Å; V49-S53 PolarHBondContact O-N 3.44Å; V49-S53 PolarHBondContact O-OG 3.28Å; V49-L121 HydrophobicContact CB-CD1 4.46Å; V49-L121 HydrophobicContact CG2-CB 4.28Å; V49-L121 HydrophobicContact CG2-CD1 3.43Å; V49-L121 VanDerWaalsContact CG2-CD1 3.43Å; V49-L121 HydrophobicContact CG2-CG 4.4Å
50	Q	63.8	Low	61.4	Low	107 Å²	107	65.3 Å²	65.3	50%	0.5	37%	0.365	S	S	.	.	H	α-helix	trans	-63.9	-37.8	-178.5	-169.2	-177.4	9.1	0	0	111.4	N46 I48 S53	N46-Q50 WeakPolarHBondContact O-CB 3.47Å; N46-Q50 PolarHBondContact O-N 3.21Å; I48-Q50 PolarHBondContact O-N 2.89Å; Q50-S53 VanDerWaalsContact O-CB 3.25Å; Q50-S53 WeakPolarHBondContact O-CB 2.81Å; Q50-S53 PolarHBondContact O-N 2.7Å
51	R	61.4	Low	63.8	Low	75 Å²	75	57.3 Å²	57.3	28%	0.283	33%	0.329	S	S	.	.	H	α-helix	trans	-75	-35.5	177.9	-73.5	-171.1	-178.6	-159.2	0.9	112.8	I47 I48 V49 S53 S54 L74 N76	I47-R51 HydrophobicContact CG2-CG 4.2Å; I47-R51 WeakPolarHBondContact O-CB 3.03Å; I47-R51 WeakPolarHBondContact O-CG 3.35Å; I47-R51 PolarHBondContact O-N 2.89Å; I48-R51 PolarHBondContact O-N 3.34Å; V49-R51 VanDerWaalsContact C-N 3.32Å; V49-R51 PolarHBondContact O-N 3.08Å; R51-S53 PolarHBondContact O-N 3.4Å; R51-S54 CarbonylContact O-C 3.56Å; R51-S54 PolarHBondContact O-N 3.29Å; R51-L74 HydrophobicContact CB-CD1 4.41Å; R51-N76 PolarHBondContact NH1-ND2 3.33Å
52	F	60.8	Low	66	Low	75 Å²	75	51.6 Å²	51.6	33%	0.329	29%	0.292	S	S	.	.	H	α-helix	trans	-68.4	-22.3	169.3	-79.5	-62	0	0	0	112.7	I48 V49 S54 V58 V72 F85	I48-F52 HydrophobicContact CG2-CD2 3.45Å; I48-F52 VanDerWaalsContact CG2-CD2 3.45Å; I48-F52 HydrophobicContact CG2-CE2 3.43Å; I48-F52 VanDerWaalsContact CG2-CE2 3.43Å; I48-F52 WeakPolarHBondContact O-CB 3.46Å; I48-F52 WeakPolarHBondContact O-CD2 3.2Å; I48-F52 PolarHBondContact O-N 3.06Å; V49-F52 PolarHBondContact O-N 3.04Å; F52-S54 PolarHBondContact O-N 2.84Å; F52-V58 HydrophobicContact CD1-CG2 4.31Å; F52-V58 HydrophobicContact CE1-CG2 4.25Å; F52-V72 HydrophobicContact CE1-CG1 3.83Å; F52-V72 HydrophobicContact CE1-CG2 4.49Å; F52-V72 HydrophobicContact CZ-CB 4.31Å; F52-V72 HydrophobicContact CZ-CG1 3.94Å; F52-V72 HydrophobicContact CZ-CG2 4.11Å; F52-F85 HydrophobicContact CE2-CE1 4.35Å; F52-F85 AromaticContact CE2-CE2 3.86Å; F52-F85 HydrophobicContact CE2-CE2 3.86Å; F52-F85 AromaticContact CE2-CZ 3.47Å; F52-F85 HydrophobicContact CE2-CZ 3.47Å; F52-F85 VanDerWaalsContact CE2-CZ 3.47Å; F52-F85 AromaticContact CZ-CE2 3.63Å; F52-F85 HydrophobicContact CZ-CE2 3.63Å; F52-F85 AromaticContact CZ-CZ 3.73Å; F52-F85 HydrophobicContact CZ-CZ 3.73Å
53	S	59.8	Low	67.9	Low	74 Å²	74	52.1 Å²	52.1	52%	0.517	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-19.2	173.7	-54.6	0	0	0	0	112.6	V49 Q50 R51 P55	V49-S53 PolarHBondContact O-N 3.44Å; V49-S53 PolarHBondContact O-OG 3.28Å; Q50-S53 VanDerWaalsContact O-CB 3.25Å; Q50-S53 WeakPolarHBondContact O-CB 2.81Å; Q50-S53 PolarHBondContact O-N 2.7Å; R51-S53 PolarHBondContact O-N 3.4Å; S53-P55 VanDerWaalsContact C-CD 3.47Å; S53-P55 VanDerWaalsContact O-CD 3.23Å; S53-P55 WeakPolarHBondContact O-CD 3.13Å
54	S	66.3	Low	69.2	Low	40 Å²	40	49.7 Å²	49.7	28%	0.28	28%	0.278	S	S	.	.	S	Bend	trans	-110.9	79.5	168.7	-160.8	0	0	0	0	109.8	R51 F52 S56 N57	R51-S54 CarbonylContact O-C 3.56Å; R51-S54 PolarHBondContact O-N 3.29Å; F52-S54 PolarHBondContact O-N 2.84Å; S54-S56 PolarHBondContact O-N 3.37Å; S54-S56 PolarHBondContact O-OG 2.83Å; S54-S56 PolarHBondContact OG-OG 3.48Å; S54-N57 PolarHBondContact O-N 3.42Å
55	P	59.9	Low	70.8	Confident	67 Å²	67	48.7 Å²	48.7	44%	0.435	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-59.2	-14.1	-175.5	24	-34.6	0	0	0	113.7	S53 N57 V58	S53-P55 VanDerWaalsContact C-CD 3.47Å; S53-P55 VanDerWaalsContact O-CD 3.23Å; S53-P55 WeakPolarHBondContact O-CD 3.13Å; P55-N57 PolarHBondContact O-N 2.89Å; P55-V58 PolarHBondContact O-N 2.81Å
56	S	66.4	Low	72.4	Confident	19 Å²	19	50.8 Å²	50.8	13%	0.133	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-49.8	-23.1	172	55.6	0	0	0	0	115.2	V31 S54	V31-S56 WeakPolarHBondContact O-CB 3.48Å; S54-S56 PolarHBondContact O-N 3.37Å; S54-S56 PolarHBondContact O-OG 2.83Å; S54-S56 PolarHBondContact OG-OG 3.48Å
57	N	80.2	Confident	73.7	Confident	27 Å²	27	48 Å²	48	14%	0.144	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-96.2	-12.4	-172.5	-62.3	2.4	0	0	0	112.4	S54 P55 V59 L74 N75 N76	S54-N57 PolarHBondContact O-N 3.42Å; P55-N57 PolarHBondContact O-N 2.89Å; N57-V59 PolarHBondContact O-N 2.98Å; N57-L74 CarbonylContact O-C 3.41Å; N57-L74 WeakPolarHBondContact O-CA 3.19Å; N57-N75 WeakPolarHBondContact CB-O 3.49Å; N57-N75 PolarHBondContact O-N 3.23Å; N57-N76 PolarHBondContact ND2-OD1 2.95Å
58	V	83.1	Confident	75	Confident	16 Å²	16	46.4 Å²	46.4	10%	0.097	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	115.8	178.6	-174.3	0	0	0	0	109.5	I28 F52 P55 T61 V72 C73 L74	I28-V58 HydrophobicContact CD1-CB 4.4Å; I28-V58 HydrophobicContact CD1-CG1 4.1Å; F52-V58 HydrophobicContact CD1-CG2 4.31Å; F52-V58 HydrophobicContact CE1-CG2 4.25Å; P55-V58 PolarHBondContact O-N 2.81Å; V58-T61 HydrophobicContact CG1-CG2 3.61Å; V58-V72 HydrophobicContact CG1-CG1 3.93Å; V58-V72 HydrophobicContact CG2-CG1 4.39Å; V58-C73 WeakPolarHBondContact CA-O 3.45Å; V58-L74 HydrophobicContact CB-CD2 4.18Å; V58-L74 HydrophobicContact CG2-CD2 3.53Å
59	V	84.5	Confident	76.6	Confident	45 Å²	45	46 Å²	46	27%	0.273	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	-39.2	177.8	-176.4	0	0	0	0	111.4	N57 C73 N75	N57-V59 PolarHBondContact O-N 2.98Å; V59-C73 PolarHBondContact N-O 3.27Å; V59-N75 HydrophobicContact CG2-CB 3.29Å
60	W	83.1	Confident	77.9	Confident	36 Å²	36	45.2 Å²	45.2	14%	0.136	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	148.3	-172	-163.5	-102.8	0	0	0	111.2	S25 C73 V143	S25-W60 WeakPolarHBondContact OG-CH2 3.14Å; S25-W60 WeakPolarHBondContact OG-CZ2 3.43Å; W60-C73 HydrophobicContact CB-CB 3.86Å; W60-C73 PolarHBondContact N-O 3.29Å; W60-C73 PolarHBondContact O-N 2.91Å; W60-V143 PolarHBondContact NE1-O 2.82Å
61	T	85.9	Confident	79.1	Confident	12 Å²	12	40.1 Å²	40.1	7%	0.074	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	141.7	172.6	60.2	0	0	0	0	109.8	V58 A71 V72 F104	V58-T61 HydrophobicContact CG1-CG2 3.61Å; T61-A71 CarbonylContact C-O 3.57Å; T61-A71 WeakPolarHBondContact CA-O 3.43Å; T61-V72 HydrophobicContact CG2-CB 4.39Å; T61-V72 HydrophobicContact CG2-CG1 4.08Å; T61-V72 HydrophobicContact CG2-CG2 4.03Å; T61-F104 WeakPolarHBondContact OG1-CD2 3.33Å; T61-F104 WeakPolarHBondContact OG1-CE2 3.37Å
62	Q	87.2	Confident	80.3	Confident	23 Å²	23	36.7 Å²	36.7	11%	0.107	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	137.8	176.4	-168.2	176.4	4	0	0	112.3	A71 V143 D144 W145	Q62-A71 PolarHBondContact N-O 3.22Å; Q62-A71 PolarHBondContact O-N 3.24Å; Q62-V143 PolarHBondContact OE1-O 2.77Å; Q62-D144 VanDerWaalsContact CD-OD1 3.29Å; Q62-D144 PolarHBondContact NE2-OD1 2.91Å; Q62-D144 VanDerWaalsContact OE1-CA 3.3Å; Q62-D144 PolarHBondContact OE1-OD1 2.93Å; Q62-W145 PolarHBondContact O-NE1 2.91Å
63	C	88.8	Confident	81.4	Confident	60 Å²	60	33.1 Å²	33.1	41%	0.405	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	150	171.4	-60.9	0	0	0	0	111.5	L69	C63-L69 CarbonylContact C-O 3.59Å; C63-L69 VanDerWaalsContact CA-O 3.24Å; C63-L69 WeakPolarHBondContact CA-O 3.42Å
64	N	86.7	Confident	82.7	Confident	13 Å²	13	29.9 Å²	29.9	7%	0.07	19%	0.187	C	C	.	.			trans	-71.2	173.6	167.1	74.2	-22.3	0	0	0	111.3	D66 G67 S68 L69 W145	N64-D66 VanDerWaalsContact C-N 3.28Å; N64-D66 PolarHBondContact ND2-OD1 2.93Å; N64-D66 PolarHBondContact O-N 2.77Å; N64-D66 PolarHBondContact OD1-OD1 3Å; N64-G67 PolarHBondContact O-N 2.95Å; N64-G67 PolarHBondContact OD1-N 3.16Å; N64-S68 PolarHBondContact ND2-OG 2.73Å; N64-S68 PolarHBondContact OD1-N 2.58Å; N64-L69 HydrophobicContact CB-CB 4.22Å; N64-L69 PolarHBondContact N-O 3.34Å; N64-L69 PolarHBondContact OD1-N 2.93Å; N64-L69 PolarHBondContact OD1-O 3.05Å; N64-W145 HydrophobicContact CB-CB 4.35Å; N64-W145 HydrophobicContact CB-CD2 3.72Å; N64-W145 HydrophobicContact CB-CE3 4Å; N64-W145 HydrophobicContact CB-CG 3.87Å
65	S	84.6	Confident	83.3	Confident	78 Å²	78	31.5 Å²	31.5	55%	0.545	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-23.4	-170.7	52.9	0	0	0	0	115.6	P147	S65-P147 WeakPolarHBondContact CB-O 3.15Å; S65-P147 PolarHBondContact OG-O 2.69Å
66	D	85.7	Confident	84.1	Confident	95 Å²	95	29.1 Å²	29.1	51%	0.508	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.2	2.2	175.4	76.8	-13.9	0	0	0	113.2	N64 S68	N64-D66 VanDerWaalsContact C-N 3.28Å; N64-D66 PolarHBondContact ND2-OD1 2.93Å; N64-D66 PolarHBondContact O-N 2.77Å; N64-D66 PolarHBondContact OD1-OD1 3Å; D66-S68 PolarHBondContact O-N 3.35Å; D66-S68 VanDerWaalsContact O-N 3.16Å; D66-S68 WeakPolarHBondContact OD1-CB 3.17Å; D66-S68 PolarHBondContact OD1-N 3.04Å; D66-S68 PolarHBondContact OD1-OG 2.94Å; D66-S68 PolarHBondContact OD2-OG 3.29Å; D66-S68 VanDerWaalsContact OD2-OG 3.04Å
67	G	86	Confident	84.6	Confident	34 Å²	34	33.9 Å²	33.9	35%	0.351	20%	0.2	S	C	.	.	S	Bend	trans	67.3	6.9	-178.2	0	0	0	0	0	114.7	N64 V87	N64-G67 PolarHBondContact O-N 2.95Å; N64-G67 PolarHBondContact OD1-N 3.16Å; G67-V87 WeakPolarHBondContact O-CB 3.25Å
68	S	86.4	Confident	84.4	Confident	15 Å²	15	39.7 Å²	39.7	11%	0.105	23%	0.231	C	C	.	.	S	Bend	trans	-80.5	-18.3	-178	70	0	0	0	0	113.6	N64 D66 N86 V87	N64-S68 PolarHBondContact ND2-OG 2.73Å; N64-S68 PolarHBondContact OD1-N 2.58Å; D66-S68 PolarHBondContact O-N 3.35Å; D66-S68 VanDerWaalsContact O-N 3.16Å; D66-S68 WeakPolarHBondContact OD1-CB 3.17Å; D66-S68 PolarHBondContact OD1-N 3.04Å; D66-S68 PolarHBondContact OD1-OG 2.94Å; D66-S68 PolarHBondContact OD2-OG 3.29Å; D66-S68 VanDerWaalsContact OD2-OG 3.04Å; S68-N86 PolarHBondContact O-OD1 2.88Å; S68-V87 WeakPolarHBondContact O-CB 3.23Å; S68-V87 PolarHBondContact O-N 2.79Å
69	L	87.4	Confident	83.9	Confident	8 Å²	8	41 Å²	41	4%	0.042	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	135.8	179.2	-58	177.2	0	0	0	110.5	C63 N64 I84 F85 N86 L131 W145 M166	C63-L69 CarbonylContact C-O 3.59Å; C63-L69 VanDerWaalsContact CA-O 3.24Å; C63-L69 WeakPolarHBondContact CA-O 3.42Å; N64-L69 HydrophobicContact CB-CB 4.22Å; N64-L69 PolarHBondContact N-O 3.34Å; N64-L69 PolarHBondContact OD1-N 2.93Å; N64-L69 PolarHBondContact OD1-O 3.05Å; L69-I84 HydrophobicContact CB-CG2 4.3Å; L69-I84 HydrophobicContact CD2-CG2 4.49Å; L69-F85 CarbonylContact C-O 3.57Å; L69-F85 VanDerWaalsContact CA-O 3.25Å; L69-F85 WeakPolarHBondContact CA-O 3.27Å; L69-N86 HydrophobicContact CD2-CB 4.28Å; L69-L131 HydrophobicContact CD2-CD1 3.77Å; L69-W145 HydrophobicContact CB-CH2 4.03Å; L69-W145 HydrophobicContact CB-CZ2 3.92Å; L69-W145 HydrophobicContact CD1-CH2 3.56Å; L69-W145 HydrophobicContact CD1-CZ2 4.31Å; L69-W145 HydrophobicContact CD1-CZ3 3.87Å; L69-W145 HydrophobicContact CG-CH2 4.45Å; L69-M166 HydrophobicContact CD1-SD 4.08Å
70	L	89.1	Confident	83.5	Confident	30 Å²	30	39.4 Å²	39.4	16%	0.157	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	118.9	173.3	174.4	67.5	0	0	0	108.8	V72 I84 F85 V87	L70-V72 HydrophobicContact CD1-CG2 4.48Å; L70-V72 HydrophobicContact CD2-CG2 3.98Å; L70-V72 HydrophobicContact CG-CG2 3.88Å; L70-I84 WeakPolarHBondContact O-CA 3.45Å; L70-F85 HydrophobicContact CB-CB 4.37Å; L70-F85 HydrophobicContact CD2-CD2 4.46Å; L70-F85 PolarHBondContact N-O 2.85Å; L70-F85 PolarHBondContact O-N 2.73Å; L70-V87 HydrophobicContact CB-CG2 3.81Å
71	A	87.1	Confident	83.4	Confident	1 Å²	1	38.3 Å²	38.3	1%	0.008	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	133.1	167.6	0	0	0	0	0	109.6	T61 Q62 I84 V143 W145	T61-A71 CarbonylContact C-O 3.57Å; T61-A71 WeakPolarHBondContact CA-O 3.43Å; Q62-A71 PolarHBondContact N-O 3.22Å; Q62-A71 PolarHBondContact O-N 3.24Å; A71-I84 HydrophobicContact CB-CD1 3.46Å; A71-I84 VanDerWaalsContact CB-CD1 3.46Å; A71-V143 HydrophobicContact CB-CG1 3.86Å; A71-W145 HydrophobicContact CB-CZ2 4.17Å
72	V	87	Confident	83.3	Confident	2 Å²	2	37.8 Å²	37.8	1%	0.012	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	122.7	174.3	179.9	0	0	0	0	108.5	F52 V58 T61 L70 L74 A82 V83 F85	F52-V72 HydrophobicContact CE1-CG1 3.83Å; F52-V72 HydrophobicContact CE1-CG2 4.49Å; F52-V72 HydrophobicContact CZ-CB 4.31Å; F52-V72 HydrophobicContact CZ-CG1 3.94Å; F52-V72 HydrophobicContact CZ-CG2 4.11Å; V58-V72 HydrophobicContact CG1-CG1 3.93Å; V58-V72 HydrophobicContact CG2-CG1 4.39Å; T61-V72 HydrophobicContact CG2-CB 4.39Å; T61-V72 HydrophobicContact CG2-CG1 4.08Å; T61-V72 HydrophobicContact CG2-CG2 4.03Å; L70-V72 HydrophobicContact CD1-CG2 4.48Å; L70-V72 HydrophobicContact CD2-CG2 3.98Å; L70-V72 HydrophobicContact CG-CG2 3.88Å; V72-L74 HydrophobicContact CG1-CD2 3.7Å; V72-L74 HydrophobicContact CG1-CG 4.21Å; V72-A82 CarbonylContact O-C 3.4Å; V72-A82 WeakPolarHBondContact O-CA 3.29Å; V72-V83 PolarHBondContact N-O 3.43Å; V72-V83 PolarHBondContact O-N 2.85Å; V72-F85 HydrophobicContact CB-CD2 4.49Å; V72-F85 HydrophobicContact CB-CE2 3.9Å; V72-F85 HydrophobicContact CG2-CD2 3.85Å; V72-F85 HydrophobicContact CG2-CE2 3.61Å
73	C	85.1	Confident	83.2	Confident	1 Å²	1	37.1 Å²	37.1	1%	0.007	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	124	174.1	-54.4	0	0	0	0	109	V58 V59 W60 V140 V143	V58-C73 WeakPolarHBondContact CA-O 3.45Å; V59-C73 PolarHBondContact N-O 3.27Å; W60-C73 HydrophobicContact CB-CB 3.86Å; W60-C73 PolarHBondContact N-O 3.29Å; W60-C73 PolarHBondContact O-N 2.91Å; C73-V140 HydrophobicContact CB-CG1 4.29Å; C73-V143 WeakPolarHBondContact SG-CG2 3.25Å
74	L	85.6	Confident	83.1	Confident	6 Å²	6	34.3 Å²	34.3	3%	0.031	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	124.6	176.9	-52.2	174.1	0	0	0	108.7	R51 N57 V58 V72 N76 L81 V83	R51-L74 HydrophobicContact CB-CD1 4.41Å; N57-L74 CarbonylContact O-C 3.41Å; N57-L74 WeakPolarHBondContact O-CA 3.19Å; V58-L74 HydrophobicContact CB-CD2 4.18Å; V58-L74 HydrophobicContact CG2-CD2 3.53Å; V72-L74 HydrophobicContact CG1-CD2 3.7Å; V72-L74 HydrophobicContact CG1-CG 4.21Å; L74-N76 PolarHBondContact O-N 3.41Å; L74-L81 HydrophobicContact CB-CB 4.25Å; L74-L81 HydrophobicContact CD1-CD2 4.18Å; L74-L81 PolarHBondContact N-O 3.47Å; L74-L81 PolarHBondContact O-N 3.49Å; L74-V83 HydrophobicContact CD1-CG2 4.37Å
75	N	80.3	Confident	82.9	Confident	74 Å²	74	34.3 Å²	34.3	40%	0.396	20%	0.203	S	C	.	.			trans	-86.6	102.2	164.8	-175.8	9.5	0	0	0	108.2	N57 V59	N57-N75 WeakPolarHBondContact CB-O 3.49Å; N57-N75 PolarHBondContact O-N 3.23Å; V59-N75 HydrophobicContact CG2-CB 3.29Å
76	N	75.8	Confident	82.8	Confident	16 Å²	16	32.7 Å²	32.7	9%	0.086	19%	0.188	C	C	.	.			trans	-105	135.5	164.5	-58.4	-71.9	0	0	0	107.4	R51 N57 L74 D78 S79	R51-N76 PolarHBondContact NH1-ND2 3.33Å; N57-N76 PolarHBondContact ND2-OD1 2.95Å; L74-N76 PolarHBondContact O-N 3.41Å; N76-D78 PolarHBondContact O-N 3.01Å; N76-S79 WeakPolarHBondContact CB-O 3.46Å; N76-S79 CarbonylContact O-C 3.51Å; N76-S79 PolarHBondContact O-N 3.07Å
77	N	77.3	Confident	82.5	Confident	119 Å²	119	29.5 Å²	29.5	64%	0.636	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	-46.4	-34.2	-179.4	-68.8	8.6	0	0	0	113.6	K33	K33-N77 PolarHBondContact NZ-ND2 2.61Å
78	D	75.5	Confident	81.9	Confident	149 Å²	149	35.3 Å²	35.3	80%	0.797	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.3	-18.9	-173.6	-47.6	-50.1	0	0	0	113.5	N76	N76-D78 PolarHBondContact O-N 3.01Å
79	S	72.5	Confident	80.5	Confident	44 Å²	44	36.7 Å²	36.7	31%	0.308	20%	0.196	S	C	.	.			trans	-167	107.4	-177.6	-73.7	0	0	0	0	110.1	N76 L81	N76-S79 WeakPolarHBondContact CB-O 3.46Å; N76-S79 CarbonylContact O-C 3.51Å; N76-S79 PolarHBondContact O-N 3.07Å; S79-L81 PolarHBondContact O-N 2.89Å
80	P	75.5	Confident	78.9	Confident	11 Å²	11	37.4 Å²	37.4	7%	0.071	20%	0.2	C	C	.	.			trans	-53.8	142.4	165.3	31.3	-43.6	0	0	0	110.2	S138 S139 V140	P80-S138 WeakPolarHBondContact CG-O 3.43Å; P80-S139 VanDerWaalsContact CG-CA 3.48Å; P80-V140 HydrophobicContact CB-CB 4.07Å; P80-V140 HydrophobicContact CB-CG2 4.04Å
81	L	81.9	Confident	77	Confident	13 Å²	13	44 Å²	44	7%	0.068	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	112.9	-170.8	-173.4	65.7	0	0	0	109.6	L74 S79 V83 R133	L74-L81 HydrophobicContact CB-CB 4.25Å; L74-L81 HydrophobicContact CD1-CD2 4.18Å; L74-L81 PolarHBondContact N-O 3.47Å; L74-L81 PolarHBondContact O-N 3.49Å; S79-L81 PolarHBondContact O-N 2.89Å; L81-V83 HydrophobicContact CD2-CG2 3.79Å; L81-V83 HydrophobicContact CG-CG2 3.73Å; L81-R133 HydrophobicContact CD1-CG 3.26Å
82	A	84.3	Confident	75.3	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.008	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	127.6	161.5	0	0	0	0	0	109	V72 I134 V143	V72-A82 CarbonylContact O-C 3.4Å; V72-A82 WeakPolarHBondContact O-CA 3.29Å; A82-I134 HydrophobicContact CB-CB 4.19Å; A82-I134 HydrophobicContact CB-CD1 4.09Å; A82-I134 HydrophobicContact CB-CG1 4.45Å; A82-I134 PolarHBondContact O-N 2.89Å; A82-V143 HydrophobicContact CB-CG2 4.12Å
83	V	85.5	Confident	73.3	Confident	10 Å²	10	51.9 Å²	51.9	6%	0.061	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	132.8	175.6	-168.9	0	0	0	0	108.4	V72 L74 L81 F85 A130	V72-V83 PolarHBondContact N-O 3.43Å; V72-V83 PolarHBondContact O-N 2.85Å; L74-V83 HydrophobicContact CD1-CG2 4.37Å; L81-V83 HydrophobicContact CD2-CG2 3.79Å; L81-V83 HydrophobicContact CG-CG2 3.73Å; V83-F85 HydrophobicContact CB-CE1 4.41Å; V83-F85 HydrophobicContact CB-CE2 3.91Å; V83-F85 HydrophobicContact CB-CZ 3.75Å; V83-F85 HydrophobicContact CG1-CD1 4.14Å; V83-F85 HydrophobicContact CG1-CE1 3.5Å; V83-F85 HydrophobicContact CG1-CE2 3.85Å; V83-F85 HydrophobicContact CG1-CZ 3.32Å; V83-A130 HydrophobicContact CG1-CB 4.06Å
84	I	84.8	Confident	71.3	Confident	1 Å²	1	54 Å²	54	1%	0.005	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	125.4	175.2	-50	-54.8	0	0	0	109	L69 L70 A71 L131 W145 F152	L69-I84 HydrophobicContact CB-CG2 4.3Å; L69-I84 HydrophobicContact CD2-CG2 4.49Å; L70-I84 WeakPolarHBondContact O-CA 3.45Å; A71-I84 HydrophobicContact CB-CD1 3.46Å; A71-I84 VanDerWaalsContact CB-CD1 3.46Å; I84-L131 HydrophobicContact CB-CB 4.45Å; I84-L131 HydrophobicContact CG2-CD1 3.96Å; I84-L131 PolarHBondContact O-N 3.24Å; I84-L131 VanDerWaalsContact O-N 3.11Å; I84-W145 HydrophobicContact CD1-CH2 4.37Å; I84-W145 HydrophobicContact CD1-CZ2 3.87Å; I84-W145 HydrophobicContact CG1-CZ2 4.46Å; I84-W145 HydrophobicContact CG2-CH2 3.8Å; I84-W145 HydrophobicContact CG2-CZ2 3.77Å; I84-F152 HydrophobicContact CG1-CE1 4.5Å; I84-F152 HydrophobicContact CG1-CZ 4.36Å
85	F	83.2	Confident	69	Low	13 Å²	13	56.7 Å²	56.7	6%	0.057	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	138.8	179.1	-58.2	-69	0	0	0	110.9	I48 F52 L69 L70 V72 V83 V128	I48-F85 HydrophobicContact CD1-CE1 3.84Å; I48-F85 HydrophobicContact CG1-CE1 4.2Å; I48-F85 HydrophobicContact CG1-CZ 4.42Å; I48-F85 HydrophobicContact CG2-CE1 3.83Å; I48-F85 HydrophobicContact CG2-CZ 3.92Å; F52-F85 HydrophobicContact CE2-CE1 4.35Å; F52-F85 AromaticContact CE2-CE2 3.86Å; F52-F85 HydrophobicContact CE2-CE2 3.86Å; F52-F85 AromaticContact CE2-CZ 3.47Å; F52-F85 HydrophobicContact CE2-CZ 3.47Å; F52-F85 VanDerWaalsContact CE2-CZ 3.47Å; F52-F85 AromaticContact CZ-CE2 3.63Å; F52-F85 HydrophobicContact CZ-CE2 3.63Å; F52-F85 AromaticContact CZ-CZ 3.73Å; F52-F85 HydrophobicContact CZ-CZ 3.73Å; L69-F85 CarbonylContact C-O 3.57Å; L69-F85 VanDerWaalsContact CA-O 3.25Å; L69-F85 WeakPolarHBondContact CA-O 3.27Å; L70-F85 HydrophobicContact CB-CB 4.37Å; L70-F85 HydrophobicContact CD2-CD2 4.46Å; L70-F85 PolarHBondContact N-O 2.85Å; L70-F85 PolarHBondContact O-N 2.73Å; V72-F85 HydrophobicContact CB-CD2 4.49Å; V72-F85 HydrophobicContact CB-CE2 3.9Å; V72-F85 HydrophobicContact CG2-CD2 3.85Å; V72-F85 HydrophobicContact CG2-CE2 3.61Å; V83-F85 HydrophobicContact CB-CE1 4.41Å; V83-F85 HydrophobicContact CB-CE2 3.91Å; V83-F85 HydrophobicContact CB-CZ 3.75Å; V83-F85 HydrophobicContact CG1-CD1 4.14Å; V83-F85 HydrophobicContact CG1-CE1 3.5Å; V83-F85 HydrophobicContact CG1-CE2 3.85Å; V83-F85 HydrophobicContact CG1-CZ 3.32Å; F85-V128 HydrophobicContact CB-CG1 4.23Å; F85-V128 HydrophobicContact CD1-CG1 3.11Å; F85-V128 HydrophobicContact CE1-CG1 3.67Å; F85-V128 HydrophobicContact CG-CG1 3.99Å
86	N	83.2	Confident	67	Low	43 Å²	43	57.2 Å²	57.2	23%	0.23	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	118.8	164.1	-168.3	-28.2	0	0	0	109.5	S68 L69 K88 T89	S68-N86 PolarHBondContact O-OD1 2.88Å; L69-N86 HydrophobicContact CD2-CB 4.28Å; N86-K88 WeakPolarHBondContact OD1-CB 3.03Å; N86-K88 PolarHBondContact OD1-N 3.3Å; N86-T89 HydrophobicContact CB-CG2 4.46Å; N86-T89 PolarHBondContact O-OG1 3.38Å
87	V	79.2	Confident	64.8	Low	29 Å²	29	59 Å²	59	18%	0.176	31%	0.307	C	S	.	.	S	Bend	trans	-80.4	-32.7	-177.1	-176.5	0	0	0	0	110.7	G67 S68 L70 T89 V90 I94	G67-V87 WeakPolarHBondContact O-CB 3.25Å; S68-V87 WeakPolarHBondContact O-CB 3.23Å; S68-V87 PolarHBondContact O-N 2.79Å; L70-V87 HydrophobicContact CB-CG2 3.81Å; V87-T89 PolarHBondContact O-N 2.96Å; V87-V90 WeakPolarHBondContact O-CB 3.37Å; V87-V90 PolarHBondContact O-N 3.17Å; V87-I94 HydrophobicContact CG1-CD1 3.35Å
88	K	72.8	Confident	62.6	Low	155 Å²	155	56.8 Å²	56.8	67%	0.674	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-26.4	-179.3	-70.9	-178	175.6	167.8	0	113	N86 V90	N86-K88 WeakPolarHBondContact OD1-CB 3.03Å; N86-K88 PolarHBondContact OD1-N 3.3Å; K88-V90 PolarHBondContact O-N 3.04Å
89	T	57.3	Low	60.4	Low	45 Å²	45	55.1 Å²	55.1	28%	0.276	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80	-6.4	178.3	52.7	0	0	0	0	112.5	N86 V87 K91 G126 S127	N86-T89 HydrophobicContact CB-CG2 4.46Å; N86-T89 PolarHBondContact O-OG1 3.38Å; V87-T89 PolarHBondContact O-N 2.96Å; T89-K91 PolarHBondContact O-N 3.1Å; T89-G126 CarbonylContact O-C 3.38Å; T89-G126 WeakPolarHBondContact O-CA 3.28Å; T89-S127 WeakPolarHBondContact CB-O 3.17Å; T89-S127 PolarHBondContact O-N 2.9Å; T89-S127 PolarHBondContact OG1-O 3.18Å
90	V	54.5	Low	58.5	Low	23 Å²	23	62.5 Å²	62.5	14%	0.139	31%	0.313	C	S	.	.			trans	-85	96	171.3	-169.7	0	0	0	0	108.3	V87 K88 G92 I94 L108 V124 V128	V87-V90 WeakPolarHBondContact O-CB 3.37Å; V87-V90 PolarHBondContact O-N 3.17Å; K88-V90 PolarHBondContact O-N 3.04Å; V90-G92 VanDerWaalsContact C-N 3.25Å; V90-G92 PolarHBondContact O-N 3.22Å; V90-I94 HydrophobicContact CB-CD1 3.93Å; V90-I94 HydrophobicContact CG1-CD1 4.05Å; V90-I94 HydrophobicContact CG1-CG1 4.41Å; V90-I94 HydrophobicContact CG2-CD1 4.33Å; V90-L108 HydrophobicContact CG1-CD2 3.38Å; V90-V124 HydrophobicContact CG1-CG1 4.2Å; V90-V128 HydrophobicContact CG2-CG2 3.85Å
91	K	48.3	Very low	56.3	Low	167 Å²	167	69.8 Å²	69.8	73%	0.726	35%	0.346	S	S	*	.			trans	-68.3	87.5	168.4	-78.6	-172.3	177.3	179.5	0	108.9	T89 V124	T89-K91 PolarHBondContact O-N 3.1Å; K91-V124 VanDerWaalsContact O-CG1 3.27Å; K91-V124 WeakPolarHBondContact O-CG1 3.39Å
92	G	51.2	Low	54	Low	26 Å²	26	73.6 Å²	73.6	27%	0.268	37%	0.365	S	S	.	.	S	Bend	trans	-177.6	145.2	178.1	0	0	0	0	0	109.4	V90 I94	V90-G92 VanDerWaalsContact C-N 3.25Å; V90-G92 PolarHBondContact O-N 3.22Å; G92-I94 PolarHBondContact O-N 2.79Å
93	K	44.6	Very low	51.7	Low	143 Å²	143	75.7 Å²	75.7	62%	0.622	38%	0.383	S	S	*	.			trans	-69.4	97.1	173.9	-175.3	-170.7	-173.3	-170.8	0	108.1	E95 Q107	K93-E95 HydrophobicContact CD-CG 4Å; K93-E95 WeakPolarHBondContact CD-OE1 3.21Å; K93-E95 WeakPolarHBondContact CE-OE1 3.24Å; K93-E95 HydrophobicContact CG-CG 4.1Å; K93-E95 IonicContact NZ-OE1 2.61Å; K93-E95 PolarHBondContact NZ-OE1 2.82Å; K93-E95 PolarHBondContact O-N 3.08Å; K93-Q107 CarbonylContact C-O 3.34Å
94	I	43.8	Very low	49.4	Very low	46 Å²	46	78.4 Å²	78.4	24%	0.236	39%	0.394	C	S	.	.			trans	-71.4	96.7	173	-69.5	169.7	0	0	0	108	V87 V90 G92 V96 L106 L108	V87-I94 HydrophobicContact CG1-CD1 3.35Å; V90-I94 HydrophobicContact CB-CD1 3.93Å; V90-I94 HydrophobicContact CG1-CD1 4.05Å; V90-I94 HydrophobicContact CG1-CG1 4.41Å; V90-I94 HydrophobicContact CG2-CD1 4.33Å; G92-I94 PolarHBondContact O-N 2.79Å; I94-V96 HydrophobicContact CG2-CG2 3.87Å; I94-V96 PolarHBondContact O-N 3.03Å; I94-L106 HydrophobicContact CB-CD2 4.19Å; I94-L106 HydrophobicContact CD1-CD2 3.75Å; I94-L106 HydrophobicContact CG1-CD2 3.69Å; I94-L106 HydrophobicContact CG2-CD2 3.51Å; I94-L108 HydrophobicContact CG1-CD2 4.18Å
95	E	37.7	Very low	47.1	Very low	62 Å²	62	80.5 Å²	80.5	29%	0.29	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	109.1	163.8	-66.1	-163.8	178.8	0	0	108.3	K93 L97 Q107	K93-E95 HydrophobicContact CD-CG 4Å; K93-E95 WeakPolarHBondContact CD-OE1 3.21Å; K93-E95 WeakPolarHBondContact CE-OE1 3.24Å; K93-E95 HydrophobicContact CG-CG 4.1Å; K93-E95 IonicContact NZ-OE1 2.61Å; K93-E95 PolarHBondContact NZ-OE1 2.82Å; K93-E95 PolarHBondContact O-N 3.08Å; E95-L97 VanDerWaalsContact C-N 3.29Å; E95-L97 HydrophobicContact CB-CD2 4.5Å; E95-L97 HydrophobicContact CB-CG 4.34Å; E95-L97 PolarHBondContact O-N 2.72Å; E95-Q107 HydrophobicContact CB-CB 4.2Å; E95-Q107 PolarHBondContact OE2-OE1 3.23Å
96	V	37.9	Very low	44.8	Very low	85 Å²	85	82.8 Å²	82.8	52%	0.515	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	86.1	171.7	-177.1	0	0	0	0	107.1	I94 S98 F104	I94-V96 HydrophobicContact CG2-CG2 3.87Å; I94-V96 PolarHBondContact O-N 3.03Å; V96-S98 PolarHBondContact O-N 3.48Å; V96-F104 HydrophobicContact CG1-CD1 3.39Å; V96-F104 HydrophobicContact CG1-CE1 3.46Å; V96-F104 VanDerWaalsContact CG1-CE1 3.46Å
97	L	30	Very low	42.8	Very low	54 Å²	54	83.3 Å²	83.3	28%	0.283	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	106.5	174.7	-64.3	176.5	0	0	0	109	E95 F99	E95-L97 VanDerWaalsContact C-N 3.29Å; E95-L97 HydrophobicContact CB-CD2 4.5Å; E95-L97 HydrophobicContact CB-CG 4.34Å; E95-L97 PolarHBondContact O-N 2.72Å; L97-F99 HydrophobicContact CB-CD2 4.12Å; L97-F99 HydrophobicContact CB-CE2 3.52Å; L97-F99 HydrophobicContact CB-CZ 4.1Å; L97-F99 HydrophobicContact CD1-CE2 4.13Å; L97-F99 HydrophobicContact CD1-CZ 4.15Å; L97-F99 HydrophobicContact CG-CE2 4.48Å; L97-F99 PolarHBondContact O-N 2.8Å
98	S	31.5	Very low	40.8	Very low	72 Å²	72	83.1 Å²	83.1	50%	0.503	42%	0.422	S	S	.	.			trans	-76.3	100.7	171.5	-179.3	0	0	0	0	109	F26 V96	F26-S98 WeakPolarHBondContact CZ-OG 3.2Å; V96-S98 PolarHBondContact O-N 3.48Å
99	F	29.3	Very low	39.1	Very low	115 Å²	115	78.8 Å²	78.8	50%	0.504	42%	0.416	S	S	.	.			trans	-85.9	131.5	169.3	-70.6	-80.1	0	0	0	109.6	L97 H101	L97-F99 HydrophobicContact CB-CD2 4.12Å; L97-F99 HydrophobicContact CB-CE2 3.52Å; L97-F99 HydrophobicContact CB-CZ 4.1Å; L97-F99 HydrophobicContact CD1-CE2 4.13Å; L97-F99 HydrophobicContact CD1-CZ 4.15Å; L97-F99 HydrophobicContact CG-CE2 4.48Å; L97-F99 PolarHBondContact O-N 2.8Å; F99-H101 PolarHBondContact O-N 3.03Å
100	K	32.3	Very low	38.2	Very low	199 Å²	199	83.4 Å²	83.4	87%	0.865	44%	0.439	S	S	*	.	S	Bend	trans	-52	-21.6	-172.9	-128.2	175.6	-176.6	178.9	0	113.8
101	H	29.3	Very low	37.1	Very low	163 Å²	163	85 Å²	85	76%	0.755	46%	0.46	S	S	*	.	S	Bend	trans	-147.1	105.1	171	-60.6	-88.5	0	0	0	108.6	F99	F99-H101 PolarHBondContact O-N 3.03Å
102	I	33.9	Very low	36.4	Very low	93 Å²	93	84.5 Å²	84.5	48%	0.477	46%	0.464	S	S	.	.	S	Bend	trans	85.5	129.2	168	-54.8	169.2	0	0	0	116.9	I28	I28-I102 HydrophobicContact CG2-CG2 4.19Å
103	A	36.6	Very low	35.4	Very low	45 Å²	45	91.6 Å²	91.6	37%	0.372	49%	0.488	S	S	.	.			trans	66.2	118.6	159.2	0	0	0	0	0	118.8	A105	A103-A105 PolarHBondContact O-N 2.77Å
104	F	35.6	Very low	34.6	Very low	68 Å²	68	91.8 Å²	91.8	30%	0.298	49%	0.49	S	S	.	.			trans	-61.3	114.2	161.1	-62.1	-85.5	0	0	0	109.3	F26 T61 V96	F26-F104 HydrophobicContact CD2-CE1 4.43Å; F26-F104 HydrophobicContact CD2-CE2 4.01Å; F26-F104 AromaticContact CD2-CZ 3.55Å; F26-F104 HydrophobicContact CD2-CZ 3.55Å; F26-F104 HydrophobicContact CE2-CE1 4.31Å; F26-F104 AromaticContact CE2-CZ 3.83Å; F26-F104 HydrophobicContact CE2-CZ 3.83Å; T61-F104 WeakPolarHBondContact OG1-CD2 3.33Å; T61-F104 WeakPolarHBondContact OG1-CE2 3.37Å; V96-F104 HydrophobicContact CG1-CD1 3.39Å; V96-F104 HydrophobicContact CG1-CE1 3.46Å; V96-F104 VanDerWaalsContact CG1-CE1 3.46Å
105	A	36.7	Very low	34	Very low	44 Å²	44	95.5 Å²	95.5	36%	0.364	52%	0.518	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	114.3	160.1	0	0	0	0	0	107	A103 Q107	A103-A105 PolarHBondContact O-N 2.77Å; A105-Q107 VanDerWaalsContact C-N 3.29Å; A105-Q107 PolarHBondContact O-N 2.78Å
106	L	36.1	Very low	33.7	Very low	62 Å²	62	100.1 Å²	100.1	33%	0.325	54%	0.543	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	93.4	162.2	-81.7	154.7	0	0	0	106.1	I94 L108 I119	I94-L106 HydrophobicContact CB-CD2 4.19Å; I94-L106 HydrophobicContact CD1-CD2 3.75Å; I94-L106 HydrophobicContact CG1-CD2 3.69Å; I94-L106 HydrophobicContact CG2-CD2 3.51Å; L106-L108 PolarHBondContact O-N 2.77Å; L106-I119 HydrophobicContact CB-CD1 3.95Å
107	Q	41.4	Very low	33.3	Very low	53 Å²	53	99 Å²	99	25%	0.248	54%	0.542	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	122.9	168.7	-173.5	171.6	-2.3	0	0	107.3	K93 E95 A105	K93-Q107 CarbonylContact C-O 3.34Å; E95-Q107 HydrophobicContact CB-CB 4.2Å; E95-Q107 PolarHBondContact OE2-OE1 3.23Å; A105-Q107 VanDerWaalsContact C-N 3.29Å; A105-Q107 PolarHBondContact O-N 2.78Å
108	L	37	Very low	33.5	Very low	25 Å²	25	104.2 Å²	104.2	13%	0.131	57%	0.565	C	S	.	*			trans	-112.4	142.1	168.4	-57.2	168.3	0	0	0	105.7	V90 I94 L106 D110 I119 L121 V124	V90-L108 HydrophobicContact CG1-CD2 3.38Å; I94-L108 HydrophobicContact CG1-CD2 4.18Å; L106-L108 PolarHBondContact O-N 2.77Å; L108-D110 PolarHBondContact O-N 3.46Å; L108-I119 HydrophobicContact CD1-CG2 4.02Å; L108-L121 HydrophobicContact CD1-CD2 4.2Å; L108-V124 HydrophobicContact CB-CB 4.24Å; L108-V124 HydrophobicContact CB-CG1 4.07Å; L108-V124 HydrophobicContact CB-CG2 3.24Å; L108-V124 HydrophobicContact CD1-CB 3.98Å; L108-V124 HydrophobicContact CD1-CG1 3.99Å; L108-V124 HydrophobicContact CD1-CG2 3.52Å; L108-V124 HydrophobicContact CD2-CG1 4.02Å; L108-V124 HydrophobicContact CG-CG1 4.2Å; L108-V124 HydrophobicContact CG-CG2 3.87Å
109	A	35.3	Very low	33.5	Very low	65 Å²	65	104.5 Å²	104.5	54%	0.537	56%	0.56	S	S	.	*	S	Bend	trans	-56.2	107	-164.4	0	0	0	0	0	110.1
110	D	39	Very low	33.8	Very low	141 Å²	141	103 Å²	103	75%	0.754	56%	0.562	S	S	*	*	S	Bend	trans	168	90.4	147.5	-76.4	-16.1	0	0	0	107.2	L108 I112	L108-D110 PolarHBondContact O-N 3.46Å; D110-I112 PolarHBondContact O-N 3.29Å
111	G	32.3	Very low	34.1	Very low	57 Å²	57	96.8 Å²	96.8	59%	0.588	54%	0.538	S	S	*	.			trans	-61.4	115.7	-161.9	0	0	0	0	0	115.1
112	I	32.3	Very low	34.8	Very low	156 Å²	156	93.3 Å²	93.3	80%	0.8	53%	0.532	S	S	*	.			trans	-138.9	124.5	153.7	-60.1	-177.7	0	0	0	108.3	D110 Q114	D110-I112 PolarHBondContact O-N 3.29Å; I112-Q114 PolarHBondContact O-N 2.84Å
113	F	31.4	Very low	35.2	Very low	176 Å²	176	95.1 Å²	95.1	77%	0.772	54%	0.542	S	S	*	.			trans	-84.4	105.2	178.3	-73.7	-95	0	0	0	110.1
114	Q	27.7	Very low	35.6	Very low	146 Å²	146	94.1 Å²	94.1	68%	0.682	53%	0.532	S	S	*	.			trans	-136.8	130.5	156.7	-70.9	-157.3	-8.9	0	0	111.4	I112 I116 A117	I112-Q114 PolarHBondContact O-N 2.84Å; Q114-I116 PolarHBondContact O-N 2.94Å; Q114-A117 HydrophobicContact CB-CB 4.35Å
115	P	30.3	Very low	36.2	Very low	125 Å²	125	95.1 Å²	95.1	81%	0.812	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68	122.1	176.4	27.8	-30	0	0	0	109.1
116	I	32	Very low	37	Very low	158 Å²	158	93.9 Å²	93.9	81%	0.81	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.5	27.5	171.8	-38.3	163.9	0	0	0	115	Q114	Q114-I116 PolarHBondContact O-N 2.94Å
117	A	30.1	Very low	37.9	Very low	61 Å²	61	94.6 Å²	94.6	50%	0.504	55%	0.554	S	S	.	*			trans	-90.1	118	163	0	0	0	0	0	109	Q114	Q114-A117 HydrophobicContact CB-CB 4.35Å
118	Q	33	Very low	38.9	Very low	165 Å²	165	94.3 Å²	94.3	77%	0.771	56%	0.556	S	S	*	*			trans	5.1	122.9	152.3	-65.4	166	-20.1	0	0	114	P120	Q118-P120 VanDerWaalsContact C-CD 3.47Å; Q118-P120 WeakPolarHBondContact O-CD 3.47Å
119	I	33.1	Very low	40.6	Very low	77 Å²	77	96.5 Å²	96.5	40%	0.395	57%	0.571	S	S	.	*			trans	-82.3	97	162.2	-58.4	163.6	0	0	0	105.5	L106 L108 L121	L106-I119 HydrophobicContact CB-CD1 3.95Å; L108-I119 HydrophobicContact CD1-CG2 4.02Å; I119-L121 HydrophobicContact CG2-CD2 4.36Å; I119-L121 HydrophobicContact CG2-CG 4.3Å; I119-L121 PolarHBondContact O-N 2.9Å
120	P	34.6	Very low	42.6	Very low	83 Å²	83	94.4 Å²	94.4	54%	0.539	55%	0.553	S	S	.	*			trans	-64.6	107	163.8	28.9	-33.4	0	0	0	106.2	Q118 S122	Q118-P120 VanDerWaalsContact C-CD 3.47Å; Q118-P120 WeakPolarHBondContact O-CD 3.47Å; P120-S122 PolarHBondContact O-N 3.35Å
121	L	39.4	Very low	44.4	Very low	70 Å²	70	91.2 Å²	91.2	37%	0.366	54%	0.536	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	13.8	170.4	-77.7	163.8	0	0	0	112	V49 L108 I119	V49-L121 HydrophobicContact CB-CD1 4.46Å; V49-L121 HydrophobicContact CG2-CB 4.28Å; V49-L121 HydrophobicContact CG2-CD1 3.43Å; V49-L121 VanDerWaalsContact CG2-CD1 3.43Å; V49-L121 HydrophobicContact CG2-CG 4.4Å; L108-L121 HydrophobicContact CD1-CD2 4.2Å; I119-L121 HydrophobicContact CG2-CD2 4.36Å; I119-L121 HydrophobicContact CG2-CG 4.3Å; I119-L121 PolarHBondContact O-N 2.9Å
122	S	43	Very low	46.8	Very low	89 Å²	89	89.6 Å²	89.6	62%	0.622	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-34.9	-176	61.3	0	0	0	0	113.5	P120	P120-S122 PolarHBondContact O-N 3.35Å
123	D	42.1	Very low	49.1	Very low	131 Å²	131	89.2 Å²	89.2	70%	0.701	51%	0.508	S	S	*	.	S	Bend	trans	-100.8	2.5	-165.9	-68.2	5.8	0	0	0	113.3
124	V	44.7	Very low	51.4	Low	24 Å²	24	81.1 Å²	81.1	15%	0.145	47%	0.473	C	S	.	.			trans	-109.4	107.1	-173.8	-171.9	0	0	0	0	107.1	V90 K91 L108 G126	V90-V124 HydrophobicContact CG1-CG1 4.2Å; K91-V124 VanDerWaalsContact O-CG1 3.27Å; K91-V124 WeakPolarHBondContact O-CG1 3.39Å; L108-V124 HydrophobicContact CB-CB 4.24Å; L108-V124 HydrophobicContact CB-CG1 4.07Å; L108-V124 HydrophobicContact CB-CG2 3.24Å; L108-V124 HydrophobicContact CD1-CB 3.98Å; L108-V124 HydrophobicContact CD1-CG1 3.99Å; L108-V124 HydrophobicContact CD1-CG2 3.52Å; L108-V124 HydrophobicContact CD2-CG1 4.02Å; L108-V124 HydrophobicContact CG-CG1 4.2Å; L108-V124 HydrophobicContact CG-CG2 3.87Å; V124-G126 PolarHBondContact O-N 2.99Å
125	A	48.4	Very low	53.3	Low	89 Å²	89	76.7 Å²	76.7	74%	0.736	47%	0.466	S	S	*	.			trans	-69.7	45.4	178.3	0	0	0	0	0	112.8
126	G	52.9	Low	55.5	Low	19 Å²	19	73 Å²	73	20%	0.196	45%	0.45	C	S	.	.			trans	-120.5	127	174.1	0	0	0	0	0	110.5	T89 V124 V128	T89-G126 CarbonylContact O-C 3.38Å; T89-G126 WeakPolarHBondContact O-CA 3.28Å; V124-G126 PolarHBondContact O-N 2.99Å; G126-V128 PolarHBondContact O-N 3.21Å
127	S	55.9	Low	57.9	Low	76 Å²	76	74.2 Å²	74.2	53%	0.531	46%	0.459	S	S	.	.			trans	-82.1	115.2	173.8	74.3	0	0	0	0	108.9	T89 T129	T89-S127 WeakPolarHBondContact CB-O 3.17Å; T89-S127 PolarHBondContact O-N 2.9Å; T89-S127 PolarHBondContact OG1-O 3.18Å; S127-T129 PolarHBondContact O-N 3.28Å
128	V	62.4	Low	60.5	Low	47 Å²	47	72 Å²	72	29%	0.285	44%	0.44	S	S	.	.			trans	-78.8	104.4	166.2	176.4	0	0	0	0	107.6	F85 V90 G126	F85-V128 HydrophobicContact CB-CG1 4.23Å; F85-V128 HydrophobicContact CD1-CG1 3.11Å; F85-V128 HydrophobicContact CE1-CG1 3.67Å; F85-V128 HydrophobicContact CG-CG1 3.99Å; V90-V128 HydrophobicContact CG2-CG2 3.85Å; G126-V128 PolarHBondContact O-N 3.21Å
129	T	73.4	Confident	63.1	Low	71 Å²	71	65.6 Å²	65.6	44%	0.436	41%	0.413	S	S	.	.			trans	-92.3	114.5	174.9	-44	0	0	0	0	108.6	S127 L131	S127-T129 PolarHBondContact O-N 3.28Å; T129-L131 PolarHBondContact O-N 3.24Å
130	A	75.6	Confident	65.7	Low	21 Å²	21	62.4 Å²	62.4	17%	0.174	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	120.6	168	0	0	0	0	0	108.8	L44 I48 V83 G132	L44-A130 HydrophobicContact CD2-CB 3.54Å; L44-A130 HydrophobicContact CG-CB 4.23Å; I48-A130 HydrophobicContact CD1-CB 3.9Å; V83-A130 HydrophobicContact CG1-CB 4.06Å; A130-G132 VanDerWaalsContact C-N 3.32Å
131	L	78.3	Confident	68.2	Low	74 Å²	74	61 Å²	61	39%	0.387	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	-24.5	-175.7	-65.9	179.1	0	0	0	112.9	L69 I84 T129	L69-L131 HydrophobicContact CD2-CD1 3.77Å; I84-L131 HydrophobicContact CB-CB 4.45Å; I84-L131 HydrophobicContact CG2-CD1 3.96Å; I84-L131 PolarHBondContact O-N 3.24Å; I84-L131 VanDerWaalsContact O-N 3.11Å; T129-L131 PolarHBondContact O-N 3.24Å
132	G	82.1	Confident	70.4	Confident	24 Å²	24	58 Å²	58	25%	0.247	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	176.6	172.5	178.5	0	0	0	0	0	112.1	A130	A130-G132 VanDerWaalsContact C-N 3.32Å
133	R	80.5	Confident	72.5	Confident	148 Å²	148	53.8 Å²	53.8	56%	0.558	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.3	127.3	177.9	-172.6	175.6	172.8	-179.5	-5	108.7	L81	L81-R133 HydrophobicContact CD1-CG 3.26Å
134	I	79.5	Confident	74.8	Confident	6 Å²	6	48 Å²	48	3%	0.031	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	105.9	171.9	-49.4	-179.7	0	0	0	106.9	A82 F152 V154 Y164	A82-I134 HydrophobicContact CB-CB 4.19Å; A82-I134 HydrophobicContact CB-CD1 4.09Å; A82-I134 HydrophobicContact CB-CG1 4.45Å; A82-I134 PolarHBondContact O-N 2.89Å; I134-F152 HydrophobicContact CD1-CD2 4.43Å; I134-F152 HydrophobicContact CD1-CE2 3.16Å; I134-F152 HydrophobicContact CD1-CZ 3.37Å; I134-V154 HydrophobicContact CD1-CG2 4.02Å; I134-Y164 HydrophobicContact CD1-CD2 4.21Å; I134-Y164 HydrophobicContact CD1-CE2 4.23Å; I134-Y164 HydrophobicContact CD1-CG 4.39Å; I134-Y164 HydrophobicContact CG2-CE1 4.01Å; I134-Y164 HydrophobicContact CG2-CE2 3.79Å; I134-Y164 WeakPolarHBondContact CG2-OH 3.34Å
135	G	67.8	Low	77	Confident	52 Å²	52	47.3 Å²	47.3	54%	0.536	30%	0.304	S	S	.	.			trans	-129.4	137.7	177.6	0	0	0	0	0	109.5
136	G	75.9	Confident	79	Confident	47 Å²	47	43.6 Å²	43.6	49%	0.485	27%	0.272	S	S	.	.			trans	-151.1	-177.8	171.6	0	0	0	0	0	108.9	S138	G136-S138 PolarHBondContact O-N 2.95Å; G136-S138 VanDerWaalsContact O-N 3.1Å
137	N	82.7	Confident	80.4	Confident	184 Å²	184	43.6 Å²	43.6	98%	0.984	27%	0.269	S	S	*	.	S	Bend	trans	-76.7	9.9	-177.9	-63.4	-9	0	0	0	113.7
138	S	86	Confident	81.9	Confident	15 Å²	15	47.4 Å²	47.4	11%	0.105	28%	0.276	C	S	.	.	S	Bend	trans	-142.1	133.7	-164.3	-172	0	0	0	0	111.1	P80 G136 V140 Q157 D158	P80-S138 WeakPolarHBondContact CG-O 3.43Å; G136-S138 PolarHBondContact O-N 2.95Å; G136-S138 VanDerWaalsContact O-N 3.1Å; S138-V140 PolarHBondContact O-N 2.84Å; S138-Q157 PolarHBondContact OG-N 3.45Å; S138-D158 WeakPolarHBondContact CB-OD2 3.21Å; S138-D158 PolarHBondContact OG-N 3.03Å; S138-D158 VanDerWaalsContact OG-N 3.16Å; S138-D158 PolarHBondContact OG-OD2 2.75Å
139	S	87	Confident	83.1	Confident	30 Å²	30	45.3 Å²	45.3	21%	0.21	26%	0.263	C	S	.	.			trans	-58.8	131.4	-174.8	-53	0	0	0	0	112.5	P80 L141 L156 Q157	P80-S139 VanDerWaalsContact CG-CA 3.48Å; S139-L141 PolarHBondContact O-N 3.46Å; S139-L156 CarbonylContact O-C 3.25Å; S139-L156 VanDerWaalsContact O-CA 3.3Å; S139-L156 WeakPolarHBondContact O-CA 3.14Å; S139-Q157 WeakPolarHBondContact O-CB 3.36Å; S139-Q157 PolarHBondContact O-N 2.86Å; S139-Q157 PolarHBondContact OG-OE1 2.73Å
140	V	87.1	Confident	83.9	Confident	10 Å²	10	48.3 Å²	48.3	6%	0.061	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	119.7	171.8	173.3	0	0	0	0	107.9	C73 P80 S138 V143 V154 L156	C73-V140 HydrophobicContact CB-CG1 4.29Å; P80-V140 HydrophobicContact CB-CB 4.07Å; P80-V140 HydrophobicContact CB-CG2 4.04Å; S138-V140 PolarHBondContact O-N 2.84Å; V140-V143 HydrophobicContact CG1-CG2 4.1Å; V140-V154 HydrophobicContact CB-CG1 4.12Å; V140-V154 HydrophobicContact CG1-CG1 3.42Å; V140-V154 VanDerWaalsContact CG1-CG1 3.42Å; V140-V154 HydrophobicContact CG2-CG1 3.68Å; V140-L156 HydrophobicContact CG2-CD2 3.85Å
141	L	86.7	Confident	84.8	Confident	55 Å²	55	49.2 Å²	49.2	29%	0.288	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	-37.9	179.3	-61.8	-175.6	0	0	0	111.9	L14 S139 G155 Q157	L14-L141 HydrophobicContact CB-CD1 4.46Å; S139-L141 PolarHBondContact O-N 3.46Å; L141-G155 PolarHBondContact N-O 3.01Å; L141-Q157 HydrophobicContact CD1-CB 4.41Å; L141-Q157 HydrophobicContact CD2-CB 4.28Å; L141-Q157 HydrophobicContact CG-CB 4.28Å
142	C	85.4	Confident	85.4	Confident	5 Å²	5	45.7 Å²	45.7	3%	0.034	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	159.9	-177.5	64.5	0	0	0	0	111.5	L14 V154 G155	L14-C142 VanDerWaalsContact O-CB 3.31Å; L14-C142 WeakPolarHBondContact O-CB 3.25Å; L14-C142 PolarHBondContact O-SG 3.29Å; C142-V154 WeakPolarHBondContact O-CA 3.46Å; C142-G155 PolarHBondContact N-O 3.44Å; C142-G155 PolarHBondContact O-N 3.47Å
143	V	88.2	Confident	85.9	Confident	2 Å²	2	44.6 Å²	44.6	1%	0.012	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	142	172.1	170.1	0	0	0	0	107.8	W60 Q62 A71 C73 A82 V140 F152 A153 V154	W60-V143 PolarHBondContact NE1-O 2.82Å; Q62-V143 PolarHBondContact OE1-O 2.77Å; A71-V143 HydrophobicContact CB-CG1 3.86Å; C73-V143 WeakPolarHBondContact SG-CG2 3.25Å; A82-V143 HydrophobicContact CB-CG2 4.12Å; V140-V143 HydrophobicContact CG1-CG2 4.1Å; V143-F152 HydrophobicContact CG1-CD2 4.12Å; V143-A153 CarbonylContact C-O 3.5Å; V143-A153 VanDerWaalsContact CA-O 3.28Å; V143-A153 WeakPolarHBondContact CA-O 3.47Å; V143-V154 HydrophobicContact CG2-CB 4.3Å; V143-V154 HydrophobicContact CG2-CG1 3.94Å; V143-V154 HydrophobicContact CG2-CG2 3.94Å
144	D	90.4	Very high	86.4	Confident	9 Å²	9	37.5 Å²	37.5	5%	0.048	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	146.9	171.7	-167.2	18.9	0	0	0	112.6	V16 C17 F18 Q62 F152 A153	V16-D144 HydrophobicContact CB-CB 4.03Å; V16-D144 HydrophobicContact CG1-CB 3.89Å; V16-D144 VanDerWaalsContact O-CB 3.26Å; V16-D144 WeakPolarHBondContact O-CB 3.33Å; V16-D144 VanDerWaalsContact O-OD2 3.07Å; C17-D144 VanDerWaalsContact C-OD2 3.29Å; C17-D144 WeakPolarHBondContact CA-OD2 3.16Å; F18-D144 HydrophobicContact CD2-CB 4.1Å; F18-D144 VanDerWaalsContact CD2-OD2 3.29Å; F18-D144 WeakPolarHBondContact CD2-OD2 3.02Å; F18-D144 HydrophobicContact CE2-CB 4.29Å; F18-D144 WeakPolarHBondContact CE2-O 3.47Å; F18-D144 PolarHBondContact N-OD2 2.86Å; Q62-D144 VanDerWaalsContact CD-OD1 3.29Å; Q62-D144 PolarHBondContact NE2-OD1 2.91Å; Q62-D144 VanDerWaalsContact OE1-CA 3.3Å; Q62-D144 PolarHBondContact OE1-OD1 2.93Å; D144-F152 CarbonylContact O-C 3.58Å; D144-F152 WeakPolarHBondContact O-CA 3.07Å; D144-F152 WeakPolarHBondContact O-CB 3.4Å; D144-A153 PolarHBondContact N-O 3.48Å; D144-A153 PolarHBondContact O-N 3.34Å
145	W	91.2	Very high	86.9	Confident	10 Å²	10	37.2 Å²	37.2	4%	0.038	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	137.1	-177.8	-73.6	95.5	0	0	0	111.8	F18 Q62 N64 L69 A71 I84 F152	F18-W145 WeakPolarHBondContact CD2-O 2.91Å; F18-W145 WeakPolarHBondContact CG-O 3.49Å; Q62-W145 PolarHBondContact O-NE1 2.91Å; N64-W145 HydrophobicContact CB-CB 4.35Å; N64-W145 HydrophobicContact CB-CD2 3.72Å; N64-W145 HydrophobicContact CB-CE3 4Å; N64-W145 HydrophobicContact CB-CG 3.87Å; L69-W145 HydrophobicContact CB-CH2 4.03Å; L69-W145 HydrophobicContact CB-CZ2 3.92Å; L69-W145 HydrophobicContact CD1-CH2 3.56Å; L69-W145 HydrophobicContact CD1-CZ2 4.31Å; L69-W145 HydrophobicContact CD1-CZ3 3.87Å; L69-W145 HydrophobicContact CG-CH2 4.45Å; A71-W145 HydrophobicContact CB-CZ2 4.17Å; I84-W145 HydrophobicContact CD1-CH2 4.37Å; I84-W145 HydrophobicContact CD1-CZ2 3.87Å; I84-W145 HydrophobicContact CG1-CZ2 4.46Å; I84-W145 HydrophobicContact CG2-CH2 3.8Å; I84-W145 HydrophobicContact CG2-CZ2 3.77Å; W145-F152 HydrophobicContact CD2-CB 3.83Å; W145-F152 HydrophobicContact CE3-CB 3.65Å; W145-F152 HydrophobicContact CE3-CD1 4.14Å; W145-F152 HydrophobicContact CE3-CG 4.26Å; W145-F152 HydrophobicContact CG-CB 4.31Å; W145-F152 AromaticContact CH2-CD1 3.8Å; W145-F152 HydrophobicContact CH2-CD1 3.8Å; W145-F152 HydrophobicContact CH2-CE1 4.41Å; W145-F152 HydrophobicContact CH2-CG 4.34Å; W145-F152 HydrophobicContact CZ2-CD1 4.5Å; W145-F152 HydrophobicContact CZ3-CB 4.04Å; W145-F152 AromaticContact CZ3-CD1 3.6Å; W145-F152 HydrophobicContact CZ3-CD1 3.6Å; W145-F152 HydrophobicContact CZ3-CG 4.15Å
146	S	89.1	Confident	88	Confident	10 Å²	10	35.9 Å²	35.9	7%	0.07	19%	0.193	C	C	.	.			trans	-55.8	149.9	166.6	64.9	0	0	0	0	110.3	K148 G149 K150 Q151	S146-K148 PolarHBondContact O-N 2.82Å; S146-G149 WeakPolarHBondContact O-CA 3.37Å; S146-G149 PolarHBondContact O-N 2.92Å; S146-G149 PolarHBondContact OG-N 3.15Å; S146-K150 PolarHBondContact OG-N 2.79Å; S146-Q151 VanDerWaalsContact CB-O 3.25Å; S146-Q151 WeakPolarHBondContact CB-O 3.2Å; S146-Q151 PolarHBondContact N-O 3.01Å; S146-Q151 PolarHBondContact OG-N 3.29Å; S146-Q151 PolarHBondContact OG-O 3.44Å
147	P	83.2	Confident	88.6	Confident	19 Å²	19	39.5 Å²	39.5	12%	0.123	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-27.3	-176.3	-28	38.2	0	0	0	113.9	F18 R20 S65 G149	F18-P147 HydrophobicContact CB-CG 4.02Å; R20-P147 HydrophobicContact CG-CB 3.99Å; R20-P147 HydrophobicContact CG-CG 4.15Å; S65-P147 WeakPolarHBondContact CB-O 3.15Å; S65-P147 PolarHBondContact OG-O 2.69Å; P147-G149 VanDerWaalsContact C-N 3.34Å
148	K	86.9	Confident	88.8	Confident	157 Å²	157	34.3 Å²	34.3	68%	0.683	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.2	-0.9	178	-63.8	179.4	179.9	169.3	0	112.7	S146 K150	S146-K148 PolarHBondContact O-N 2.82Å; K148-K150 HydrophobicContact CB-CG 4.18Å; K148-K150 PolarHBondContact O-N 2.78Å
149	G	88.4	Confident	88.8	Confident	2 Å²	2	34.4 Å²	34.4	2%	0.021	17%	0.173	C	C	.	.	S	Bend	trans	65.4	3.7	-176.9	0	0	0	0	0	115	S146 P147 M166	S146-G149 WeakPolarHBondContact O-CA 3.37Å; S146-G149 PolarHBondContact O-N 2.92Å; S146-G149 PolarHBondContact OG-N 3.15Å; P147-G149 VanDerWaalsContact C-N 3.34Å; G149-M166 VanDerWaalsContact O-CE 3.27Å; G149-M166 WeakPolarHBondContact O-CE 3.21Å; G149-M166 WeakPolarHBondContact O-CG 3.46Å
150	K	90.7	Very high	88.9	Confident	134 Å²	134	33.9 Å²	33.9	58%	0.583	17%	0.169	S	C	*	.	S	Bend	trans	-78	-22.9	-174.1	-66.3	-171	177.8	-173.1	0	114	S146 K148 M166	S146-K150 PolarHBondContact OG-N 2.79Å; K148-K150 HydrophobicContact CB-CG 4.18Å; K148-K150 PolarHBondContact O-N 2.78Å; K150-M166 HydrophobicContact CB-CE 4.31Å; K150-M166 HydrophobicContact CG-CE 4.06Å; K150-M166 VanDerWaalsContact O-CG 3.29Å; K150-M166 WeakPolarHBondContact O-CG 3.04Å; K150-M166 PolarHBondContact O-N 2.75Å
151	Q	93.8	Very high	89.2	Confident	40 Å²	40	33.5 Å²	33.5	19%	0.187	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	162.9	-177.9	-61.8	174.8	8.2	0	0	108.7	S146 Y164	S146-Q151 VanDerWaalsContact CB-O 3.25Å; S146-Q151 WeakPolarHBondContact CB-O 3.2Å; S146-Q151 PolarHBondContact N-O 3.01Å; S146-Q151 PolarHBondContact OG-N 3.29Å; S146-Q151 PolarHBondContact OG-O 3.44Å; Q151-Y164 WeakPolarHBondContact CA-O 3.39Å; Q151-Y164 VanDerWaalsContact CB-O 3.28Å; Q151-Y164 WeakPolarHBondContact CB-O 2.85Å
152	F	91.2	Very high	89.4	Confident	1 Å²	1	31.3 Å²	31.3	0%	0.004	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	157	171.3	63.2	-86.8	0	0	0	108.9	I84 I134 V143 D144 W145 V154 Y164 K165	I84-F152 HydrophobicContact CG1-CE1 4.5Å; I84-F152 HydrophobicContact CG1-CZ 4.36Å; I134-F152 HydrophobicContact CD1-CD2 4.43Å; I134-F152 HydrophobicContact CD1-CE2 3.16Å; I134-F152 HydrophobicContact CD1-CZ 3.37Å; V143-F152 HydrophobicContact CG1-CD2 4.12Å; D144-F152 CarbonylContact O-C 3.58Å; D144-F152 WeakPolarHBondContact O-CA 3.07Å; D144-F152 WeakPolarHBondContact O-CB 3.4Å; W145-F152 HydrophobicContact CD2-CB 3.83Å; W145-F152 HydrophobicContact CE3-CB 3.65Å; W145-F152 HydrophobicContact CE3-CD1 4.14Å; W145-F152 HydrophobicContact CE3-CG 4.26Å; W145-F152 HydrophobicContact CG-CB 4.31Å; W145-F152 AromaticContact CH2-CD1 3.8Å; W145-F152 HydrophobicContact CH2-CD1 3.8Å; W145-F152 HydrophobicContact CH2-CE1 4.41Å; W145-F152 HydrophobicContact CH2-CG 4.34Å; W145-F152 HydrophobicContact CZ2-CD1 4.5Å; W145-F152 HydrophobicContact CZ3-CB 4.04Å; W145-F152 AromaticContact CZ3-CD1 3.6Å; W145-F152 HydrophobicContact CZ3-CD1 3.6Å; W145-F152 HydrophobicContact CZ3-CG 4.15Å; F152-V154 HydrophobicContact CD2-CG2 3.95Å; F152-V154 HydrophobicContact CE2-CG2 3.76Å; F152-Y164 HydrophobicContact CD2-CD2 4.36Å; F152-Y164 AromaticContact CE2-CD2 3.7Å; F152-Y164 HydrophobicContact CE2-CD2 3.7Å; F152-Y164 AromaticContact CE2-CG 3.87Å; F152-Y164 HydrophobicContact CE2-CG 3.87Å; F152-Y164 HydrophobicContact CZ-CD2 4.13Å; F152-Y164 AromaticContact CZ-CG 3.8Å; F152-Y164 HydrophobicContact CZ-CG 3.8Å; F152-Y164 PolarHBondContact N-O 2.88Å; F152-Y164 VanDerWaalsContact N-O 3.08Å; F152-Y164 PolarHBondContact O-N 3.05Å; F152-K165 WeakPolarHBondContact CE1-O 3.31Å
153	A	92.5	Very high	89.8	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	148.2	179.4	0	0	0	0	0	109.5	V16 F18 V143 D144 I161 V162 F200	V16-A153 HydrophobicContact CG1-CB 3.96Å; F18-A153 HydrophobicContact CE2-CB 4.01Å; F18-A153 HydrophobicContact CZ-CB 4.05Å; V143-A153 CarbonylContact C-O 3.5Å; V143-A153 VanDerWaalsContact CA-O 3.28Å; V143-A153 WeakPolarHBondContact CA-O 3.47Å; D144-A153 PolarHBondContact N-O 3.48Å; D144-A153 PolarHBondContact O-N 3.34Å; A153-I161 HydrophobicContact CB-CG2 3.95Å; A153-V162 CarbonylContact C-O 3.57Å; A153-V162 WeakPolarHBondContact CA-O 3.49Å; A153-F200 HydrophobicContact CB-CE2 4.21Å; A153-F200 HydrophobicContact CB-CZ 4.03Å
154	V	90.8	Very high	90	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	120.8	-179.4	-171.7	0	0	0	0	108	I134 V140 C142 V143 F152 L156 I161 V162 Y164	I134-V154 HydrophobicContact CD1-CG2 4.02Å; V140-V154 HydrophobicContact CB-CG1 4.12Å; V140-V154 HydrophobicContact CG1-CG1 3.42Å; V140-V154 VanDerWaalsContact CG1-CG1 3.42Å; V140-V154 HydrophobicContact CG2-CG1 3.68Å; C142-V154 WeakPolarHBondContact O-CA 3.46Å; V143-V154 HydrophobicContact CG2-CB 4.3Å; V143-V154 HydrophobicContact CG2-CG1 3.94Å; V143-V154 HydrophobicContact CG2-CG2 3.94Å; F152-V154 HydrophobicContact CD2-CG2 3.95Å; F152-V154 HydrophobicContact CE2-CG2 3.76Å; V154-L156 HydrophobicContact CG1-CD2 4.03Å; V154-I161 WeakPolarHBondContact O-CA 3.28Å; V154-V162 PolarHBondContact N-O 3.13Å; V154-V162 PolarHBondContact O-N 3.05Å; V154-Y164 HydrophobicContact CB-CE2 4.03Å; V154-Y164 HydrophobicContact CG2-CD2 3.64Å; V154-Y164 HydrophobicContact CG2-CE2 3.49Å; V154-Y164 VanDerWaalsContact CG2-CE2 3.49Å
155	G	89.6	Confident	90.2	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	128.1	172.8	0	0	0	0	0	111.1	L14 L141 C142	L14-G155 VanDerWaalsContact CD2-CA 3.47Å; L141-G155 PolarHBondContact N-O 3.01Å; C142-G155 PolarHBondContact N-O 3.44Å; C142-G155 PolarHBondContact O-N 3.47Å
156	L	90.1	Very high	90.1	Very high	23 Å²	23	39.4 Å²	39.4	12%	0.12	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	160.4	-178.2	-56.9	-178.1	0	0	0	111.8	S139 V140 V154 D158 G159 S160 V162	S139-L156 CarbonylContact O-C 3.25Å; S139-L156 VanDerWaalsContact O-CA 3.3Å; S139-L156 WeakPolarHBondContact O-CA 3.14Å; V140-L156 HydrophobicContact CG2-CD2 3.85Å; V154-L156 HydrophobicContact CG1-CD2 4.03Å; L156-D158 VanDerWaalsContact C-N 3.27Å; L156-D158 PolarHBondContact O-N 2.76Å; L156-G159 WeakPolarHBondContact O-CA 3.42Å; L156-G159 PolarHBondContact O-N 3.48Å; L156-S160 WeakPolarHBondContact CB-O 3.41Å; L156-S160 PolarHBondContact N-O 2.83Å; L156-V162 HydrophobicContact CD1-CG2 3.8Å; L156-V162 HydrophobicContact CG-CG2 4.48Å
157	Q	88.4	Confident	90.1	Very high	124 Å²	124	43.2 Å²	43.2	58%	0.579	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-27.4	-178.5	-178.2	177.3	16.9	0	0	113.2	S138 S139 L141 G159	S138-Q157 PolarHBondContact OG-N 3.45Å; S139-Q157 WeakPolarHBondContact O-CB 3.36Å; S139-Q157 PolarHBondContact O-N 2.86Å; S139-Q157 PolarHBondContact OG-OE1 2.73Å; L141-Q157 HydrophobicContact CD1-CB 4.41Å; L141-Q157 HydrophobicContact CD2-CB 4.28Å; L141-Q157 HydrophobicContact CG-CB 4.28Å; Q157-G159 PolarHBondContact O-N 3.43Å
158	D	87	Confident	90.4	Very high	75 Å²	75	43.4 Å²	43.4	40%	0.401	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-1.3	170.7	58.2	36.8	0	0	0	113.4	S138 L156 S160	S138-D158 WeakPolarHBondContact CB-OD2 3.21Å; S138-D158 PolarHBondContact OG-N 3.03Å; S138-D158 VanDerWaalsContact OG-N 3.16Å; S138-D158 PolarHBondContact OG-OD2 2.75Å; L156-D158 VanDerWaalsContact C-N 3.27Å; L156-D158 PolarHBondContact O-N 2.76Å; D158-S160 VanDerWaalsContact C-N 3.29Å; D158-S160 WeakPolarHBondContact OD1-CA 3.02Å; D158-S160 WeakPolarHBondContact OD1-CB 3.47Å; D158-S160 PolarHBondContact OD1-N 3.45Å; D158-S160 PolarHBondContact OD1-OG 3.2Å
159	G	87.3	Confident	90.7	Very high	16 Å²	16	41 Å²	41	17%	0.165	20%	0.204	C	C	.	.	S	Bend	trans	83.3	0.1	-178.9	0	0	0	0	0	114.1	L156 Q157	L156-G159 WeakPolarHBondContact O-CA 3.42Å; L156-G159 PolarHBondContact O-N 3.48Å; Q157-G159 PolarHBondContact O-N 3.43Å
160	S	89.4	Confident	90.9	Very high	19 Å²	19	45 Å²	45	13%	0.133	23%	0.227	C	C	.	.			trans	-72.8	151	172.5	-47.2	0	0	0	0	110.5	L156 D158 F174	L156-S160 WeakPolarHBondContact CB-O 3.41Å; L156-S160 PolarHBondContact N-O 2.83Å; D158-S160 VanDerWaalsContact C-N 3.29Å; D158-S160 WeakPolarHBondContact OD1-CA 3.02Å; D158-S160 WeakPolarHBondContact OD1-CB 3.47Å; D158-S160 PolarHBondContact OD1-N 3.45Å; D158-S160 PolarHBondContact OD1-OG 3.2Å; S160-F174 CarbonylContact C-O 3.48Å; S160-F174 WeakPolarHBondContact CA-O 3.26Å; S160-F174 WeakPolarHBondContact CB-O 3.29Å
161	I	91.8	Very high	91.1	Very high	3 Å²	3	44.5 Å²	44.5	2%	0.015	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	132.5	166.8	-61.8	163.7	0	0	0	109	L14 V16 A153 V154 F174 I198 F200 L206	L14-I161 HydrophobicContact CD2-CG1 4.07Å; V16-I161 HydrophobicContact CG2-CD1 4.24Å; V16-I161 HydrophobicContact CG2-CG1 4.37Å; A153-I161 HydrophobicContact CB-CG2 3.95Å; V154-I161 WeakPolarHBondContact O-CA 3.28Å; I161-F174 HydrophobicContact CB-CB 4.39Å; I161-F174 HydrophobicContact CB-CD2 4.3Å; I161-F174 HydrophobicContact CG2-CD2 4.43Å; I161-F174 PolarHBondContact N-O 2.99Å; I161-F174 PolarHBondContact O-N 2.87Å; I161-I198 HydrophobicContact CD1-CB 3.75Å; I161-I198 HydrophobicContact CD1-CD1 3.19Å; I161-I198 HydrophobicContact CD1-CG1 3.99Å; I161-I198 HydrophobicContact CD1-CG2 3.47Å; I161-I198 VanDerWaalsContact CD1-CG2 3.47Å; I161-I198 HydrophobicContact CG1-CD1 4.02Å; I161-F200 HydrophobicContact CD1-CE2 4.15Å; I161-F200 HydrophobicContact CD1-CZ 4.2Å; I161-F200 HydrophobicContact CG2-CE2 4.39Å; I161-F200 HydrophobicContact CG2-CZ 3.85Å; I161-L206 HydrophobicContact CD1-CD1 3.82Å
162	V	91.8	Very high	91.1	Very high	8 Å²	8	49.4 Å²	49.4	5%	0.048	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	123.7	172.8	-168.7	0	0	0	0	109.4	A153 V154 L156 Y164 V170 T173	A153-V162 CarbonylContact C-O 3.57Å; A153-V162 WeakPolarHBondContact CA-O 3.49Å; V154-V162 PolarHBondContact N-O 3.13Å; V154-V162 PolarHBondContact O-N 3.05Å; L156-V162 HydrophobicContact CD1-CG2 3.8Å; L156-V162 HydrophobicContact CG-CG2 4.48Å; V162-Y164 HydrophobicContact CB-CD2 4.35Å; V162-Y164 HydrophobicContact CB-CE2 3.51Å; V162-Y164 HydrophobicContact CG1-CD2 4.08Å; V162-Y164 HydrophobicContact CG1-CE1 4.07Å; V162-Y164 HydrophobicContact CG1-CE2 3.38Å; V162-Y164 WeakPolarHBondContact CG1-OH 3.3Å; V162-Y164 WeakPolarHBondContact O-CD2 2.74Å; V162-Y164 WeakPolarHBondContact O-CE2 3.47Å; V162-V170 HydrophobicContact CG1-CB 4.45Å; V162-V170 HydrophobicContact CG1-CG1 3.75Å; V162-V170 HydrophobicContact CG1-CG2 4.05Å; V162-T173 HydrophobicContact CG2-CG2 4.07Å
163	Q	93.3	Very high	91.2	Very high	1 Å²	1	53 Å²	53	1%	0.005	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	132.7	175	-174	176.4	14.8	0	0	109.4	Y171 R172 F174	Q163-Y171 VanDerWaalsContact CD-CD1 3.5Å; Q163-Y171 HydrophobicContact CG-CD1 3.99Å; Q163-Y171 WeakPolarHBondContact O-CB 3.39Å; Q163-Y171 PolarHBondContact O-N 2.72Å; Q163-R172 HydrophobicContact CB-CB 4.34Å; Q163-R172 PolarHBondContact N-O 2.83Å; Q163-R172 PolarHBondContact O-N 2.85Å; Q163-F174 HydrophobicContact CB-CE2 4.27Å
164	Y	93.7	Very high	91.2	Very high	23 Å²	23	54.6 Å²	54.6	9%	0.09	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	150.7	-177.3	-65.8	-92.8	0	0	0	111.6	I134 Q151 F152 V154 V162 C168 Q169 V170	I134-Y164 HydrophobicContact CD1-CD2 4.21Å; I134-Y164 HydrophobicContact CD1-CE2 4.23Å; I134-Y164 HydrophobicContact CD1-CG 4.39Å; I134-Y164 HydrophobicContact CG2-CE1 4.01Å; I134-Y164 HydrophobicContact CG2-CE2 3.79Å; I134-Y164 WeakPolarHBondContact CG2-OH 3.34Å; Q151-Y164 WeakPolarHBondContact CA-O 3.39Å; Q151-Y164 VanDerWaalsContact CB-O 3.28Å; Q151-Y164 WeakPolarHBondContact CB-O 2.85Å; F152-Y164 HydrophobicContact CD2-CD2 4.36Å; F152-Y164 AromaticContact CE2-CD2 3.7Å; F152-Y164 HydrophobicContact CE2-CD2 3.7Å; F152-Y164 AromaticContact CE2-CG 3.87Å; F152-Y164 HydrophobicContact CE2-CG 3.87Å; F152-Y164 HydrophobicContact CZ-CD2 4.13Å; F152-Y164 AromaticContact CZ-CG 3.8Å; F152-Y164 HydrophobicContact CZ-CG 3.8Å; F152-Y164 PolarHBondContact N-O 2.88Å; F152-Y164 VanDerWaalsContact N-O 3.08Å; F152-Y164 PolarHBondContact O-N 3.05Å; V154-Y164 HydrophobicContact CB-CE2 4.03Å; V154-Y164 HydrophobicContact CG2-CD2 3.64Å; V154-Y164 HydrophobicContact CG2-CE2 3.49Å; V154-Y164 VanDerWaalsContact CG2-CE2 3.49Å; V162-Y164 HydrophobicContact CB-CD2 4.35Å; V162-Y164 HydrophobicContact CB-CE2 3.51Å; V162-Y164 HydrophobicContact CG1-CD2 4.08Å; V162-Y164 HydrophobicContact CG1-CE1 4.07Å; V162-Y164 HydrophobicContact CG1-CE2 3.38Å; V162-Y164 WeakPolarHBondContact CG1-OH 3.3Å; V162-Y164 WeakPolarHBondContact O-CD2 2.74Å; V162-Y164 WeakPolarHBondContact O-CE2 3.47Å; Y164-C168 WeakPolarHBondContact CD1-O 3.37Å; Y164-Q169 WeakPolarHBondContact CA-O 2.92Å; Y164-V170 HydrophobicContact CD1-CG2 4.06Å; Y164-V170 HydrophobicContact CE1-CB 4.41Å; Y164-V170 HydrophobicContact CE1-CG2 3.46Å; Y164-V170 VanDerWaalsContact CE1-CG2 3.46Å
165	K	93.8	Very high	91.2	Very high	89 Å²	89	59.1 Å²	59.1	39%	0.387	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	163.7	163.1	-64.1	-179.4	-173.9	175	0	110.1	F152 N167 C168 Q169	F152-K165 WeakPolarHBondContact CE1-O 3.31Å; K165-N167 WeakPolarHBondContact CB-OD1 3.44Å; K165-N167 PolarHBondContact O-N 3.16Å; K165-N167 VanDerWaalsContact O-N 3.08Å; K165-C168 PolarHBondContact O-N 3.25Å; K165-Q169 PolarHBondContact N-O 3.39Å
166	M	89.2	Confident	90.9	Very high	84 Å²	84	64.8 Å²	64.8	41%	0.414	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-26.8	177.7	-67.2	-155.1	-142.2	0	0	114.4	L69 G149 K150 C168	L69-M166 HydrophobicContact CD1-SD 4.08Å; G149-M166 VanDerWaalsContact O-CE 3.27Å; G149-M166 WeakPolarHBondContact O-CE 3.21Å; G149-M166 WeakPolarHBondContact O-CG 3.46Å; K150-M166 HydrophobicContact CB-CE 4.31Å; K150-M166 HydrophobicContact CG-CE 4.06Å; K150-M166 VanDerWaalsContact O-CG 3.29Å; K150-M166 WeakPolarHBondContact O-CG 3.04Å; K150-M166 PolarHBondContact O-N 2.75Å; M166-C168 PolarHBondContact O-N 2.7Å
167	N	89.3	Confident	90.5	Very high	89 Å²	89	66.3 Å²	66.3	48%	0.476	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	19.7	176	66.5	-11.1	0	0	0	113.2	K165 Q169	K165-N167 WeakPolarHBondContact CB-OD1 3.44Å; K165-N167 PolarHBondContact O-N 3.16Å; K165-N167 VanDerWaalsContact O-N 3.08Å; N167-Q169 PolarHBondContact ND2-NE2 2.71Å; N167-Q169 PolarHBondContact ND2-OE1 3.3Å; N167-Q169 PolarHBondContact O-N 2.8Å; N167-Q169 WeakPolarHBondContact OD1-CB 3.48Å; N167-Q169 WeakPolarHBondContact OD1-CG 3.11Å; N167-Q169 PolarHBondContact OD1-N 2.97Å
168	C	90.1	Very high	90.2	Very high	23 Å²	23	68.4 Å²	68.4	16%	0.155	35%	0.348	C	S	.	.	S	Bend	trans	57	18.5	-177.8	-61.2	0	0	0	0	115	Y164 K165 M166	Y164-C168 WeakPolarHBondContact CD1-O 3.37Å; K165-C168 PolarHBondContact O-N 3.25Å; M166-C168 PolarHBondContact O-N 2.7Å
169	Q	91.9	Very high	89.2	Confident	108 Å²	108	71.4 Å²	71.4	51%	0.505	36%	0.363	S	S	.	.			trans	-79.4	133.8	170	-68.8	178.8	-14.7	0	0	110	Y164 K165 N167 Y171	Y164-Q169 WeakPolarHBondContact CA-O 2.92Å; K165-Q169 PolarHBondContact N-O 3.39Å; N167-Q169 PolarHBondContact ND2-NE2 2.71Å; N167-Q169 PolarHBondContact ND2-OE1 3.3Å; N167-Q169 PolarHBondContact O-N 2.8Å; N167-Q169 WeakPolarHBondContact OD1-CB 3.48Å; N167-Q169 WeakPolarHBondContact OD1-CG 3.11Å; N167-Q169 PolarHBondContact OD1-N 2.97Å; Q169-Y171 PolarHBondContact O-N 2.88Å
170	V	93.1	Very high	87.7	Confident	84 Å²	84	73.5 Å²	73.5	51%	0.509	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	121.9	172.7	179.2	0	0	0	0	108.5	V162 Y164	V162-V170 HydrophobicContact CG1-CB 4.45Å; V162-V170 HydrophobicContact CG1-CG1 3.75Å; V162-V170 HydrophobicContact CG1-CG2 4.05Å; Y164-V170 HydrophobicContact CD1-CG2 4.06Å; Y164-V170 HydrophobicContact CE1-CB 4.41Å; Y164-V170 HydrophobicContact CE1-CG2 3.46Å; Y164-V170 VanDerWaalsContact CE1-CG2 3.46Å
171	Y	94.1	Very high	85.7	Confident	125 Å²	125	77.8 Å²	77.8	49%	0.49	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	-47.9	171.4	178.5	-108.6	0	0	0	110.6	Q163 Q169	Q163-Y171 VanDerWaalsContact CD-CD1 3.5Å; Q163-Y171 HydrophobicContact CG-CD1 3.99Å; Q163-Y171 WeakPolarHBondContact O-CB 3.39Å; Q163-Y171 PolarHBondContact O-N 2.72Å; Q169-Y171 PolarHBondContact O-N 2.88Å
172	R	94.9	Very high	83.7	Confident	142 Å²	142	83.5 Å²	83.5	54%	0.536	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	147.1	-177.8	-157	169	-156.8	-176.8	6.7	110.8	Q163 F174	Q163-R172 HydrophobicContact CB-CB 4.34Å; Q163-R172 PolarHBondContact N-O 2.83Å; Q163-R172 PolarHBondContact O-N 2.85Å; R172-F174 HydrophobicContact CB-CE2 4.19Å; R172-F174 HydrophobicContact CB-CZ 4.31Å; R172-F174 HydrophobicContact CG-CE1 4.3Å; R172-F174 HydrophobicContact CG-CE2 4.26Å; R172-F174 HydrophobicContact CG-CZ 4.03Å
173	T	93	Very high	81.3	Confident	77 Å²	77	89.5 Å²	89.5	47%	0.472	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	133.3	170.8	-59.2	0	0	0	0	108.7	V162	V162-T173 HydrophobicContact CG2-CG2 4.07Å
174	F	91.7	Very high	79	Confident	34 Å²	34	94.8 Å²	94.8	15%	0.149	51%	0.507	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	112.5	174.5	-55	-86.4	0	0	0	107.1	S160 I161 Q163 R172 F200 L206	S160-F174 CarbonylContact C-O 3.48Å; S160-F174 WeakPolarHBondContact CA-O 3.26Å; S160-F174 WeakPolarHBondContact CB-O 3.29Å; I161-F174 HydrophobicContact CB-CB 4.39Å; I161-F174 HydrophobicContact CB-CD2 4.3Å; I161-F174 HydrophobicContact CG2-CD2 4.43Å; I161-F174 PolarHBondContact N-O 2.99Å; I161-F174 PolarHBondContact O-N 2.87Å; Q163-F174 HydrophobicContact CB-CE2 4.27Å; R172-F174 HydrophobicContact CB-CE2 4.19Å; R172-F174 HydrophobicContact CB-CZ 4.31Å; R172-F174 HydrophobicContact CG-CE1 4.3Å; R172-F174 HydrophobicContact CG-CE2 4.26Å; R172-F174 HydrophobicContact CG-CZ 4.03Å; F174-F200 HydrophobicContact CE2-CE1 4.07Å; F174-F200 HydrophobicContact CE2-CZ 4.45Å; F174-F200 HydrophobicContact CZ-CE1 4.44Å; F174-L206 HydrophobicContact CB-CD1 4.34Å; F174-L206 HydrophobicContact CB-CD2 4.31Å; F174-L206 HydrophobicContact CD1-CB 4.03Å; F174-L206 HydrophobicContact CD1-CD1 4.07Å; F174-L206 HydrophobicContact CD1-CD2 3.62Å; F174-L206 HydrophobicContact CD1-CG 4.1Å; F174-L206 HydrophobicContact CD2-CD1 3.78Å; F174-L206 HydrophobicContact CE1-CB 3.51Å; F174-L206 HydrophobicContact CE1-CD1 4.23Å; F174-L206 HydrophobicContact CE1-CD2 4.01Å; F174-L206 HydrophobicContact CE1-CG 4.1Å; F174-L206 HydrophobicContact CE2-CB 4.3Å; F174-L206 HydrophobicContact CE2-CD1 3.97Å; F174-L206 HydrophobicContact CG-CD1 3.81Å; F174-L206 HydrophobicContact CG-CD2 4Å; F174-L206 HydrophobicContact CG-CG 4.34Å; F174-L206 HydrophobicContact CZ-CB 3.65Å; F174-L206 HydrophobicContact CZ-CD1 4.16Å; F174-L206 HydrophobicContact CZ-CG 4.36Å
175	S	91.2	Very high	76.6	Confident	94 Å²	94	96.1 Å²	96.1	66%	0.657	53%	0.527	S	S	*	.	P	Polyproline II helix	trans	-75.9	149.7	174.8	-56	0	0	0	0	110
176	R	84.7	Confident	74.2	Confident	120 Å²	120	99.3 Å²	99.3	45%	0.453	55%	0.548	S	S	.	.	P	Polyproline II helix	trans	-55.6	130.7	166.6	-175.2	178.8	179.4	171.1	0.8	109	L178	R176-L178 PolarHBondContact O-N 2.83Å
177	P	80.3	Confident	72.1	Confident	55 Å²	55	103.2 Å²	103.2	36%	0.357	57%	0.565	S	S	.	*	P	Polyproline II helix	trans	-56.4	122.8	172.3	-23.4	33.3	0	0	0	109.9	D179 W208	P177-D179 VanDerWaalsContact C-N 3.28Å; P177-W208 HydrophobicContact CG-CD2 4.33Å; P177-W208 HydrophobicContact CG-CE3 4.41Å; P177-W208 HydrophobicContact CG-CZ3 4.49Å
178	L	81.7	Confident	69.8	Low	168 Å²	168	104.7 Å²	104.7	88%	0.88	58%	0.583	S	S	*	*	S	Bend	trans	-70	-28.9	178.9	-80.7	153.4	0	0	0	111.7	R176 T180	R176-L178 PolarHBondContact O-N 2.83Å; L178-T180 VanDerWaalsContact C-N 3.28Å; L178-T180 PolarHBondContact O-N 3.18Å; L178-T180 VanDerWaalsContact O-N 3.11Å
179	D	67.7	Low	67.8	Low	137 Å²	137	107.4 Å²	107.4	73%	0.733	61%	0.614	S	S	*	*			trans	-89.3	49.4	-173.2	-69.8	-28.2	0	0	0	113.1	P177 S181	P177-D179 VanDerWaalsContact C-N 3.28Å; D179-S181 PolarHBondContact O-N 3.1Å
180	T	55.6	Low	65.7	Low	61 Å²	61	106.4 Å²	106.4	37%	0.374	62%	0.62	S	S	.	*			trans	-77.1	55.9	157.9	56	0	0	0	0	109.7	L178 L182	L178-T180 VanDerWaalsContact C-N 3.28Å; L178-T180 PolarHBondContact O-N 3.18Å; L178-T180 VanDerWaalsContact O-N 3.11Å; T180-L182 PolarHBondContact O-N 2.83Å
181	S	47.5	Very low	63.8	Low	108 Å²	108	112 Å²	112	76%	0.755	64%	0.643	S	S	*	*			trans	-82.1	17.5	153.2	73.2	0	0	0	0	110.7	D179 V183	D179-S181 PolarHBondContact O-N 3.1Å; S181-V183 PolarHBondContact O-N 3.26Å
182	L	48.3	Very low	62.1	Low	124 Å²	124	108.6 Å²	108.6	65%	0.649	65%	0.645	S	S	*	*	S	Bend	trans	-59.2	89.1	172	-83.3	166.2	0	0	0	108.6	T180 S184	T180-L182 PolarHBondContact O-N 2.83Å; L182-S184 VanDerWaalsContact C-N 3.32Å; L182-S184 PolarHBondContact O-N 3.41Å
183	V	42.9	Very low	60.4	Low	134 Å²	134	103.6 Å²	103.6	81%	0.812	64%	0.638	S	S	*	*			trans	20.1	70.6	160.9	-166.9	0	0	0	0	111.9	S181 G185	S181-V183 PolarHBondContact O-N 3.26Å; V183-G185 PolarHBondContact O-N 3.01Å
184	S	44	Very low	58.8	Low	112 Å²	112	104.5 Å²	104.5	78%	0.783	64%	0.64	S	S	*	*			trans	-67.2	87.9	157.9	70.2	0	0	0	0	104.9	L182 D186	L182-S184 VanDerWaalsContact C-N 3.32Å; L182-S184 PolarHBondContact O-N 3.41Å; S184-D186 PolarHBondContact O-N 2.93Å; S184-D186 VanDerWaalsContact O-N 3.14Å
185	G	43.9	Very low	57.3	Low	50 Å²	50	104.1 Å²	104.1	52%	0.515	64%	0.638	S	S	.	*			trans	-53.2	123.3	163.7	0	0	0	0	0	106.1	V183 Q187	V183-G185 PolarHBondContact O-N 3.01Å; G185-Q187 PolarHBondContact O-N 2.69Å
186	D	43.8	Very low	55.9	Low	157 Å²	157	100.5 Å²	100.5	84%	0.84	61%	0.613	S	S	*	*			trans	-37.2	95.4	-176.1	-83.5	-40.8	0	0	0	111.9	S184	S184-D186 PolarHBondContact O-N 2.93Å; S184-D186 VanDerWaalsContact O-N 3.14Å
187	Q	44.9	Very low	54.8	Low	165 Å²	165	96.8 Å²	96.8	77%	0.771	60%	0.603	S	S	*	*			trans	-115.9	69.3	163.3	-68.9	-153.5	11.6	0	0	106.8	G185 G189	G185-Q187 PolarHBondContact O-N 2.69Å; Q187-G189 VanDerWaalsContact C-N 3.33Å; Q187-G189 PolarHBondContact O-N 3.19Å
188	S	41.2	Very low	54.1	Low	121 Å²	121	94.2 Å²	94.2	85%	0.846	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.9	94.9	167.7	44.1	0	0	0	0	109.2
189	G	48	Very low	53.2	Low	79 Å²	79	88.5 Å²	88.5	81%	0.814	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	147.4	-9.8	163.9	0	0	0	0	0	118	Q187	Q187-G189 VanDerWaalsContact C-N 3.33Å; Q187-G189 PolarHBondContact O-N 3.19Å
190	S	46.4	Very low	52.9	Low	88 Å²	88	82.3 Å²	82.3	62%	0.615	52%	0.523	S	S	*	.			trans	-100.9	110	-176.4	-162.5	0	0	0	0	112.2	G192	S190-G192 PolarHBondContact O-N 2.86Å
191	M	54.1	Low	53.3	Low	202 Å²	202	80.3 Å²	80.3	100%	0.995	51%	0.512	S	S	*	.			trans	-69.7	30.4	165.1	-71.3	-161.7	165.9	0	0	112.7	G193	M191-G193 PolarHBondContact O-N 2.82Å
192	G	57.8	Low	53.8	Low	53 Å²	53	79.7 Å²	79.7	55%	0.546	50%	0.504	S	S	.	.			trans	-73.2	109.3	177.1	0	0	0	0	0	109.3	S190 D194	S190-G192 PolarHBondContact O-N 2.86Å; G192-D194 PolarHBondContact O-N 3.04Å
193	G	60	Low	54.7	Low	36 Å²	36	81.6 Å²	81.6	37%	0.371	51%	0.509	S	S	.	.	P	Polyproline II helix	trans	-62.5	125.7	175.8	0	0	0	0	0	110.4	M191 H195	M191-G193 PolarHBondContact O-N 2.82Å; G193-H195 PolarHBondContact O-CD2 3.19Å; G193-H195 PolarHBondContact O-N 3.25Å
194	D	60	Low	55.5	Low	96 Å²	96	76.3 Å²	76.3	51%	0.513	48%	0.48	S	S	.	.	P	Polyproline II helix	trans	-60.7	126.5	171.5	-76.1	-53.8	0	0	0	110	G192 S212	G192-D194 PolarHBondContact O-N 3.04Å; D194-S212 WeakPolarHBondContact OD1-CB 3.18Å; D194-S212 PolarHBondContact OD1-OG 3.14Å
195	H	59	Low	56.5	Low	27 Å²	27	73.7 Å²	73.7	13%	0.125	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	134.7	171.5	-63.9	-68.6	0	0	0	109.2	L10 G193 L211 Y213	L10-H195 PolarHBondContact O-CE1 2.84Å; G193-H195 PolarHBondContact O-CD2 3.19Å; G193-H195 PolarHBondContact O-N 3.25Å; H195-L211 CarbonylContact O-C 3.58Å; H195-L211 PolarHBondContact O-N 3.34Å; H195-L211 VanDerWaalsContact O-N 3.13Å; H195-Y213 HydrophobicContact CB-CD1 4.43Å; H195-Y213 HydrophobicContact CB-CE1 3.72Å; H195-Y213 AromaticContact CD2-CE1 3.46Å; H195-Y213 VanDerWaalsContact CD2-CE1 3.46Å; H195-Y213 WeakPolarHBondContact CD2-CE1 3.49Å; H195-Y213 AromaticContact CD2-CZ 3.32Å; H195-Y213 PolarHBondContact CD2-OH 3.13Å; H195-Y213 VanDerWaalsContact CD2-OH 3.23Å; H195-Y213 AromaticContact CG-CE1 3.79Å; H195-Y213 AromaticContact CG-CZ 3.98Å; H195-Y213 AromaticContact NE2-CZ 3.99Å
196	S	61.5	Low	57.4	Low	17 Å²	17	73 Å²	73	12%	0.119	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	130.2	173.8	-59	0	0	0	0	108.4
197	V	62.7	Low	58.4	Low	42 Å²	42	70.2 Å²	70.2	26%	0.255	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	131.4	173.8	177.1	0	0	0	0	107.6	L199 L209 L211	V197-L199 HydrophobicContact CG1-CD2 4.17Å; V197-L199 HydrophobicContact CG1-CG 4.35Å; V197-L209 CarbonylContact C-O 3.19Å; V197-L209 PolarHBondContact N-O 2.96Å; V197-L209 CarbonylContact O-C 3.43Å; V197-L209 VanDerWaalsContact O-C 3.25Å; V197-L209 WeakPolarHBondContact O-CA 3.46Å; V197-L209 WeakPolarHBondContact O-CB 3.5Å; V197-L209 PolarHBondContact O-N 3.47Å; V197-L211 HydrophobicContact CB-CD1 3.8Å; V197-L211 HydrophobicContact CB-CG 4.33Å; V197-L211 HydrophobicContact CG2-CD1 3.47Å; V197-L211 VanDerWaalsContact CG2-CD1 3.47Å; V197-L211 HydrophobicContact CG2-CG 4.23Å
198	I	64.7	Low	59.1	Low	1 Å²	1	66.3 Å²	66.3	1%	0.005	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	121.8	-176.7	-54.3	174.3	0	0	0	107.5	L14 I161 F200 L206 W208	L14-I198 HydrophobicContact CD1-CD1 3.91Å; I161-I198 HydrophobicContact CD1-CB 3.75Å; I161-I198 HydrophobicContact CD1-CD1 3.19Å; I161-I198 HydrophobicContact CD1-CG1 3.99Å; I161-I198 HydrophobicContact CD1-CG2 3.47Å; I161-I198 VanDerWaalsContact CD1-CG2 3.47Å; I161-I198 HydrophobicContact CG1-CD1 4.02Å; I198-F200 HydrophobicContact CG2-CE2 4.13Å; I198-L206 HydrophobicContact CG2-CD1 3.51Å; I198-L206 HydrophobicContact CG2-CG 3.93Å; I198-W208 HydrophobicContact CG1-CG 4.41Å
199	L	63.8	Low	59.8	Low	49 Å²	49	63.2 Å²	63.2	26%	0.257	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	124.9	-172.8	-64.9	172	0	0	0	108.7	V197 Y207 L209 L278	V197-L199 HydrophobicContact CG1-CD2 4.17Å; V197-L199 HydrophobicContact CG1-CG 4.35Å; L199-Y207 PolarHBondContact N-O 2.85Å; L199-Y207 WeakPolarHBondContact O-CA 3.47Å; L199-Y207 WeakPolarHBondContact O-CB 3.43Å; L199-Y207 PolarHBondContact O-N 3.42Å; L199-L209 HydrophobicContact CD1-CB 4.48Å; L199-L209 HydrophobicContact CD1-CD2 4.02Å; L199-L278 HydrophobicContact CD1-CD2 4.19Å
200	F	61.5	Low	60.5	Low	6 Å²	6	61.6 Å²	61.6	3%	0.026	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	132.3	173.6	-73.7	-93.9	0	0	0	110.9	V16 C17 F18 A153 I161 F174 I198 L206	V16-F200 HydrophobicContact CG1-CD2 3.58Å; V16-F200 HydrophobicContact CG1-CE2 3.34Å; V16-F200 HydrophobicContact CG1-CZ 4.43Å; C17-F200 PolarHBondContact O-N 3.41Å; F18-F200 HydrophobicContact CD1-CB 3.41Å; F18-F200 VanDerWaalsContact CD1-CB 3.41Å; F18-F200 HydrophobicContact CD1-CG 4.11Å; F18-F200 HydrophobicContact CE1-CB 3.5Å; F18-F200 AromaticContact CE1-CD1 3.98Å; F18-F200 HydrophobicContact CE1-CD1 3.98Å; F18-F200 HydrophobicContact CE1-CD2 4.44Å; F18-F200 AromaticContact CE1-CG 3.74Å; F18-F200 HydrophobicContact CE1-CG 3.74Å; F18-F200 HydrophobicContact CG-CB 4.14Å; F18-F200 HydrophobicContact CZ-CB 4.29Å; F18-F200 HydrophobicContact CZ-CD1 4.29Å; F18-F200 HydrophobicContact CZ-CD2 4.42Å; F18-F200 HydrophobicContact CZ-CG 4.09Å; A153-F200 HydrophobicContact CB-CE2 4.21Å; A153-F200 HydrophobicContact CB-CZ 4.03Å; I161-F200 HydrophobicContact CD1-CE2 4.15Å; I161-F200 HydrophobicContact CD1-CZ 4.2Å; I161-F200 HydrophobicContact CG2-CE2 4.39Å; I161-F200 HydrophobicContact CG2-CZ 3.85Å; F174-F200 HydrophobicContact CE2-CE1 4.07Å; F174-F200 HydrophobicContact CE2-CZ 4.45Å; F174-F200 HydrophobicContact CZ-CE1 4.44Å; I198-F200 HydrophobicContact CG2-CE2 4.13Å; F200-L206 HydrophobicContact CD1-CB 4.25Å; F200-L206 HydrophobicContact CD1-CD1 4.25Å; F200-L206 HydrophobicContact CE1-CB 3.96Å; F200-L206 HydrophobicContact CE1-CD1 3.41Å; F200-L206 VanDerWaalsContact CE1-CD1 3.41Å; F200-L206 HydrophobicContact CE1-CG 4.22Å; F200-L206 HydrophobicContact CE2-CD1 3.82Å; F200-L206 HydrophobicContact CZ-CD1 3.18Å; F200-L206 HydrophobicContact CZ-CG 4.35Å
201	S	63.8	Low	60.8	Low	19 Å²	19	58.6 Å²	58.6	13%	0.133	32%	0.322	C	S	.	.			trans	-68.4	163.5	170.8	99.8	0	0	0	0	111.6	E203 A204 T205	S201-E203 PolarHBondContact O-N 3.12Å; S201-E203 WeakPolarHBondContact OG-CA 3.38Å; S201-E203 PolarHBondContact OG-N 3.23Å; S201-A204 PolarHBondContact O-N 2.83Å; S201-A204 PolarHBondContact OG-N 3.28Å; S201-T205 PolarHBondContact N-O 3.25Å; S201-T205 WeakPolarHBondContact OG-CB 3.36Å; S201-T205 PolarHBondContact OG-N 3.24Å; S201-T205 PolarHBondContact OG-OG1 3.22Å
202	T	56.8	Low	60.6	Low	95 Å²	95	51.7 Å²	51.7	58%	0.583	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-20.7	172.6	49.4	0	0	0	0	113.2	A204	T202-A204 VanDerWaalsContact C-N 3.27Å
203	E	67	Low	60.5	Low	164 Å²	164	52.2 Å²	52.2	77%	0.766	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	4.8	174.1	-56.5	-173.2	167	0	0	112.4	S201 T205	S201-E203 PolarHBondContact O-N 3.12Å; S201-E203 WeakPolarHBondContact OG-CA 3.38Å; S201-E203 PolarHBondContact OG-N 3.23Å; E203-T205 PolarHBondContact O-N 3.5Å
204	A	59.7	Low	59.9	Low	24 Å²	24	54.2 Å²	54.2	20%	0.198	30%	0.3	C	S	.	.			trans	64.3	25.2	-175.6	0	0	0	0	0	114.3	S201 T202	S201-A204 PolarHBondContact O-N 2.83Å; S201-A204 PolarHBondContact OG-N 3.28Å; T202-A204 VanDerWaalsContact C-N 3.27Å
205	T	65.1	Low	59.5	Low	56 Å²	56	53.9 Å²	53.9	34%	0.344	30%	0.302	S	S	.	.			trans	-73.6	126.4	165.7	-48.3	0	0	0	0	108.4	S201 E203 Y207	S201-T205 PolarHBondContact N-O 3.25Å; S201-T205 WeakPolarHBondContact OG-CB 3.36Å; S201-T205 PolarHBondContact OG-N 3.24Å; S201-T205 PolarHBondContact OG-OG1 3.22Å; E203-T205 PolarHBondContact O-N 3.5Å; T205-Y207 HydrophobicContact CG2-CE1 4.2Å; T205-Y207 HydrophobicContact CG2-CE2 4.13Å
206	L	63.7	Low	59.1	Low	37 Å²	37	58.1 Å²	58.1	19%	0.194	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	121.5	176.8	178.5	118.7	0	0	0	109.1	I161 F174 I198 F200	I161-L206 HydrophobicContact CD1-CD1 3.82Å; F174-L206 HydrophobicContact CB-CD1 4.34Å; F174-L206 HydrophobicContact CB-CD2 4.31Å; F174-L206 HydrophobicContact CD1-CB 4.03Å; F174-L206 HydrophobicContact CD1-CD1 4.07Å; F174-L206 HydrophobicContact CD1-CD2 3.62Å; F174-L206 HydrophobicContact CD1-CG 4.1Å; F174-L206 HydrophobicContact CD2-CD1 3.78Å; F174-L206 HydrophobicContact CE1-CB 3.51Å; F174-L206 HydrophobicContact CE1-CD1 4.23Å; F174-L206 HydrophobicContact CE1-CD2 4.01Å; F174-L206 HydrophobicContact CE1-CG 4.1Å; F174-L206 HydrophobicContact CE2-CB 4.3Å; F174-L206 HydrophobicContact CE2-CD1 3.97Å; F174-L206 HydrophobicContact CG-CD1 3.81Å; F174-L206 HydrophobicContact CG-CD2 4Å; F174-L206 HydrophobicContact CG-CG 4.34Å; F174-L206 HydrophobicContact CZ-CB 3.65Å; F174-L206 HydrophobicContact CZ-CD1 4.16Å; F174-L206 HydrophobicContact CZ-CG 4.36Å; I198-L206 HydrophobicContact CG2-CD1 3.51Å; I198-L206 HydrophobicContact CG2-CG 3.93Å; F200-L206 HydrophobicContact CD1-CB 4.25Å; F200-L206 HydrophobicContact CD1-CD1 4.25Å; F200-L206 HydrophobicContact CE1-CB 3.96Å; F200-L206 HydrophobicContact CE1-CD1 3.41Å; F200-L206 VanDerWaalsContact CE1-CD1 3.41Å; F200-L206 HydrophobicContact CE1-CG 4.22Å; F200-L206 HydrophobicContact CE2-CD1 3.82Å; F200-L206 HydrophobicContact CZ-CD1 3.18Å; F200-L206 HydrophobicContact CZ-CG 4.35Å
207	Y	65.8	Low	59	Low	97 Å²	97	67.3 Å²	67.3	38%	0.38	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	125.1	168	-60.5	-77	0	0	0	108.6	L199 T205	L199-Y207 PolarHBondContact N-O 2.85Å; L199-Y207 WeakPolarHBondContact O-CA 3.47Å; L199-Y207 WeakPolarHBondContact O-CB 3.43Å; L199-Y207 PolarHBondContact O-N 3.42Å; T205-Y207 HydrophobicContact CG2-CE1 4.2Å; T205-Y207 HydrophobicContact CG2-CE2 4.13Å
208	W	57.8	Low	58.8	Low	83 Å²	83	69.1 Å²	69.1	31%	0.314	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	124.3	179.9	-151.2	81.9	0	0	0	109.1	P177 I198 Q210	P177-W208 HydrophobicContact CG-CD2 4.33Å; P177-W208 HydrophobicContact CG-CE3 4.41Å; P177-W208 HydrophobicContact CG-CZ3 4.49Å; I198-W208 HydrophobicContact CG1-CG 4.41Å; W208-Q210 HydrophobicContact CE3-CB 4.08Å; W208-Q210 HydrophobicContact CH2-CB 3.8Å; W208-Q210 HydrophobicContact CH2-CG 3.68Å; W208-Q210 HydrophobicContact CZ3-CB 3.39Å; W208-Q210 HydrophobicContact CZ3-CG 3.79Å
209	L	57.3	Low	58.1	Low	56 Å²	56	75 Å²	75	29%	0.293	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	94.1	177	-174	70.4	0	0	0	109.3	V197 L199 L211	V197-L209 CarbonylContact C-O 3.19Å; V197-L209 PolarHBondContact N-O 2.96Å; V197-L209 CarbonylContact O-C 3.43Å; V197-L209 VanDerWaalsContact O-C 3.25Å; V197-L209 WeakPolarHBondContact O-CA 3.46Å; V197-L209 WeakPolarHBondContact O-CB 3.5Å; V197-L209 PolarHBondContact O-N 3.47Å; L199-L209 HydrophobicContact CD1-CB 4.48Å; L199-L209 HydrophobicContact CD1-CD2 4.02Å; L209-L211 HydrophobicContact CD1-CD2 4.41Å; L209-L211 HydrophobicContact CD2-CD1 4.13Å; L209-L211 HydrophobicContact CD2-CD2 3.83Å; L209-L211 HydrophobicContact CD2-CG 4.08Å; L209-L211 HydrophobicContact CG-CD2 3.81Å; L209-L211 HydrophobicContact CG-CG 4.02Å; L209-L211 PolarHBondContact O-N 3.34Å
210	Q	61.7	Low	57.4	Low	46 Å²	46	78.3 Å²	78.3	22%	0.215	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	121.8	170.3	-152.6	169.3	-35.4	0	0	109	W208	W208-Q210 HydrophobicContact CE3-CB 4.08Å; W208-Q210 HydrophobicContact CH2-CB 3.8Å; W208-Q210 HydrophobicContact CH2-CG 3.68Å; W208-Q210 HydrophobicContact CZ3-CB 3.39Å; W208-Q210 HydrophobicContact CZ3-CG 3.79Å
211	L	52.1	Low	56.9	Low	24 Å²	24	84.8 Å²	84.8	13%	0.126	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	83.3	175.2	-66.1	177.9	0	0	0	108.1	H195 V197 L209 Y213 L226	H195-L211 CarbonylContact O-C 3.58Å; H195-L211 PolarHBondContact O-N 3.34Å; H195-L211 VanDerWaalsContact O-N 3.13Å; V197-L211 HydrophobicContact CB-CD1 3.8Å; V197-L211 HydrophobicContact CB-CG 4.33Å; V197-L211 HydrophobicContact CG2-CD1 3.47Å; V197-L211 VanDerWaalsContact CG2-CD1 3.47Å; V197-L211 HydrophobicContact CG2-CG 4.23Å; L209-L211 HydrophobicContact CD1-CD2 4.41Å; L209-L211 HydrophobicContact CD2-CD1 4.13Å; L209-L211 HydrophobicContact CD2-CD2 3.83Å; L209-L211 HydrophobicContact CD2-CG 4.08Å; L209-L211 HydrophobicContact CG-CD2 3.81Å; L209-L211 HydrophobicContact CG-CG 4.02Å; L209-L211 PolarHBondContact O-N 3.34Å; L211-Y213 PolarHBondContact O-N 2.8Å; L211-Y213 VanDerWaalsContact O-N 3.15Å; L211-L226 HydrophobicContact CD1-CD1 3.88Å; L211-L226 HydrophobicContact CD1-CD2 4.1Å; L211-L226 HydrophobicContact CD1-CG 4.33Å
212	S	51	Low	56.4	Low	58 Å²	58	87.1 Å²	87.1	41%	0.406	48%	0.481	S	S	.	.			trans	-75.3	100.9	169.4	-66.6	0	0	0	0	108.6	D194	D194-S212 WeakPolarHBondContact OD1-CB 3.18Å; D194-S212 PolarHBondContact OD1-OG 3.14Å
213	Y	56.1	Low	55.8	Low	64 Å²	64	89.3 Å²	89.3	25%	0.251	49%	0.488	S	S	.	.			trans	-111	126.6	166.6	63.5	-86	0	0	0	109.3	H195 L211 V215 P222	H195-Y213 HydrophobicContact CB-CD1 4.43Å; H195-Y213 HydrophobicContact CB-CE1 3.72Å; H195-Y213 AromaticContact CD2-CE1 3.46Å; H195-Y213 VanDerWaalsContact CD2-CE1 3.46Å; H195-Y213 WeakPolarHBondContact CD2-CE1 3.49Å; H195-Y213 AromaticContact CD2-CZ 3.32Å; H195-Y213 PolarHBondContact CD2-OH 3.13Å; H195-Y213 VanDerWaalsContact CD2-OH 3.23Å; H195-Y213 AromaticContact CG-CE1 3.79Å; H195-Y213 AromaticContact CG-CZ 3.98Å; H195-Y213 AromaticContact NE2-CZ 3.99Å; L211-Y213 PolarHBondContact O-N 2.8Å; L211-Y213 VanDerWaalsContact O-N 3.15Å; Y213-V215 HydrophobicContact CD2-CG2 3.8Å; Y213-V215 HydrophobicContact CE2-CG2 3.52Å; Y213-V215 PolarHBondContact O-N 2.98Å; Y213-P222 HydrophobicContact CE2-CB 4.45Å
214	G	47.6	Very low	54.7	Low	78 Å²	78	84.4 Å²	84.4	80%	0.804	47%	0.472	S	S	*	.			trans	-71.6	113.2	168.7	0	0	0	0	0	108.4	D216	G214-D216 VanDerWaalsContact C-N 3.26Å; G214-D216 PolarHBondContact O-N 3.34Å
215	V	51.1	Low	54.2	Low	89 Å²	89	85.6 Å²	85.6	54%	0.539	48%	0.479	S	S	.	.			trans	-73	92.8	163.3	-178	0	0	0	0	106.3	Y213 K217	Y213-V215 HydrophobicContact CD2-CG2 3.8Å; Y213-V215 HydrophobicContact CE2-CG2 3.52Å; Y213-V215 PolarHBondContact O-N 2.98Å; V215-K217 PolarHBondContact O-N 3.11Å
216	D	51.3	Low	53.1	Low	115 Å²	115	85.8 Å²	85.8	62%	0.615	48%	0.478	S	S	*	.			trans	-66.3	120.1	167.1	-149.8	-13.4	0	0	0	107.1	G214 S218 D219	G214-D216 VanDerWaalsContact C-N 3.26Å; G214-D216 PolarHBondContact O-N 3.34Å; D216-S218 PolarHBondContact O-N 2.93Å; D216-D219 PolarHBondContact O-N 3.07Å
217	K	58.6	Low	52.2	Low	210 Å²	210	86 Å²	86	91%	0.913	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-13.5	-172.7	-73.8	-177.3	179.5	174.3	0	112.5	V215	V215-K217 PolarHBondContact O-N 3.11Å
218	S	57.7	Low	50.9	Low	81 Å²	81	86.2 Å²	86.2	57%	0.566	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-30.8	179.5	48.5	0	0	0	0	114.2	D216	D216-S218 PolarHBondContact O-N 2.93Å
219	D	50.9	Low	50	Low	125 Å²	125	85.7 Å²	85.7	67%	0.668	49%	0.494	S	S	*	.			trans	-120.4	105	-168.7	-72	-32.1	0	0	0	112.5	D216 Q221	D216-D219 PolarHBondContact O-N 3.07Å; D219-Q221 PolarHBondContact O-N 3.14Å
220	S	49.3	Very low	49	Very low	117 Å²	117	84.4 Å²	84.4	82%	0.818	49%	0.489	S	S	*	.			trans	-74	38	-177.7	57.6	0	0	0	0	114.6
221	Q	50.8	Low	47.8	Very low	143 Å²	143	85.7 Å²	85.7	67%	0.668	50%	0.5	S	S	*	.			trans	-128.3	71.5	175.4	-68.2	-131.5	-0.4	0	0	112.5	D219 L223	D219-Q221 PolarHBondContact O-N 3.14Å; Q221-L223 VanDerWaalsContact C-N 3.31Å; Q221-L223 PolarHBondContact O-N 3.28Å
222	P	52.2	Low	46.9	Very low	68 Å²	68	92.6 Å²	92.6	44%	0.442	53%	0.529	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-17.9	-175.3	25.8	-32.8	0	0	0	114.6	Y213	Y213-P222 HydrophobicContact CE2-CB 4.45Å
223	L	44	Very low	46.2	Very low	140 Å²	140	94 Å²	94	73%	0.733	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.8	-29.5	-166.9	-75.4	166.5	0	0	0	115.7	Q221 S225 L226	Q221-L223 VanDerWaalsContact C-N 3.31Å; Q221-L223 PolarHBondContact O-N 3.28Å; L223-S225 PolarHBondContact O-N 3.49Å; L223-L226 PolarHBondContact O-N 3.35Å
224	S	44.7	Very low	45.3	Very low	62 Å²	62	92 Å²	92	43%	0.434	54%	0.539	S	S	.	.	H	α-helix	trans	-62.1	-35.3	173.4	43.6	0	0	0	0	111.1	L226 A227	S224-L226 VanDerWaalsContact C-N 3.28Å; S224-L226 PolarHBondContact O-N 2.88Å; S224-A227 PolarHBondContact O-N 3Å
225	S	49.9	Very low	44.6	Very low	48 Å²	48	95.1 Å²	95.1	34%	0.336	53%	0.532	S	S	.	.	H	α-helix	trans	-58.4	-32.2	177	175.4	0	0	0	0	114.1	L223 A227 D228 M229	L223-S225 PolarHBondContact O-N 3.49Å; S225-A227 PolarHBondContact O-N 2.8Å; S225-D228 PolarHBondContact O-N 3.37Å; S225-M229 VanDerWaalsContact O-CB 3.28Å; S225-M229 WeakPolarHBondContact O-CB 3.46Å; S225-M229 PolarHBondContact O-N 3.05Å; S225-M229 WeakPolarHBondContact OG-CE 3.43Å
226	L	41	Very low	43.8	Very low	60 Å²	60	96 Å²	96	31%	0.314	54%	0.54	S	S	.	.	H	α-helix	trans	-65	-41.5	-175.2	-150.1	92.4	0	0	0	111.9	L211 L223 S224 V230	L211-L226 HydrophobicContact CD1-CD1 3.88Å; L211-L226 HydrophobicContact CD1-CD2 4.1Å; L211-L226 HydrophobicContact CD1-CG 4.33Å; L223-L226 PolarHBondContact O-N 3.35Å; S224-L226 VanDerWaalsContact C-N 3.28Å; S224-L226 PolarHBondContact O-N 2.88Å; L226-V230 WeakPolarHBondContact O-CG2 3.25Å; L226-V230 PolarHBondContact O-N 3.05Å
227	A	44.6	Very low	43.4	Very low	41 Å²	41	99.8 Å²	99.8	34%	0.339	55%	0.551	S	S	.	*	H	α-helix	trans	-64.8	-44	175.2	0	0	0	0	0	110.6	S224 S225 M229 V230 V231	S224-A227 PolarHBondContact O-N 3Å; S225-A227 PolarHBondContact O-N 2.8Å; A227-M229 VanDerWaalsContact C-N 3.32Å; A227-M229 PolarHBondContact O-N 3.28Å; A227-V230 PolarHBondContact O-N 3.46Å; A227-V231 VanDerWaalsContact O-CG2 3.28Å; A227-V231 WeakPolarHBondContact O-CG2 3.47Å; A227-V231 PolarHBondContact O-N 3.23Å; A227-V231 VanDerWaalsContact O-N 3.1Å
228	D	39.2	Very low	42.6	Very low	103 Å²	103	97.1 Å²	97.1	55%	0.551	55%	0.547	S	S	*	.	H	α-helix	trans	-67.8	-31.5	-179.3	-65.4	-20.2	0	0	0	112.8	S225 V231 K232	S225-D228 PolarHBondContact O-N 3.37Å; D228-V231 PolarHBondContact O-N 3.31Å; D228-K232 PolarHBondContact O-N 3.2Å
229	M	39.1	Very low	42	Very low	71 Å²	71	98.4 Å²	98.4	35%	0.35	55%	0.551	S	S	.	*	H	α-helix	trans	-73.6	-38.9	179.9	-152.4	-178.2	-49.9	0	0	111.6	S225 A227 V231 K232 A233	S225-M229 VanDerWaalsContact O-CB 3.28Å; S225-M229 WeakPolarHBondContact O-CB 3.46Å; S225-M229 PolarHBondContact O-N 3.05Å; S225-M229 WeakPolarHBondContact OG-CE 3.43Å; A227-M229 VanDerWaalsContact C-N 3.32Å; A227-M229 PolarHBondContact O-N 3.28Å; M229-V231 VanDerWaalsContact C-N 3.27Å; M229-V231 PolarHBondContact O-N 3.1Å; M229-K232 PolarHBondContact O-N 3.24Å; M229-A233 PolarHBondContact O-N 3.33Å
230	V	36.9	Very low	41.5	Very low	29 Å²	29	101.7 Å²	101.7	18%	0.176	56%	0.562	C	S	.	*	H	α-helix	trans	-63	-37.6	169.6	176.6	0	0	0	0	110.3	L226 A227 T234 L275 V279	L226-V230 WeakPolarHBondContact O-CG2 3.25Å; L226-V230 PolarHBondContact O-N 3.05Å; A227-V230 PolarHBondContact O-N 3.46Å; V230-T234 WeakPolarHBondContact O-CG2 3.46Å; V230-L275 HydrophobicContact CG1-CD2 3.87Å; V230-L275 HydrophobicContact CG1-CG 4.22Å; V230-V279 HydrophobicContact CG1-CG2 4.3Å
231	V	36.1	Very low	41.2	Very low	73 Å²	73	104.4 Å²	104.4	44%	0.442	56%	0.562	S	S	.	*	H	α-helix	trans	-67.2	-47	176.6	173	0	0	0	0	111.7	A227 D228 M229 A233 T234	A227-V231 VanDerWaalsContact O-CG2 3.28Å; A227-V231 WeakPolarHBondContact O-CG2 3.47Å; A227-V231 PolarHBondContact O-N 3.23Å; A227-V231 VanDerWaalsContact O-N 3.1Å; D228-V231 PolarHBondContact O-N 3.31Å; M229-V231 VanDerWaalsContact C-N 3.27Å; M229-V231 PolarHBondContact O-N 3.1Å; V231-A233 VanDerWaalsContact C-N 3.31Å; V231-A233 PolarHBondContact O-N 3.33Å; V231-T234 WeakPolarHBondContact O-CA 3.46Å; V231-T234 PolarHBondContact O-N 3.28Å; V231-T234 PolarHBondContact O-OG1 2.79Å
232	K	33.7	Very low	40.8	Very low	169 Å²	169	106.4 Å²	106.4	74%	0.735	57%	0.571	S	S	*	*	H	α-helix	trans	-62.9	-31.8	-179.3	-97.6	-176.6	176.5	176.5	0	114.2	D228 M229 T234	D228-K232 PolarHBondContact O-N 3.2Å; M229-K232 PolarHBondContact O-N 3.24Å; K232-T234 PolarHBondContact O-N 3.37Å
233	A	36.2	Very low	40.5	Very low	89 Å²	89	109.2 Å²	109.2	74%	0.736	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.1	-13.8	173	0	0	0	0	0	113	M229 V231	M229-A233 PolarHBondContact O-N 3.33Å; V231-A233 VanDerWaalsContact C-N 3.31Å; V231-A233 PolarHBondContact O-N 3.33Å
234	T	37.3	Very low	40.6	Very low	22 Å²	22	107.6 Å²	107.6	14%	0.135	60%	0.596	C	S	.	*	T	Hydrogen-bonded Turn	trans	-110.1	4.1	-174.2	65.1	0	0	0	0	115.4	V230 V231 K232 P236 P272 R276	V230-T234 WeakPolarHBondContact O-CG2 3.46Å; V231-T234 WeakPolarHBondContact O-CA 3.46Å; V231-T234 PolarHBondContact O-N 3.28Å; V231-T234 PolarHBondContact O-OG1 2.79Å; K232-T234 PolarHBondContact O-N 3.37Å; T234-P236 WeakPolarHBondContact O-CD 3.16Å; T234-P272 HydrophobicContact CG2-CB 3.91Å; T234-R276 PolarHBondContact OG1-NH2 3.15Å
235	E	31.9	Very low	40.8	Very low	143 Å²	143	109.3 Å²	109.3	67%	0.668	61%	0.614	S	S	*	*			trans	-83.3	109.7	170.1	-76.5	-174.8	172.8	0	0	109.3	K237	E235-K237 PolarHBondContact O-N 3.42Å
236	P	35.1	Very low	40.5	Very low	108 Å²	108	112.8 Å²	112.8	70%	0.701	63%	0.633	S	S	*	*			trans	-62.1	125.2	169.7	26.5	-30.7	0	0	0	107.2	T234 D238	T234-P236 WeakPolarHBondContact O-CD 3.16Å; P236-D238 PolarHBondContact O-N 3.42Å
237	K	41.9	Very low	40.8	Very low	194 Å²	194	120.2 Å²	120.2	84%	0.843	66%	0.663	S	S	*	*			trans	-56.5	110.1	165.9	-78.5	-177.3	176.6	178.6	0	106.4	E235 V239	E235-K237 PolarHBondContact O-N 3.42Å; K237-V239 PolarHBondContact O-N 3.25Å
238	D	41.5	Very low	40.5	Very low	154 Å²	154	123.4 Å²	123.4	82%	0.824	68%	0.678	S	S	*	*			trans	-57.6	90.9	163.9	-85.4	-34.2	0	0	0	107.3	P236 Q240	P236-D238 PolarHBondContact O-N 3.42Å; D238-Q240 VanDerWaalsContact C-N 3.33Å; D238-Q240 PolarHBondContact O-N 3.49Å
239	V	45.3	Very low	40.3	Very low	108 Å²	108	125.2 Å²	125.2	66%	0.655	69%	0.686	S	S	*	*			trans	-69.8	99.8	167.6	-178.3	0	0	0	0	104.8	K237 Q241	K237-V239 PolarHBondContact O-N 3.25Å; V239-Q241 HydrophobicContact CG1-CG 3.83Å; V239-Q241 PolarHBondContact O-N 2.9Å
240	Q	40.8	Very low	40.2	Very low	193 Å²	193	131 Å²	131	90%	0.902	71%	0.71	S	S	*	*			trans	-56.3	93.8	160.2	-79.4	-173.3	-13.7	0	0	108.2	D238	D238-Q240 VanDerWaalsContact C-N 3.33Å; D238-Q240 PolarHBondContact O-N 3.49Å
241	Q	43.4	Very low	40.5	Very low	175 Å²	175	141.2 Å²	141.2	82%	0.818	75%	0.745	S	S	*	*			trans	-85.4	110.6	168.2	-79.2	-177.2	-8.8	0	0	108.5	V239	V239-Q241 HydrophobicContact CG1-CG 3.83Å; V239-Q241 PolarHBondContact O-N 2.9Å
242	Q	41.4	Very low	41.1	Very low	185 Å²	185	142.7 Å²	142.7	86%	0.864	76%	0.756	S	S	*	*			trans	-93.7	138.3	166.5	-159.4	167.9	7	0	0	108.8
243	P	46.2	Very low	41.4	Very low	127 Å²	127	142 Å²	142	83%	0.825	76%	0.76	S	S	*	*			trans	-88.1	135.7	-162.1	32.9	-32.2	0	0	0	112.4
244	A	47.1	Very low	41.4	Very low	105 Å²	105	141.8 Å²	141.8	87%	0.868	76%	0.758	S	S	*	*			trans	-125.7	135.7	167.4	0	0	0	0	0	110.9
245	A	48.7	Very low	41.5	Very low	98 Å²	98	147 Å²	147	81%	0.81	79%	0.79	S	S	*	*			trans	-73.4	140.1	-161.1	0	0	0	0	0	115.9
246	V	43.9	Very low	42.4	Very low	122 Å²	122	146.2 Å²	146.2	74%	0.739	80%	0.797	S	S	*	*			trans	2	117.8	142.2	-174.6	0	0	0	0	116.7	T248	V246-T248 WeakPolarHBondContact CG1-OG1 3.49Å
247	K	46.5	Very low	42.8	Very low	216 Å²	216	144.8 Å²	144.8	94%	0.939	80%	0.802	S	S	*	*			trans	-139.5	132.7	141.3	-111.4	-179.3	-176	177.5	0	110.6
248	T	38.9	Very low	42.7	Very low	108 Å²	108	144.3 Å²	144.3	66%	0.663	81%	0.805	S	S	*	*			trans	-107.5	163.1	-159.2	-36.4	0	0	0	0	110.6	V246	V246-T248 WeakPolarHBondContact CG1-OG1 3.49Å
249	I	35.4	Very low	42.6	Very low	141 Å²	141	142.5 Å²	142.5	72%	0.723	80%	0.801	S	S	*	*			trans	73.9	129.9	155.6	-8.3	-177.5	0	0	0	115
250	K	36.6	Very low	42.2	Very low	192 Å²	192	143.1 Å²	143.1	84%	0.835	81%	0.805	S	S	*	*			cis	-157	138.2	37.9	-86.7	174.8	178.6	178.7	0	114.3
251	R	43.1	Very low	41.9	Very low	244 Å²	244	139 Å²	139	92%	0.921	80%	0.798	S	S	*	*			trans	-63.7	-175.5	153	-104.7	179.4	-178.4	179.3	0.6	111.7
252	P	48.8	Very low	41.5	Very low	104 Å²	104	137.9 Å²	137.9	68%	0.675	80%	0.797	S	S	*	*			cis	-133.9	-175.3	-13.7	23.8	3.5	0	0	0	111.7
253	L	39.6	Very low	40.9	Very low	155 Å²	155	137.1 Å²	137.1	81%	0.812	80%	0.797	S	S	*	*				174.6	122.4	73.6	-147.1	84.8	0	0	0	108
254	A	35.7	Very low	40.2	Very low	84 Å²	84	134.7 Å²	134.7	69%	0.694	79%	0.788	S	S	*	*				63.6	136.6	114.7	0	0	0	0	0	116.7
255	T	39.8	Very low	39.6	Very low	131 Å²	131	133.9 Å²	133.9	80%	0.804	78%	0.781	S	S	*	*			cis	-175.5	-160.8	10.2	12	0	0	0	0	106.3
256	P	50.4	Low	38.8	Very low	126 Å²	126	136.5 Å²	136.5	82%	0.818	78%	0.782	S	S	*	*				-124	163.2	-82.1	37.3	-18.2	0	0	0	114.1
257	G	43.9	Very low	38.5	Very low	78 Å²	78	138.2 Å²	138.2	80%	0.804	78%	0.782	S	S	*	*			trans	-174.4	94.5	166.4	0	0	0	0	0	112.4
258	M	40.6	Very low	38.6	Very low	185 Å²	185	135.9 Å²	135.9	91%	0.911	77%	0.774	S	S	*	*			trans	-73.6	150	166.1	-61.3	-166.9	92.6	0	0	109.1
259	P	39	Very low	38.8	Very low	115 Å²	115	138 Å²	138	75%	0.747	78%	0.776	S	S	*	*				-153.3	163.6	92.6	41.9	-23.7	0	0	0	116.9
260	V	36.6	Very low	39.6	Very low	122 Å²	122	137.6 Å²	137.6	74%	0.739	77%	0.767	S	S	*	*			trans	69	103.3	159.9	-152.2	0	0	0	0	118.8	N262	V260-N262 PolarHBondContact O-N 2.75Å
261	S	34.9	Very low	41	Very low	107 Å²	107	131.6 Å²	131.6	75%	0.748	75%	0.746	S	S	*	*			trans	-57.3	109.7	163.5	50.4	0	0	0	0	111.7	I263	S261-I263 PolarHBondContact O-N 3.05Å
262	N	33.4	Very low	41.7	Very low	151 Å²	151	123.2 Å²	123.2	81%	0.807	72%	0.723	S	S	*	*			trans	-69.7	123	156.7	-75.7	-29.7	0	0	0	107.7	V260 A264	V260-N262 PolarHBondContact O-N 2.75Å; N262-A264 PolarHBondContact O-N 3.22Å
263	I	30	Very low	42.4	Very low	168 Å²	168	123.4 Å²	123.4	86%	0.862	72%	0.715	S	S	*	*			trans	-64	90.7	167	-62.4	170.7	0	0	0	105.6	S261 A265	S261-I263 PolarHBondContact O-N 3.05Å; I263-A265 PolarHBondContact O-N 2.92Å
264	A	31.7	Very low	43.7	Very low	77 Å²	77	119.4 Å²	119.4	64%	0.636	69%	0.693	S	S	*	*			trans	-64	113.9	167.8	0	0	0	0	0	106.1	N262 N266	N262-A264 PolarHBondContact O-N 3.22Å; A264-N266 PolarHBondContact O-N 2.87Å; A264-N266 VanDerWaalsContact O-N 3.1Å
265	A	33.9	Very low	44.9	Very low	87 Å²	87	118.4 Å²	118.4	72%	0.719	68%	0.676	S	S	*	*			trans	-53.5	119.2	164	0	0	0	0	0	106.3	I263 E267	I263-A265 PolarHBondContact O-N 2.92Å; A265-E267 VanDerWaalsContact C-N 3.33Å; A265-E267 PolarHBondContact O-N 3.28Å
266	N	31.9	Very low	46	Very low	154 Å²	154	118 Å²	118	82%	0.824	66%	0.66	S	S	*	*			trans	-57.8	101.6	174.3	-80.1	-21.3	0	0	0	107.3	A264 E268	A264-N266 PolarHBondContact O-N 2.87Å; A264-N266 VanDerWaalsContact O-N 3.1Å; N266-E268 VanDerWaalsContact C-N 3.29Å; N266-E268 PolarHBondContact O-N 3Å
267	E	36.9	Very low	46.8	Very low	158 Å²	158	118.8 Å²	118.8	74%	0.738	65%	0.652	S	S	*	*			trans	-63.2	100.2	159.6	-71.3	-176.9	162	0	0	105.3	A265 H269	A265-E267 VanDerWaalsContact C-N 3.33Å; A265-E267 PolarHBondContact O-N 3.28Å; E267-H269 VanDerWaalsContact C-N 3.31Å; E267-H269 PolarHBondContact O-N 3.25Å; E267-H269 PolarHBondContact O-ND1 2.81Å
268	E	49	Very low	47.6	Very low	167 Å²	167	117.7 Å²	117.7	78%	0.78	63%	0.628	S	S	*	*			trans	-59.1	101.4	167.7	-71.2	-175.2	167.1	0	0	107	N266 Y270	N266-E268 VanDerWaalsContact C-N 3.29Å; N266-E268 PolarHBondContact O-N 3Å; E268-Y270 PolarHBondContact O-N 3.33Å
269	H	43.4	Very low	48.5	Very low	153 Å²	153	111 Å²	111	71%	0.708	60%	0.597	S	S	*	*			trans	-67.7	104.4	179.1	-77.9	51.9	0	0	0	107.6	E267 T271	E267-H269 VanDerWaalsContact C-N 3.31Å; E267-H269 PolarHBondContact O-N 3.25Å; E267-H269 PolarHBondContact O-ND1 2.81Å; H269-T271 PolarHBondContact O-N 3.2Å
270	Y	52.5	Low	49.9	Very low	131 Å²	131	108.3 Å²	108.3	51%	0.514	59%	0.585	S	S	.	*			trans	-63.2	125.3	170.5	-99	-107.5	0	0	0	109.2	E268 M274	E268-Y270 PolarHBondContact O-N 3.33Å; Y270-M274 HydrophobicContact CD1-CB 3.4Å; Y270-M274 VanDerWaalsContact CD1-CB 3.4Å; Y270-M274 HydrophobicContact CD1-CE 3.61Å; Y270-M274 HydrophobicContact CD1-CG 4.07Å; Y270-M274 HydrophobicContact CD1-SD 3.5Å; Y270-M274 VanDerWaalsContact CD1-SD 3.5Å; Y270-M274 HydrophobicContact CD2-CE 4.25Å; Y270-M274 HydrophobicContact CD2-SD 4.31Å; Y270-M274 HydrophobicContact CE1-CB 3.74Å; Y270-M274 HydrophobicContact CE1-CE 3.17Å; Y270-M274 HydrophobicContact CE1-CG 4.33Å; Y270-M274 HydrophobicContact CE1-SD 3.78Å; Y270-M274 HydrophobicContact CE2-CE 3.89Å; Y270-M274 HydrophobicContact CG-CB 4.41Å; Y270-M274 HydrophobicContact CG-CE 4.11Å; Y270-M274 HydrophobicContact CG-SD 3.78Å
271	T	66.4	Low	51.1	Low	67 Å²	67	106.5 Å²	106.5	41%	0.411	58%	0.578	S	S	.	*			trans	-80.8	153.7	174.5	78	0	0	0	0	109.9	H269 E273 M274	H269-T271 PolarHBondContact O-N 3.2Å; T271-E273 WeakPolarHBondContact CB-OE2 3.4Å; T271-E273 PolarHBondContact O-N 3.45Å; T271-E273 PolarHBondContact OG1-OE2 3.45Å; T271-M274 WeakPolarHBondContact O-CB 3.46Å; T271-M274 PolarHBondContact O-N 3.22Å
272	P	58	Low	52.2	Low	67 Å²	67	106.5 Å²	106.5	44%	0.435	57%	0.568	S	S	.	*	H	α-helix	trans	-48.5	-31.3	173.9	-30.9	37.7	0	0	0	114.4	T234 L275 R276	T234-P272 HydrophobicContact CG2-CB 3.91Å; P272-L275 PolarHBondContact O-N 3.48Å; P272-R276 PolarHBondContact O-N 3.1Å; P272-R276 VanDerWaalsContact O-N 3.07Å
273	E	63.5	Low	53	Low	108 Å²	108	106.9 Å²	106.9	51%	0.505	56%	0.563	S	S	.	*	H	α-helix	trans	-63.3	-41.7	177.8	-66.5	67.3	-149.4	0	0	111.9	T271 L275 R276 E277	T271-E273 WeakPolarHBondContact CB-OE2 3.4Å; T271-E273 PolarHBondContact O-N 3.45Å; T271-E273 PolarHBondContact OG1-OE2 3.45Å; E273-L275 VanDerWaalsContact C-N 3.28Å; E273-L275 PolarHBondContact O-N 3.43Å; E273-R276 WeakPolarHBondContact O-CB 3.39Å; E273-R276 PolarHBondContact O-N 2.82Å; E273-R276 VanDerWaalsContact O-N 3.14Å; E273-E277 PolarHBondContact O-N 3.21Å
274	M	65.2	Low	53.5	Low	72 Å²	72	104.8 Å²	104.8	36%	0.355	55%	0.553	S	S	.	*	H	α-helix	trans	-64.1	-35.7	179	-62.2	177.5	81.6	0	0	111.6	Y270 T271 L278	Y270-M274 HydrophobicContact CD1-CB 3.4Å; Y270-M274 VanDerWaalsContact CD1-CB 3.4Å; Y270-M274 HydrophobicContact CD1-CE 3.61Å; Y270-M274 HydrophobicContact CD1-CG 4.07Å; Y270-M274 HydrophobicContact CD1-SD 3.5Å; Y270-M274 VanDerWaalsContact CD1-SD 3.5Å; Y270-M274 HydrophobicContact CD2-CE 4.25Å; Y270-M274 HydrophobicContact CD2-SD 4.31Å; Y270-M274 HydrophobicContact CE1-CB 3.74Å; Y270-M274 HydrophobicContact CE1-CE 3.17Å; Y270-M274 HydrophobicContact CE1-CG 4.33Å; Y270-M274 HydrophobicContact CE1-SD 3.78Å; Y270-M274 HydrophobicContact CE2-CE 3.89Å; Y270-M274 HydrophobicContact CG-CB 4.41Å; Y270-M274 HydrophobicContact CG-CE 4.11Å; Y270-M274 HydrophobicContact CG-SD 3.78Å; T271-M274 WeakPolarHBondContact O-CB 3.46Å; T271-M274 PolarHBondContact O-N 3.22Å; M274-L278 PolarHBondContact O-N 2.91Å
275	L	61.8	Low	54.3	Low	62 Å²	62	107 Å²	107	33%	0.325	56%	0.561	S	S	.	*	H	α-helix	trans	-69.1	-40.6	174.1	-173.6	67.3	0	0	0	111.4	V230 P272 E273 E277 L278 V279	V230-L275 HydrophobicContact CG1-CD2 3.87Å; V230-L275 HydrophobicContact CG1-CG 4.22Å; P272-L275 PolarHBondContact O-N 3.48Å; E273-L275 VanDerWaalsContact C-N 3.28Å; E273-L275 PolarHBondContact O-N 3.43Å; L275-E277 VanDerWaalsContact C-N 3.34Å; L275-E277 PolarHBondContact O-N 2.86Å; L275-L278 HydrophobicContact CD1-CD2 4.41Å; L275-L278 WeakPolarHBondContact O-CB 3.28Å; L275-L278 PolarHBondContact O-N 3.3Å; L275-V279 WeakPolarHBondContact O-CG2 3.28Å; L275-V279 PolarHBondContact O-N 3.32Å
276	R	62.3	Low	54.7	Low	124 Å²	124	116 Å²	116	47%	0.468	58%	0.584	S	S	.	*	H	α-helix	trans	-60.9	-42.8	173.9	-72.7	-176	-168.6	-176.3	5.2	111.6	T234 P272 E273 L278 V279 A280	T234-R276 PolarHBondContact OG1-NH2 3.15Å; P272-R276 PolarHBondContact O-N 3.1Å; P272-R276 VanDerWaalsContact O-N 3.07Å; E273-R276 WeakPolarHBondContact O-CB 3.39Å; E273-R276 PolarHBondContact O-N 2.82Å; E273-R276 VanDerWaalsContact O-N 3.14Å; R276-L278 VanDerWaalsContact C-N 3.34Å; R276-V279 PolarHBondContact O-N 2.68Å; R276-A280 VanDerWaalsContact O-CB 3.25Å; R276-A280 WeakPolarHBondContact O-CB 3.44Å; R276-A280 PolarHBondContact O-N 2.88Å
277	E	66.9	Low	55.9	Low	142 Å²	142	114.2 Å²	114.2	66%	0.664	57%	0.572	S	S	*	*	H	α-helix	trans	-62.2	-41.6	176	-74.6	-171.3	170.7	0	0	111.8	E273 L275 A280 S281	E273-E277 PolarHBondContact O-N 3.21Å; L275-E277 VanDerWaalsContact C-N 3.34Å; L275-E277 PolarHBondContact O-N 2.86Å; E277-A280 PolarHBondContact O-N 3.45Å; E277-S281 WeakPolarHBondContact O-CB 3.47Å; E277-S281 PolarHBondContact O-N 2.97Å
278	L	61	Low	56.9	Low	54 Å²	54	111.8 Å²	111.8	28%	0.283	56%	0.564	S	S	.	*	H	α-helix	trans	-59.2	-50.3	174.4	-171.5	80.9	0	0	0	111.1	L199 M274 L275 R276 A280 S281 L282	L199-L278 HydrophobicContact CD1-CD2 4.19Å; M274-L278 PolarHBondContact O-N 2.91Å; L275-L278 HydrophobicContact CD1-CD2 4.41Å; L275-L278 WeakPolarHBondContact O-CB 3.28Å; L275-L278 PolarHBondContact O-N 3.3Å; R276-L278 VanDerWaalsContact C-N 3.34Å; L278-A280 VanDerWaalsContact C-N 3.34Å; L278-A280 PolarHBondContact O-N 2.93Å; L278-S281 PolarHBondContact O-N 3.25Å; L278-S281 PolarHBondContact O-OG 2.88Å; L278-L282 WeakPolarHBondContact O-CG 3.16Å; L278-L282 PolarHBondContact O-N 2.75Å
279	V	60.9	Low	57.3	Low	44 Å²	44	108.8 Å²	108.8	27%	0.267	55%	0.552	S	S	.	*	H	α-helix	trans	-63.8	-39.9	178.4	173.7	0	0	0	0	111.5	V230 L275 R276 S281 L282 K283	V230-V279 HydrophobicContact CG1-CG2 4.3Å; L275-V279 WeakPolarHBondContact O-CG2 3.28Å; L275-V279 PolarHBondContact O-N 3.32Å; R276-V279 PolarHBondContact O-N 2.68Å; V279-S281 VanDerWaalsContact C-N 3.34Å; V279-S281 PolarHBondContact O-N 3.22Å; V279-L282 PolarHBondContact O-N 3.14Å; V279-K283 PolarHBondContact O-N 2.74Å
280	A	67	Low	58.1	Low	60 Å²	60	106.2 Å²	106.2	50%	0.496	54%	0.542	S	S	.	.	H	α-helix	trans	-63.5	-40.1	176	0	0	0	0	0	111.6	R276 E277 L278 L282 K283	R276-A280 VanDerWaalsContact O-CB 3.25Å; R276-A280 WeakPolarHBondContact O-CB 3.44Å; R276-A280 PolarHBondContact O-N 2.88Å; E277-A280 PolarHBondContact O-N 3.45Å; L278-A280 VanDerWaalsContact C-N 3.34Å; L278-A280 PolarHBondContact O-N 2.93Å; A280-L282 PolarHBondContact O-N 3.2Å; A280-K283 WeakPolarHBondContact O-CB 3.48Å; A280-K283 PolarHBondContact O-N 3.02Å; A280-K283 VanDerWaalsContact O-N 3.12Å
281	S	62.5	Low	58.5	Low	84 Å²	84	104.6 Å²	104.6	59%	0.587	54%	0.544	S	S	*	.	H	α-helix	trans	-65.3	-23.4	176.9	79.2	0	0	0	0	113.5	E277 L278 V279	E277-S281 WeakPolarHBondContact O-CB 3.47Å; E277-S281 PolarHBondContact O-N 2.97Å; L278-S281 PolarHBondContact O-N 3.25Å; L278-S281 PolarHBondContact O-OG 2.88Å; V279-S281 VanDerWaalsContact C-N 3.34Å; V279-S281 PolarHBondContact O-N 3.22Å
282	L	58.1	Low	57.9	Low	106 Å²	106	107.1 Å²	107.1	56%	0.555	55%	0.553	S	S	*	*	H	α-helix	trans	-83.2	-13.8	175.9	-70.8	168.9	0	0	0	113.4	L278 V279 A280 L284	L278-L282 WeakPolarHBondContact O-CG 3.16Å; L278-L282 PolarHBondContact O-N 2.75Å; V279-L282 PolarHBondContact O-N 3.14Å; A280-L282 PolarHBondContact O-N 3.2Å; L282-L284 VanDerWaalsContact C-N 3.3Å; L282-L284 PolarHBondContact O-N 2.92Å
283	K	50.6	Low	57.9	Low	159 Å²	159	110 Å²	110	69%	0.691	56%	0.562	S	S	*	*			trans	-69	91.7	174.2	-71.3	-172.2	176.8	-177.9	0	109	V279 A280	V279-K283 PolarHBondContact O-N 2.74Å; A280-K283 WeakPolarHBondContact O-CB 3.48Å; A280-K283 PolarHBondContact O-N 3.02Å; A280-K283 VanDerWaalsContact O-N 3.12Å
284	L	39.4	Very low	57.5	Low	124 Å²	124	110.2 Å²	110.2	65%	0.649	57%	0.566	S	S	*	*			trans	-56.6	133.8	169.3	-69	166.3	0	0	0	108.9	L282 F286	L282-L284 VanDerWaalsContact C-N 3.3Å; L282-L284 PolarHBondContact O-N 2.92Å; L284-F286 PolarHBondContact O-N 2.81Å
285	P	49.2	Very low	56.9	Low	123 Å²	123	113.3 Å²	113.3	80%	0.799	58%	0.584	S	S	*	*			trans	-63.5	120.4	167.1	27.1	-30.4	0	0	0	107.4
286	F	42.6	Very low	56.4	Low	278 Å²	278	118 Å²	118	100%	1.219	61%	0.607	S	S	*	*			trans	-64	0	170.3	-70.7	-81.7	0	0	0	110.9	L284	L284-F286 PolarHBondContact O-N 2.81Å

Retrieved 286 of 286 residues in 62.8 ms (Link to these results)

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