G4VQA4_SCHMA Loading...

EGF-like domain-containing protein

AlphaFold DB , UniProt , Accession G4VQA4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 500 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	33.5	Very low	33.6	Very low	227 Å²	227	125.6 Å²	125.6	100%	1.118	67%	0.672	S	S	*	*				0	103.5	0	-75	179.7	176.5	0	0	106.3	K3	M1-K3 PolarHBondContact O-N 3.27Å
2	D	31.3	Very low	33.1	Very low	158 Å²	158	129.7 Å²	129.7	85%	0.845	69%	0.692	S	S	*	*			trans	-61.6	120.8	175.7	-66.1	-41	0	0	0	108.4	I4	D2-I4 PolarHBondContact O-N 3.09Å
3	K	34.5	Very low	32.5	Very low	195 Å²	195	134.2 Å²	134.2	85%	0.848	70%	0.702	S	S	*	*			trans	-65.3	103.8	175.4	-78.5	-177.7	174.6	-177.7	0	107.5	M1 I5	M1-K3 PolarHBondContact O-N 3.27Å; K3-I5 PolarHBondContact O-N 2.82Å; K3-I5 VanDerWaalsContact O-N 3.1Å
4	I	38	Very low	32	Very low	99 Å²	99	131.8 Å²	131.8	51%	0.508	70%	0.696	S	S	.	*			trans	-74.9	100.8	170.1	-47.6	-179.5	0	0	0	106.5	D2 C6 C162	D2-I4 PolarHBondContact O-N 3.09Å; I4-C6 PolarHBondContact O-N 3.02Å; I4-C162 WeakPolarHBondContact CG2-SG 3.48Å
5	I	35.8	Very low	31.8	Very low	145 Å²	145	130.3 Å²	130.3	74%	0.744	69%	0.686	S	S	*	*			trans	-78	102.4	177.1	-59.1	173.6	0	0	0	107.4	K3	K3-I5 PolarHBondContact O-N 2.82Å; K3-I5 VanDerWaalsContact O-N 3.1Å
6	C	36	Very low	31.5	Very low	18 Å²	18	131.6 Å²	131.6	12%	0.122	70%	0.701	C	S	.	*			trans	-82.2	119	171.4	-48.4	0	0	0	0	108.9	I4 V8 C162	I4-C6 PolarHBondContact O-N 3.02Å; C6-V8 PolarHBondContact O-N 2.76Å; C6-C162 HydrophobicContact CB-CB 3.84Å; C6-C162 WeakPolarHBondContact CB-SG 3.07Å; C6-C162 WeakPolarHBondContact SG-CB 3.3Å; C6-C162 CovalentContact SG-SG 2.05Å; C6-C162 PolarHBondContact SG-SG 3.16Å
7	S	34.2	Very low	31.4	Very low	98 Å²	98	129.4 Å²	129.4	69%	0.685	70%	0.699	S	S	*	*			trans	-73.7	112.2	175.8	56.3	0	0	0	0	110.6	S9	S7-S9 PolarHBondContact O-N 2.99Å
8	V	35	Very low	31.4	Very low	75 Å²	75	126.9 Å²	126.9	46%	0.455	70%	0.699	S	S	.	*			trans	-71.7	-8.8	-178.3	175.8	0	0	0	0	113.3	C6	C6-V8 PolarHBondContact O-N 2.76Å
9	S	28.3	Very low	31.2	Very low	96 Å²	96	126.2 Å²	126.2	67%	0.671	69%	0.694	S	S	*	*			trans	-96.5	127.6	-166.5	-62	0	0	0	0	113.5	S7	S7-S9 PolarHBondContact O-N 2.99Å
10	V	28.4	Very low	31.1	Very low	123 Å²	123	130.2 Å²	130.2	75%	0.745	70%	0.704	S	S	*	*			trans	82.1	94.3	163.5	-165.4	0	0	0	0	115.2
11	F	34.8	Very low	31.2	Very low	148 Å²	148	125.9 Å²	125.9	65%	0.649	68%	0.684	S	S	*	*			trans	-166.3	31.7	147.7	-102.3	-64.3	0	0	0	115.6	F13 V14	F11-F13 PolarHBondContact O-N 3.39Å; F11-F13 VanDerWaalsContact O-N 3.11Å; F11-V14 HydrophobicContact CD1-CB 4.09Å; F11-V14 HydrophobicContact CD1-CG2 4.03Å; F11-V14 HydrophobicContact CE1-CB 3.79Å; F11-V14 HydrophobicContact CE1-CG2 3.58Å
12	L	27.5	Very low	31.2	Very low	174 Å²	174	119.4 Å²	119.4	91%	0.911	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	12.8	165.4	-119.6	155.9	0	0	0	113.1
13	F	24.9	Very low	31.1	Very low	188 Å²	188	123 Å²	123	83%	0.825	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.4	10.2	-163.3	-112.6	-79.3	0	0	0	119.4	F11	F11-F13 PolarHBondContact O-N 3.39Å; F11-F13 VanDerWaalsContact O-N 3.11Å
14	V	25.4	Very low	30.9	Very low	101 Å²	101	114.9 Å²	114.9	61%	0.612	62%	0.62	S	S	*	*			trans	-141.3	76.2	-178.7	-168.2	0	0	0	0	113	F11	F11-V14 HydrophobicContact CD1-CB 4.09Å; F11-V14 HydrophobicContact CD1-CG2 4.03Å; F11-V14 HydrophobicContact CE1-CB 3.79Å; F11-V14 HydrophobicContact CE1-CG2 3.58Å
15	I	30.2	Very low	30.5	Very low	109 Å²	109	119.5 Å²	119.5	56%	0.559	63%	0.632	S	S	*	*			trans	-153.8	82.6	143.4	-49.1	-176.4	0	0	0	108.7	T130	I15-T130 HydrophobicContact CD1-CG2 4.14Å
16	T	26.8	Very low	30.2	Very low	151 Å²	151	118.6 Å²	118.6	93%	0.926	63%	0.629	S	S	*	*			trans	-109.1	9.3	160.4	41.6	0	0	0	0	112.2
17	S	28.9	Very low	30.1	Very low	95 Å²	95	124.1 Å²	124.1	66%	0.664	65%	0.651	S	S	*	*			trans	-106.1	63	176.8	60	0	0	0	0	111	N19	S17-N19 VanDerWaalsContact C-N 3.27Å; S17-N19 PolarHBondContact O-N 3.22Å
18	A	31.7	Very low	30.1	Very low	85 Å²	85	122 Å²	122	70%	0.702	63%	0.631	S	S	*	*			trans	-72.1	87.6	166.7	0	0	0	0	0	108.4
19	N	27.8	Very low	30.1	Very low	113 Å²	113	123 Å²	123	60%	0.604	64%	0.638	S	S	*	*			trans	-72.7	129.9	177.2	-123.3	-14.9	0	0	0	109.4	S17 S21	S17-N19 VanDerWaalsContact C-N 3.27Å; S17-N19 PolarHBondContact O-N 3.22Å; N19-S21 VanDerWaalsContact C-N 3.32Å; N19-S21 PolarHBondContact O-N 3.44Å
20	K	30	Very low	30.4	Very low	205 Å²	205	128 Å²	128	89%	0.891	65%	0.651	S	S	*	*			trans	-8	78.8	171.7	-77.2	-179	173.8	179.6	0	114.1
21	S	32.6	Very low	30.7	Very low	41 Å²	41	130.6 Å²	130.6	29%	0.287	65%	0.654	S	S	.	*			trans	-96.4	141.1	169.5	58.9	0	0	0	0	108	N19 R23 T41 G43	N19-S21 VanDerWaalsContact C-N 3.32Å; N19-S21 PolarHBondContact O-N 3.44Å; S21-R23 PolarHBondContact O-N 3.47Å; S21-T41 PolarHBondContact OG-O 2.83Å; S21-G43 VanDerWaalsContact CB-CA 3.47Å; S21-G43 VanDerWaalsContact CB-N 3.35Å; S21-G43 PolarHBondContact OG-N 3.5Å
22	E	32.7	Very low	30.9	Very low	90 Å²	90	126.1 Å²	126.1	42%	0.421	64%	0.638	S	S	.	*			trans	-55.5	126.8	172.3	-84	175.1	148.2	0	0	108.4	V24 R117	E22-V24 PolarHBondContact O-N 2.83Å; E22-V24 VanDerWaalsContact O-N 3.1Å; E22-R117 IonicContact OE2-CZ 3.61Å; E22-R117 VanDerWaalsContact OE2-CZ 3.3Å; E22-R117 IonicContact OE2-NH1 3.96Å; E22-R117 PolarHBondContact OE2-NH1 2.74Å; E22-R117 IonicContact OE2-NH2 3.91Å; E22-R117 PolarHBondContact OE2-NH2 3.48Å
23	R	28.9	Very low	31.2	Very low	235 Å²	235	126.8 Å²	126.8	89%	0.887	64%	0.636	S	S	*	*			trans	-63.3	114	-179.5	-69.2	-175.1	-165.2	-178.2	3.1	107.8	S21	S21-R23 PolarHBondContact O-N 3.47Å
24	V	31.9	Very low	31.7	Very low	24 Å²	24	126.6 Å²	126.6	15%	0.145	64%	0.635	C	S	.	*			trans	-78.4	125.2	172	178.4	0	0	0	0	105.9	E22 T41	E22-V24 PolarHBondContact O-N 2.83Å; E22-V24 VanDerWaalsContact O-N 3.1Å; V24-T41 HydrophobicContact CB-CG2 3.94Å; V24-T41 HydrophobicContact CG1-CG2 4.44Å
25	Y	28.2	Very low	32	Very low	195 Å²	195	125.2 Å²	125.2	77%	0.765	64%	0.641	S	S	*	*			trans	-62.4	136.9	179.4	-76.5	-91.4	0	0	0	110.3	F27	Y25-F27 VanDerWaalsContact C-N 3.28Å; Y25-F27 PolarHBondContact O-N 3.31Å
26	D	30	Very low	32.2	Very low	126 Å²	126	126.4 Å²	126.4	67%	0.674	64%	0.639	S	S	*	*			trans	-60.3	89.6	166.3	-76.2	-37	0	0	0	108.9
27	F	34.1	Very low	32.7	Very low	134 Å²	134	124.1 Å²	124.1	59%	0.588	63%	0.63	S	S	*	*			trans	-101.4	73.8	160.3	-86.1	-83.7	0	0	0	107.4	Y25 H115	Y25-F27 VanDerWaalsContact C-N 3.28Å; Y25-F27 PolarHBondContact O-N 3.31Å; F27-H115 AromaticContact CE1-ND1 3.98Å; F27-H115 AromaticContact CZ-ND1 3.69Å
28	I	34.4	Very low	33	Very low	54 Å²	54	125.8 Å²	125.8	28%	0.277	63%	0.63	S	S	.	*			trans	-114.1	125.3	164.5	-47.5	-176.2	0	0	0	106.3	D32	I28-D32 HydrophobicContact CB-CB 4.19Å; I28-D32 HydrophobicContact CG2-CB 3.42Å; I28-D32 VanDerWaalsContact CG2-CB 3.42Å; I28-D32 WeakPolarHBondContact CG2-OD2 3.49Å
29	T	35.2	Very low	33.3	Very low	96 Å²	96	123.9 Å²	123.9	59%	0.589	61%	0.606	S	S	*	*			trans	-38.8	148	177.1	44.5	0	0	0	0	112.3	Q31 D32	T29-Q31 PolarHBondContact O-N 2.6Å; T29-D32 PolarHBondContact O-N 3.22Å
30	E	33.3	Very low	34	Very low	202 Å²	202	126.7 Å²	126.7	94%	0.944	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-47.8	-7.5	178.6	-73.2	179.9	154.8	0	0	115.8
31	Q	36.3	Very low	35	Very low	176 Å²	176	117.8 Å²	117.8	82%	0.822	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.3	-10.5	174.7	-83	-178	-26.8	0	0	116.1	T29 E33	T29-Q31 PolarHBondContact O-N 2.6Å; Q31-E33 PolarHBondContact O-N 2.79Å
32	D	38	Very low	36.4	Very low	55 Å²	55	118.3 Å²	118.3	29%	0.294	58%	0.577	S	S	.	*			trans	-97.5	36.2	-174.1	-82.3	24.3	0	0	0	114.4	I28 T29 K34	I28-D32 HydrophobicContact CB-CB 4.19Å; I28-D32 HydrophobicContact CG2-CB 3.42Å; I28-D32 VanDerWaalsContact CG2-CB 3.42Å; I28-D32 WeakPolarHBondContact CG2-OD2 3.49Å; T29-D32 PolarHBondContact O-N 3.22Å; D32-K34 PolarHBondContact O-N 3.46Å
33	E	33.9	Very low	38.3	Very low	188 Å²	188	114 Å²	114	88%	0.879	56%	0.558	S	S	*	*			trans	-61	-2.9	169.2	-75.2	-168	152.4	0	0	113.8	Q31	Q31-E33 PolarHBondContact O-N 2.79Å
34	K	35.8	Very low	40.8	Very low	183 Å²	183	102.9 Å²	102.9	80%	0.796	52%	0.516	S	S	*	.	S	Bend	trans	-108.7	81.5	-179.7	-69.6	-177.9	-179.1	174.2	0	112.4	D32 Y36	D32-K34 PolarHBondContact O-N 3.46Å; K34-Y36 PolarHBondContact O-N 2.81Å
35	G	31.6	Very low	43.4	Very low	72 Å²	72	103.7 Å²	103.7	74%	0.742	52%	0.516	S	S	*	.			trans	79	13.9	131.4	0	0	0	0	0	120.2	S37	G35-S37 PolarHBondContact O-N 3.36Å
36	Y	33.7	Very low	46.2	Very low	134 Å²	134	95.8 Å²	95.8	53%	0.525	49%	0.488	S	S	.	.			trans	-96.8	69.5	172.2	-71.7	-77.2	0	0	0	112.6	K34 I38	K34-Y36 PolarHBondContact O-N 2.81Å; Y36-I38 PolarHBondContact O-N 2.85Å
37	S	37.1	Very low	49	Very low	104 Å²	104	90 Å²	90	73%	0.727	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	10.1	174.3	78.9	0	0	0	0	114.4	G35 Q39 E40	G35-S37 PolarHBondContact O-N 3.36Å; S37-Q39 PolarHBondContact O-N 3.43Å; S37-E40 PolarHBondContact O-N 2.98Å
38	I	35.4	Very low	51.5	Low	130 Å²	130	89.9 Å²	89.9	67%	0.667	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-9.1	179.5	-73.3	171.8	0	0	0	111.7	Y36 E40	Y36-I38 PolarHBondContact O-N 2.85Å; I38-E40 PolarHBondContact O-N 3.44Å
39	Q	39.5	Very low	54.1	Low	44 Å²	44	90.9 Å²	90.9	21%	0.206	46%	0.462	C	S	.	.			trans	-77.5	42.1	164.2	-69.3	-167	6.7	0	0	112.6	S37 T41	S37-Q39 PolarHBondContact O-N 3.43Å; Q39-T41 HydrophobicContact CB-CG2 3.73Å; Q39-T41 HydrophobicContact CG-CG2 4.13Å; Q39-T41 WeakPolarHBondContact O-CA 3.48Å; Q39-T41 WeakPolarHBondContact O-CB 3.29Å; Q39-T41 PolarHBondContact O-N 2.83Å; Q39-T41 PolarHBondContact O-OG1 3.06Å; Q39-T41 VanDerWaalsContact O-OG1 3.08Å
40	E	41	Very low	56.6	Low	173 Å²	173	86.3 Å²	86.3	81%	0.808	43%	0.434	S	S	*	.	S	Bend	trans	-60.3	80	140.8	-80.6	-170.4	157.7	0	0	105.9	S37 I38 I42	S37-E40 PolarHBondContact O-N 2.98Å; I38-E40 PolarHBondContact O-N 3.44Å; E40-I42 PolarHBondContact O-N 2.87Å
41	T	51.3	Low	59.1	Low	17 Å²	17	82 Å²	82	10%	0.104	41%	0.414	C	S	.	.			trans	-68.4	122.9	-143.4	4	0	0	0	0	107.5	S21 V24 Q39 G43 L124	S21-T41 PolarHBondContact OG-O 2.83Å; V24-T41 HydrophobicContact CB-CG2 3.94Å; V24-T41 HydrophobicContact CG1-CG2 4.44Å; Q39-T41 HydrophobicContact CB-CG2 3.73Å; Q39-T41 HydrophobicContact CG-CG2 4.13Å; Q39-T41 WeakPolarHBondContact O-CA 3.48Å; Q39-T41 WeakPolarHBondContact O-CB 3.29Å; Q39-T41 PolarHBondContact O-N 2.83Å; Q39-T41 PolarHBondContact O-OG1 3.06Å; Q39-T41 VanDerWaalsContact O-OG1 3.08Å; T41-G43 PolarHBondContact O-N 2.78Å; T41-L124 HydrophobicContact CG2-CD1 4.28Å
42	I	63.1	Low	61.5	Low	52 Å²	52	76.6 Å²	76.6	27%	0.267	39%	0.39	S	S	.	.			trans	-61	94.7	169.3	-50.1	176.2	0	0	0	105.7	E40 W120 L124 M127 I168	E40-I42 PolarHBondContact O-N 2.87Å; I42-W120 PolarHBondContact O-NE1 3.1Å; I42-L124 HydrophobicContact CB-CD2 4.14Å; I42-M127 HydrophobicContact CD1-CE 3.94Å; I42-I168 HydrophobicContact CB-CD1 4.06Å; I42-I168 HydrophobicContact CG2-CB 3.98Å; I42-I168 HydrophobicContact CG2-CD1 3.31Å; I42-I168 HydrophobicContact CG2-CG1 3.56Å
43	G	72	Confident	63.9	Low	1 Å²	1	79.8 Å²	79.8	1%	0.01	41%	0.407	C	S	.	.			trans	-74.9	151.4	-166.6	0	0	0	0	0	110.3	S21 T41	S21-G43 VanDerWaalsContact CB-CA 3.47Å; S21-G43 VanDerWaalsContact CB-N 3.35Å; S21-G43 PolarHBondContact OG-N 3.5Å; T41-G43 PolarHBondContact O-N 2.78Å
44	F	82.2	Confident	66.4	Low	0 Å²	0	75.9 Å²	75.9	0%	0	39%	0.388	C	S	.	.			trans	-49.1	143.2	172.6	167.4	-103	0	0	0	111.5	T46 W120 Y175 I176 V195	F44-T46 HydrophobicContact CE1-CG2 3.84Å; F44-W120 HydrophobicContact CB-CD2 4.14Å; F44-W120 HydrophobicContact CB-CG 4.46Å; F44-W120 HydrophobicContact CB-CZ2 4.13Å; F44-W120 HydrophobicContact CD2-CE3 4.39Å; F44-W120 HydrophobicContact CD2-CH2 4.38Å; F44-W120 HydrophobicContact CD2-CZ3 4.28Å; F44-Y175 AromaticContact CD2-CD1 3.72Å; F44-Y175 HydrophobicContact CD2-CD1 3.72Å; F44-Y175 HydrophobicContact CD2-CE1 4.17Å; F44-Y175 AromaticContact CE2-CD1 3.57Å; F44-Y175 HydrophobicContact CE2-CD1 3.57Å; F44-Y175 HydrophobicContact CE2-CE1 4.09Å; F44-Y175 HydrophobicContact CZ-CD1 4.36Å; F44-I176 HydrophobicContact CE2-CD1 3.86Å; F44-I176 HydrophobicContact CE2-CG1 3.65Å; F44-I176 HydrophobicContact CZ-CD1 3.77Å; F44-I176 HydrophobicContact CZ-CG1 3.65Å; F44-V195 HydrophobicContact CE1-CG1 3.77Å; F44-V195 HydrophobicContact CZ-CB 4.27Å; F44-V195 HydrophobicContact CZ-CG1 3.85Å
45	R	85.8	Confident	69	Low	41 Å²	41	68.1 Å²	68.1	16%	0.155	35%	0.354	C	S	.	.			trans	-115	123.2	175.7	-68.1	-175	-178.4	178.1	-3.1	110.9	Q49 M50 H51 I168 D169 S172	R45-Q49 HydrophobicContact CB-CB 4.09Å; R45-Q49 HydrophobicContact CG-CB 4.32Å; R45-M50 HydrophobicContact CB-CG 4.25Å; R45-M50 WeakPolarHBondContact O-CE 3.2Å; R45-H51 PolarHBondContact NH1-CD2 2.84Å; R45-H51 PolarHBondContact NH1-NE2 3.42Å; R45-H51 VanDerWaalsContact NH1-NE2 3.16Å; R45-H51 PolarHBondContact NH2-NE2 2.88Å; R45-I168 VanDerWaalsContact NE-CG2 3.29Å; R45-I168 VanDerWaalsContact NH1-CG2 3.35Å; R45-D169 WeakPolarHBondContact CD-OD1 3.5Å; R45-D169 IonicContact CZ-OD1 3.03Å; R45-D169 IonicContact NE-OD1 2.85Å; R45-D169 IonicContact NH1-OD1 3.3Å; R45-D169 PolarHBondContact NH1-OD1 2.97Å; R45-S172 PolarHBondContact N-OG 3.23Å; R45-S172 VanDerWaalsContact O-CB 3.29Å; R45-S172 WeakPolarHBondContact O-CB 3.31Å
46	T	86.7	Confident	71.8	Confident	30 Å²	30	69.2 Å²	69.2	18%	0.184	34%	0.336	C	S	.	.			trans	-65.8	163.5	165.7	68.4	0	0	0	0	110.1	F44 Q48 Q49 M50 V195	F44-T46 HydrophobicContact CE1-CG2 3.84Å; T46-Q48 PolarHBondContact O-N 2.01Å; T46-Q48 VanDerWaalsContact O-N 3.09Å; T46-Q49 PolarHBondContact O-N 3.44Å; T46-Q49 WeakPolarHBondContact OG1-CG 3.22Å; T46-Q49 PolarHBondContact OG1-OE1 2.99Å; T46-M50 WeakPolarHBondContact O-CG 3.4Å; T46-M50 PolarHBondContact O-N 3.22Å; T46-V195 HydrophobicContact CG2-CG1 4.11Å
47	F	89	Confident	74.6	Confident	5 Å²	5	66.8 Å²	66.8	2%	0.022	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-51.6	-37.1	178	-69.8	-63.8	0	0	0	113.3	Q49 M50 Y55 R56 E59 F62 L173 I176 V195 P197	F47-Q49 VanDerWaalsContact C-N 3.3Å; F47-Q49 PolarHBondContact O-N 3.33Å; F47-M50 HydrophobicContact CD1-CE 3.91Å; F47-M50 HydrophobicContact CD1-SD 3.97Å; F47-M50 HydrophobicContact CE1-CE 4.3Å; F47-M50 PolarHBondContact O-N 2.99Å; F47-Y55 WeakPolarHBondContact CD1-O 2.97Å; F47-R56 WeakPolarHBondContact O-CG 3.45Å; F47-E59 HydrophobicContact CB-CB 3.76Å; F47-E59 HydrophobicContact CB-CG 4.13Å; F47-E59 HydrophobicContact CD1-CB 4.4Å; F47-E59 HydrophobicContact CD2-CB 3.68Å; F47-E59 HydrophobicContact CD2-CG 3.79Å; F47-E59 HydrophobicContact CE2-CB 4.33Å; F47-E59 HydrophobicContact CG-CB 3.71Å; F47-E59 HydrophobicContact CG-CG 4.2Å; F47-F62 HydrophobicContact CZ-CZ 4.13Å; F47-L173 HydrophobicContact CD1-CD2 4.04Å; F47-L173 HydrophobicContact CE1-CD2 3.44Å; F47-L173 VanDerWaalsContact CE1-CD2 3.44Å; F47-L173 HydrophobicContact CZ-CD2 4.45Å; F47-I176 HydrophobicContact CD1-CD1 4.49Å; F47-I176 HydrophobicContact CD2-CD1 4.49Å; F47-I176 HydrophobicContact CE1-CD1 4.18Å; F47-I176 HydrophobicContact CE2-CD1 4.22Å; F47-I176 HydrophobicContact CE2-CG2 4.01Å; F47-I176 HydrophobicContact CZ-CD1 4.01Å; F47-I176 HydrophobicContact CZ-CG2 3.75Å; F47-V195 WeakPolarHBondContact CE2-O 3.39Å; F47-P197 HydrophobicContact CE2-CG 3.96Å; F47-P197 HydrophobicContact CZ-CG 3.75Å
48	Q	86.1	Confident	77.3	Confident	131 Å²	131	62.2 Å²	62.2	61%	0.612	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-71	-26.8	-179.2	-61.6	178.5	4.9	0	0	112.9	T46	T46-Q48 PolarHBondContact O-N 2.01Å; T46-Q48 VanDerWaalsContact O-N 3.09Å
49	Q	88.4	Confident	79.9	Confident	74 Å²	74	58 Å²	58	35%	0.346	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-88.9	-13.3	-178.3	-66.6	168.7	-18.6	0	0	113.3	R45 T46 F47	R45-Q49 HydrophobicContact CB-CB 4.09Å; R45-Q49 HydrophobicContact CG-CB 4.32Å; T46-Q49 PolarHBondContact O-N 3.44Å; T46-Q49 WeakPolarHBondContact OG1-CG 3.22Å; T46-Q49 PolarHBondContact OG1-OE1 2.99Å; F47-Q49 VanDerWaalsContact C-N 3.3Å; F47-Q49 PolarHBondContact O-N 3.33Å
50	M	88.5	Confident	82.4	Confident	0 Å²	0	57 Å²	57	0%	0	27%	0.27	C	S	.	.			trans	-62.8	143.5	179.9	-68.3	173.4	-173.2	0	0	111	R45 T46 F47 R56 D169 L173 I176	R45-M50 HydrophobicContact CB-CG 4.25Å; R45-M50 WeakPolarHBondContact O-CE 3.2Å; T46-M50 WeakPolarHBondContact O-CG 3.4Å; T46-M50 PolarHBondContact O-N 3.22Å; F47-M50 HydrophobicContact CD1-CE 3.91Å; F47-M50 HydrophobicContact CD1-SD 3.97Å; F47-M50 HydrophobicContact CE1-CE 4.3Å; F47-M50 PolarHBondContact O-N 2.99Å; M50-R56 HydrophobicContact CB-CG 4.27Å; M50-R56 PolarHBondContact O-NE 3.09Å; M50-R56 PolarHBondContact O-NH2 3.42Å; M50-D169 WeakPolarHBondContact CA-OD1 3.19Å; M50-D169 HydrophobicContact CB-CB 4.08Å; M50-D169 HydrophobicContact CG-CB 3.86Å; M50-D169 HydrophobicContact SD-CB 4.41Å; M50-L173 HydrophobicContact CE-CD2 3.56Å; M50-L173 HydrophobicContact CE-CG 3.94Å; M50-L173 HydrophobicContact SD-CD2 3.74Å; M50-L173 HydrophobicContact SD-CG 4.11Å; M50-I176 HydrophobicContact CE-CD1 3.79Å
51	H	86.4	Confident	84.9	Confident	113 Å²	113	48.8 Å²	48.8	52%	0.523	23%	0.231	S	C	.	.	S	Bend	trans	-79.3	-36	179.6	-70.6	-38.2	0	0	0	111.9	R45 L53 D169	R45-H51 PolarHBondContact NH1-CD2 2.84Å; R45-H51 PolarHBondContact NH1-NE2 3.42Å; R45-H51 VanDerWaalsContact NH1-NE2 3.16Å; R45-H51 PolarHBondContact NH2-NE2 2.88Å; H51-L53 PolarHBondContact O-N 3.47Å; H51-D169 PolarHBondContact N-OD1 2.95Å; H51-D169 PolarHBondContact N-OD2 2.58Å
52	N	85.7	Confident	86.9	Confident	62 Å²	62	48 Å²	48	33%	0.332	23%	0.226	S	C	.	.	S	Bend	trans	-78.2	118.6	178.8	-172.5	-17.6	0	0	0	111.1	Q54 Y55 R56 D169	N52-Q54 VanDerWaalsContact C-N 3.26Å; N52-Q54 PolarHBondContact O-N 2.88Å; N52-Q54 WeakPolarHBondContact OD1-CB 3.36Å; N52-Q54 PolarHBondContact OD1-N 2.94Å; N52-Y55 HydrophobicContact CB-CD2 3.61Å; N52-Y55 HydrophobicContact CB-CE2 4.17Å; N52-Y55 HydrophobicContact CB-CG 3.92Å; N52-Y55 WeakPolarHBondContact O-CB 3.41Å; N52-Y55 PolarHBondContact O-N 3.45Å; N52-R56 PolarHBondContact O-N 2.84Å; N52-R56 VanDerWaalsContact O-N 3.15Å; N52-D169 PolarHBondContact N-OD2 3.26Å
53	L	88	Confident	88.2	Confident	122 Å²	122	47 Å²	47	64%	0.639	22%	0.223	S	C	*	.	H	α-helix	trans	-56.1	-38.1	177.4	-69.5	173.3	0	0	0	112.9	H51 Y55 R56 E57	H51-L53 PolarHBondContact O-N 3.47Å; L53-Y55 PolarHBondContact O-N 3.32Å; L53-R56 WeakPolarHBondContact O-CB 3.45Å; L53-R56 PolarHBondContact O-N 3.21Å; L53-R56 VanDerWaalsContact O-N 3.16Å; L53-E57 WeakPolarHBondContact O-CG 3.27Å; L53-E57 PolarHBondContact O-N 3.21Å
54	Q	88	Confident	88.8	Confident	105 Å²	105	51 Å²	51	49%	0.491	25%	0.249	S	C	.	.	H	α-helix	trans	-60.9	-36.5	177.3	-174.2	-176.2	-2.8	0	0	111.7	N52 E57 Y58	N52-Q54 VanDerWaalsContact C-N 3.26Å; N52-Q54 PolarHBondContact O-N 2.88Å; N52-Q54 WeakPolarHBondContact OD1-CB 3.36Å; N52-Q54 PolarHBondContact OD1-N 2.94Å; Q54-E57 PolarHBondContact O-N 2.83Å; Q54-Y58 PolarHBondContact NE2-OH 2.87Å
55	Y	89.7	Confident	88.9	Confident	20 Å²	20	53.8 Å²	53.8	8%	0.078	28%	0.278	C	S	.	.	H	α-helix	trans	-74.5	-34.1	178	-63.5	-17	0	0	0	111.8	F47 N52 L53 E57 Y58 D169 Q170 L173	F47-Y55 WeakPolarHBondContact CD1-O 2.97Å; N52-Y55 HydrophobicContact CB-CD2 3.61Å; N52-Y55 HydrophobicContact CB-CE2 4.17Å; N52-Y55 HydrophobicContact CB-CG 3.92Å; N52-Y55 WeakPolarHBondContact O-CB 3.41Å; N52-Y55 PolarHBondContact O-N 3.45Å; L53-Y55 PolarHBondContact O-N 3.32Å; Y55-E57 PolarHBondContact O-N 3.35Å; Y55-Y58 HydrophobicContact CD1-CD2 4.32Å; Y55-Y58 AromaticContact CD1-CE2 3.75Å; Y55-Y58 HydrophobicContact CD1-CE2 3.75Å; Y55-Y58 HydrophobicContact CE1-CE2 4.31Å; Y55-Y58 WeakPolarHBondContact O-CB 2.97Å; Y55-Y58 PolarHBondContact O-N 3.01Å; Y55-D169 HydrophobicContact CD2-CB 3.57Å; Y55-D169 HydrophobicContact CE2-CB 4.08Å; Y55-Q170 HydrophobicContact CE2-CB 4.35Å; Y55-L173 HydrophobicContact CD1-CD1 3.48Å; Y55-L173 VanDerWaalsContact CD1-CD1 3.48Å; Y55-L173 HydrophobicContact CD2-CD1 3.97Å; Y55-L173 HydrophobicContact CE1-CD1 3.88Å; Y55-L173 HydrophobicContact CE2-CD1 4.32Å; Y55-L173 HydrophobicContact CG-CD1 3.52Å; Y55-L173 HydrophobicContact CG-CG 4.47Å
56	R	91.5	Very high	89	Confident	96 Å²	96	52 Å²	52	36%	0.362	27%	0.271	S	S	.	.	H	α-helix	trans	-59.1	-37.2	172	-54.1	-159.4	177.1	154.5	0.7	112	F47 M50 N52 L53 Y58 E59	F47-R56 WeakPolarHBondContact O-CG 3.45Å; M50-R56 HydrophobicContact CB-CG 4.27Å; M50-R56 PolarHBondContact O-NE 3.09Å; M50-R56 PolarHBondContact O-NH2 3.42Å; N52-R56 PolarHBondContact O-N 2.84Å; N52-R56 VanDerWaalsContact O-N 3.15Å; L53-R56 WeakPolarHBondContact O-CB 3.45Å; L53-R56 PolarHBondContact O-N 3.21Å; L53-R56 VanDerWaalsContact O-N 3.16Å; R56-Y58 PolarHBondContact O-N 3.36Å; R56-E59 WeakPolarHBondContact O-CB 3.42Å; R56-E59 PolarHBondContact O-N 2.91Å
57	E	92.3	Very high	89	Confident	83 Å²	83	55.2 Å²	55.2	39%	0.388	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-62.8	-23.7	-178.7	-65.4	-153.3	119.8	0	0	113.8	L53 Q54 Y55 E59 N60 R202	L53-E57 WeakPolarHBondContact O-CG 3.27Å; L53-E57 PolarHBondContact O-N 3.21Å; Q54-E57 PolarHBondContact O-N 2.83Å; Y55-E57 PolarHBondContact O-N 3.35Å; E57-E59 PolarHBondContact O-N 3.44Å; E57-N60 PolarHBondContact O-N 3.36Å; E57-N60 PolarHBondContact O-ND2 3.17Å; E57-R202 IonicContact OE1-CZ 3.68Å; E57-R202 IonicContact OE1-NH2 3.89Å; E57-R202 PolarHBondContact OE1-NH2 2.03Å
58	Y	92.3	Very high	88.5	Confident	8 Å²	8	57.2 Å²	57.2	3%	0.031	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-67.8	-8.4	178.4	-60.6	-21.7	0	0	0	113.6	Q54 Y55 R56 N60 G61 F62 P63 I66 I71 L173 P197	Q54-Y58 PolarHBondContact NE2-OH 2.87Å; Y55-Y58 HydrophobicContact CD1-CD2 4.32Å; Y55-Y58 AromaticContact CD1-CE2 3.75Å; Y55-Y58 HydrophobicContact CD1-CE2 3.75Å; Y55-Y58 HydrophobicContact CE1-CE2 4.31Å; Y55-Y58 WeakPolarHBondContact O-CB 2.97Å; Y55-Y58 PolarHBondContact O-N 3.01Å; R56-Y58 PolarHBondContact O-N 3.36Å; Y58-N60 PolarHBondContact O-N 2.85Å; Y58-N60 VanDerWaalsContact O-N 3.15Å; Y58-G61 CarbonylContact O-C 3.44Å; Y58-G61 PolarHBondContact O-N 2.86Å; Y58-F62 HydrophobicContact CD2-CD1 4.12Å; Y58-F62 HydrophobicContact CD2-CE1 4.3Å; Y58-F62 HydrophobicContact CG-CD1 4.15Å; Y58-P63 HydrophobicContact CE1-CG 4.03Å; Y58-I66 HydrophobicContact CE2-CD1 4.31Å; Y58-I71 HydrophobicContact CE2-CD1 4.19Å; Y58-I71 WeakPolarHBondContact OH-CD1 3.37Å; Y58-L173 HydrophobicContact CD2-CD1 3.7Å; Y58-L173 HydrophobicContact CD2-CD2 3.83Å; Y58-L173 HydrophobicContact CD2-CG 4.43Å; Y58-L173 HydrophobicContact CE2-CD1 3.84Å; Y58-P197 WeakPolarHBondContact O-CB 3.35Å; Y58-P197 WeakPolarHBondContact O-CG 3.48Å
59	E	91.6	Very high	88.3	Confident	41 Å²	41	52.6 Å²	52.6	19%	0.192	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-55.3	-26.3	163.7	-165.7	-176.3	-158.2	0	0	112.2	F47 R56 E57 G61 P197 N198 K201	F47-E59 HydrophobicContact CB-CB 3.76Å; F47-E59 HydrophobicContact CB-CG 4.13Å; F47-E59 HydrophobicContact CD1-CB 4.4Å; F47-E59 HydrophobicContact CD2-CB 3.68Å; F47-E59 HydrophobicContact CD2-CG 3.79Å; F47-E59 HydrophobicContact CE2-CB 4.33Å; F47-E59 HydrophobicContact CG-CB 3.71Å; F47-E59 HydrophobicContact CG-CG 4.2Å; R56-E59 WeakPolarHBondContact O-CB 3.42Å; R56-E59 PolarHBondContact O-N 2.91Å; E57-E59 PolarHBondContact O-N 3.44Å; E59-G61 VanDerWaalsContact C-N 3.33Å; E59-P197 CarbonylContact O-C 3.46Å; E59-P197 VanDerWaalsContact O-CA 3.3Å; E59-P197 WeakPolarHBondContact O-CA 3.46Å; E59-N198 PolarHBondContact O-N 2.91Å; E59-K201 HydrophobicContact CG-CD 4.34Å; E59-K201 IonicContact OE1-NZ 2.78Å; E59-K201 PolarHBondContact OE1-NZ 3Å; E59-K201 IonicContact OE2-NZ 2.83Å; E59-K201 PolarHBondContact OE2-NZ 2.83Å
60	N	91.4	Very high	87.6	Confident	23 Å²	23	53 Å²	53	12%	0.123	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-93.8	12.7	177.1	-49.2	-71.9	0	0	0	113	E57 Y58 P199 R202	E57-N60 PolarHBondContact O-N 3.36Å; E57-N60 PolarHBondContact O-ND2 3.17Å; Y58-N60 PolarHBondContact O-N 2.85Å; Y58-N60 VanDerWaalsContact O-N 3.15Å; N60-P199 VanDerWaalsContact O-CA 3.29Å; N60-P199 WeakPolarHBondContact O-CA 3.17Å; N60-R202 HydrophobicContact CB-CG 4.07Å; N60-R202 PolarHBondContact ND2-NE 3.39Å; N60-R202 VanDerWaalsContact ND2-NE 3.15Å; N60-R202 WeakPolarHBondContact OD1-CG 3.21Å
61	G	92.4	Very high	87.4	Confident	0 Å²	0	54 Å²	54	0%	0	30%	0.301	C	S	.	.			trans	118.8	141.9	-179.3	0	0	0	0	0	112.5	Y58 E59 Y221 K223	Y58-G61 CarbonylContact O-C 3.44Å; Y58-G61 PolarHBondContact O-N 2.86Å; E59-G61 VanDerWaalsContact C-N 3.33Å; G61-Y221 CarbonylContact C-O 3.56Å; G61-Y221 VanDerWaalsContact CA-O 3.26Å; G61-Y221 WeakPolarHBondContact CA-O 3.45Å; G61-K223 WeakPolarHBondContact O-CE 3.16Å; G61-K223 WeakPolarHBondContact O-CG 3.39Å
62	F	93.6	Very high	87.4	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	28%	0.276	C	S	.	.	B	Isolated β-bridge	trans	-72.9	145.7	171.9	-68.6	-71.4	0	0	0	111.3	F47 Y58 I66 L173 I176 Y177 P197 Y221 H222 K223	F47-F62 HydrophobicContact CZ-CZ 4.13Å; Y58-F62 HydrophobicContact CD2-CD1 4.12Å; Y58-F62 HydrophobicContact CD2-CE1 4.3Å; Y58-F62 HydrophobicContact CG-CD1 4.15Å; F62-I66 HydrophobicContact CB-CD1 4.3Å; F62-I66 HydrophobicContact CB-CG2 3.87Å; F62-I66 HydrophobicContact CD1-CD1 3.42Å; F62-I66 VanDerWaalsContact CD1-CD1 3.42Å; F62-I66 HydrophobicContact CE1-CD1 4.05Å; F62-I66 HydrophobicContact CG-CD1 4.21Å; F62-I66 HydrophobicContact CG-CG2 4.33Å; F62-L173 HydrophobicContact CE1-CB 4.5Å; F62-L173 HydrophobicContact CE1-CD2 4.02Å; F62-I176 HydrophobicContact CE2-CG2 4.37Å; F62-I176 HydrophobicContact CZ-CB 4.5Å; F62-I176 HydrophobicContact CZ-CG2 4.09Å; F62-Y177 HydrophobicContact CD1-CD2 4.37Å; F62-Y177 AromaticContact CD2-CD2 3.53Å; F62-Y177 HydrophobicContact CD2-CD2 3.53Å; F62-Y177 HydrophobicContact CD2-CE2 4.18Å; F62-Y177 HydrophobicContact CE1-CD2 4.44Å; F62-Y177 AromaticContact CE2-CD2 3.64Å; F62-Y177 HydrophobicContact CE2-CD2 3.64Å; F62-Y177 HydrophobicContact CE2-CG 4.24Å; F62-Y177 AromaticContact CG-CD2 3.91Å; F62-Y177 HydrophobicContact CG-CD2 3.91Å; F62-Y177 HydrophobicContact CG-CE2 4.43Å; F62-Y177 HydrophobicContact CZ-CD2 4.11Å; F62-Y177 HydrophobicContact CZ-CG 4.48Å; F62-P197 HydrophobicContact CD2-CG 3.59Å; F62-P197 HydrophobicContact CE2-CG 3.33Å; F62-P197 HydrophobicContact CG-CG 4.49Å; F62-P197 HydrophobicContact CZ-CG 4.06Å; F62-Y221 PolarHBondContact N-O 3.32Å; F62-H222 CarbonylContact O-C 3.22Å; F62-H222 WeakPolarHBondContact O-CA 3.41Å; F62-H222 WeakPolarHBondContact O-CB 3.35Å; F62-H222 PolarHBondContact O-ND1 3.31Å; F62-K223 PolarHBondContact O-N 2.59Å
63	P	91.7	Very high	87.3	Confident	31 Å²	31	46 Å²	46	20%	0.201	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-60.9	149.1	172.8	25.4	-31.5	0	0	0	110.8	Y58 G65 I66 H222	Y58-P63 HydrophobicContact CE1-CG 4.03Å; P63-G65 PolarHBondContact O-N 2.89Å; P63-I66 HydrophobicContact CG-CB 4.14Å; P63-I66 HydrophobicContact CG-CD1 4.3Å; P63-I66 HydrophobicContact CG-CG1 4.42Å; P63-I66 PolarHBondContact O-N 3.06Å; P63-H222 PolarHBondContact O-ND1 3.38Å; P63-H222 VanDerWaalsContact O-ND1 3.09Å
64	P	84.5	Confident	87.2	Confident	85 Å²	85	42.8 Å²	42.8	55%	0.552	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.1	138.2	170	-24.2	33.8	0	0	0	110.8	I66 D224	P64-I66 VanDerWaalsContact C-N 3.32Å; P64-I66 PolarHBondContact O-N 2.76Å; P64-D224 WeakPolarHBondContact CG-OD2 3.35Å
65	G	84	Confident	86.9	Confident	59 Å²	59	39.4 Å²	39.4	61%	0.608	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	71.4	18.3	178.9	0	0	0	0	0	115.5	P63 Y67	P63-G65 PolarHBondContact O-N 2.89Å; G65-Y67 PolarHBondContact O-N 2.66Å
66	I	87.7	Confident	86.5	Confident	3 Å²	3	38.5 Å²	38.5	2%	0.015	23%	0.231	C	C	.	.			trans	-60	-34.1	174.8	-166.8	171.3	0	0	0	112.4	Y58 F62 P63 P64 G68 S69 I71 I72 Y177	Y58-I66 HydrophobicContact CE2-CD1 4.31Å; F62-I66 HydrophobicContact CB-CD1 4.3Å; F62-I66 HydrophobicContact CB-CG2 3.87Å; F62-I66 HydrophobicContact CD1-CD1 3.42Å; F62-I66 VanDerWaalsContact CD1-CD1 3.42Å; F62-I66 HydrophobicContact CE1-CD1 4.05Å; F62-I66 HydrophobicContact CG-CD1 4.21Å; F62-I66 HydrophobicContact CG-CG2 4.33Å; P63-I66 HydrophobicContact CG-CB 4.14Å; P63-I66 HydrophobicContact CG-CD1 4.3Å; P63-I66 HydrophobicContact CG-CG1 4.42Å; P63-I66 PolarHBondContact O-N 3.06Å; P64-I66 VanDerWaalsContact C-N 3.32Å; P64-I66 PolarHBondContact O-N 2.76Å; I66-G68 PolarHBondContact O-N 2.82Å; I66-S69 WeakPolarHBondContact O-CB 3.34Å; I66-S69 PolarHBondContact O-N 2.61Å; I66-S69 VanDerWaalsContact O-N 3.13Å; I66-S69 PolarHBondContact O-OG 2.79Å; I66-I71 HydrophobicContact CD1-CB 4.33Å; I66-I71 HydrophobicContact CD1-CD1 4.36Å; I66-I71 HydrophobicContact CD1-CG2 3.99Å; I66-I71 HydrophobicContact CG1-CB 4.14Å; I66-I71 HydrophobicContact CG1-CD1 4.43Å; I66-I71 HydrophobicContact CG1-CG2 4.31Å; I66-I72 HydrophobicContact CD1-CD1 3.88Å; I66-I72 HydrophobicContact CD1-CG1 4.19Å; I66-I72 HydrophobicContact CG1-CD1 3.84Å; I66-I72 HydrophobicContact CG1-CG1 3.96Å; I66-I72 HydrophobicContact CG2-CD1 4.05Å; I66-Y177 HydrophobicContact CG2-CD2 3.86Å; I66-Y177 HydrophobicContact CG2-CE2 3.44Å; I66-Y177 VanDerWaalsContact CG2-CE2 3.44Å
67	Y	85.6	Confident	86	Confident	99 Å²	99	37.5 Å²	37.5	39%	0.388	23%	0.227	S	C	.	.	B	Isolated β-bridge	trans	-73	125.1	177.8	-168.5	-97.4	0	0	0	110.2	G65 S69 I72 T74 W103 Y177	G65-Y67 PolarHBondContact O-N 2.66Å; Y67-S69 VanDerWaalsContact C-N 3.32Å; Y67-I72 HydrophobicContact CD2-CG2 3.85Å; Y67-I72 HydrophobicContact CE2-CG2 4.26Å; Y67-T74 HydrophobicContact CD1-CG2 3.97Å; Y67-T74 HydrophobicContact CE1-CG2 3.41Å; Y67-T74 VanDerWaalsContact CE1-CG2 3.41Å; Y67-W103 AromaticContact CE2-CD1 3.84Å; Y67-Y177 HydrophobicContact CD2-CD1 4.34Å; Y67-Y177 AromaticContact CD2-CE1 3.69Å; Y67-Y177 HydrophobicContact CD2-CE1 3.69Å; Y67-Y177 HydrophobicContact CE2-CE1 4.47Å; Y67-Y177 HydrophobicContact CG-CE1 4.35Å
68	G	78.9	Confident	85.4	Confident	46 Å²	46	33.6 Å²	33.6	47%	0.474	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.3	0.9	-170.5	0	0	0	0	0	114.3	I66 I72	I66-G68 PolarHBondContact O-N 2.82Å; G68-I72 WeakPolarHBondContact CA-O 3.4Å; G68-I72 PolarHBondContact N-O 2.88Å
69	S	81.7	Confident	84.7	Confident	35 Å²	35	33.3 Å²	33.3	25%	0.245	21%	0.208	C	C	.	.	S	Bend	trans	-81.1	178.1	172.7	77.2	0	0	0	0	112.1	I66 Y67 I71 I72	I66-S69 WeakPolarHBondContact O-CB 3.34Å; I66-S69 PolarHBondContact O-N 2.61Å; I66-S69 VanDerWaalsContact O-N 3.13Å; I66-S69 PolarHBondContact O-OG 2.79Å; Y67-S69 VanDerWaalsContact C-N 3.32Å; S69-I71 PolarHBondContact O-N 2.86Å; S69-I71 WeakPolarHBondContact OG-CB 3.39Å; S69-I71 PolarHBondContact OG-N 3.46Å; S69-I71 VanDerWaalsContact OG-N 3.08Å; S69-I72 PolarHBondContact N-O 2.78Å; S69-I72 CarbonylContact O-C 3.59Å; S69-I72 VanDerWaalsContact O-C 3.25Å; S69-I72 PolarHBondContact O-N 3.12Å
70	S	75.3	Confident	84.1	Confident	81 Å²	81	32.2 Å²	32.2	57%	0.566	20%	0.202	S	C	*	.	S	Bend	trans	-65.5	-12.6	170.4	58.3	0	0	0	0	113.9	Q170	S70-Q170 PolarHBondContact O-NE2 2.78Å
71	I	82.4	Confident	83.4	Confident	23 Å²	23	33.5 Å²	33.5	12%	0.118	21%	0.205	C	C	.	.	S	Bend	trans	-85.2	-46.1	176.1	-54.4	176.1	0	0	0	110.6	Y58 I66 S69 Q170 L173	Y58-I71 HydrophobicContact CE2-CD1 4.19Å; Y58-I71 WeakPolarHBondContact OH-CD1 3.37Å; I66-I71 HydrophobicContact CD1-CB 4.33Å; I66-I71 HydrophobicContact CD1-CD1 4.36Å; I66-I71 HydrophobicContact CD1-CG2 3.99Å; I66-I71 HydrophobicContact CG1-CB 4.14Å; I66-I71 HydrophobicContact CG1-CD1 4.43Å; I66-I71 HydrophobicContact CG1-CG2 4.31Å; S69-I71 PolarHBondContact O-N 2.86Å; S69-I71 WeakPolarHBondContact OG-CB 3.39Å; S69-I71 PolarHBondContact OG-N 3.46Å; S69-I71 VanDerWaalsContact OG-N 3.08Å; I71-Q170 WeakPolarHBondContact O-CG 2.95Å; I71-Q170 PolarHBondContact O-NE2 3.44Å; I71-L173 HydrophobicContact CG2-CD1 4.05Å
72	I	86.6	Confident	82.7	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	21%	0.21	C	C	.	.	B	Isolated β-bridge	trans	-123.4	85.2	178.4	-53.9	-177.5	0	0	0	107.9	I66 Y67 G68 S69 I174 Y177	I66-I72 HydrophobicContact CD1-CD1 3.88Å; I66-I72 HydrophobicContact CD1-CG1 4.19Å; I66-I72 HydrophobicContact CG1-CD1 3.84Å; I66-I72 HydrophobicContact CG1-CG1 3.96Å; I66-I72 HydrophobicContact CG2-CD1 4.05Å; Y67-I72 HydrophobicContact CD2-CG2 3.85Å; Y67-I72 HydrophobicContact CE2-CG2 4.26Å; G68-I72 WeakPolarHBondContact CA-O 3.4Å; G68-I72 PolarHBondContact N-O 2.88Å; S69-I72 PolarHBondContact N-O 2.78Å; S69-I72 CarbonylContact O-C 3.59Å; S69-I72 VanDerWaalsContact O-C 3.25Å; S69-I72 PolarHBondContact O-N 3.12Å; I72-I174 HydrophobicContact CB-CG1 4.41Å; I72-I174 HydrophobicContact CG1-CG1 4Å; I72-I174 HydrophobicContact CG2-CG1 4.36Å; I72-I174 HydrophobicContact CG2-CG2 4.26Å; I72-Y177 HydrophobicContact CD1-CD1 3.99Å; I72-Y177 HydrophobicContact CD1-CD2 3.74Å; I72-Y177 HydrophobicContact CD1-CE2 4.41Å; I72-Y177 HydrophobicContact CD1-CG 3.5Å
73	P	84.6	Confident	81.5	Confident	6 Å²	6	43.6 Å²	43.6	4%	0.039	25%	0.245	C	C	.	.			trans	-72.3	141.7	-177.9	29.7	-33.4	0	0	0	110.6	I76 W103 I158	P73-I76 HydrophobicContact CG-CG1 4.44Å; P73-W103 HydrophobicContact CG-CZ2 4.2Å; P73-W103 VanDerWaalsContact O-CE2 3.32Å; P73-W103 VanDerWaalsContact O-CZ2 3.31Å; P73-W103 WeakPolarHBondContact O-CZ2 3.5Å; P73-W103 PolarHBondContact O-NE1 3.46Å; P73-I158 HydrophobicContact CB-CG2 3.96Å; P73-I158 HydrophobicContact CG-CD1 4.05Å; P73-I158 HydrophobicContact CG-CG1 4.25Å; P73-I158 HydrophobicContact CG-CG2 4.42Å
74	T	84.6	Confident	80.8	Confident	54 Å²	54	49.5 Å²	49.5	33%	0.331	28%	0.275	S	S	.	.	S	Bend	trans	-87.1	-12.9	170.9	51.6	0	0	0	0	112.8	Y67 V101	Y67-T74 HydrophobicContact CD1-CG2 3.97Å; Y67-T74 HydrophobicContact CE1-CG2 3.41Å; Y67-T74 VanDerWaalsContact CE1-CG2 3.41Å; T74-V101 PolarHBondContact O-N 2.79Å
75	T	83.1	Confident	80.2	Confident	35 Å²	35	48 Å²	48	22%	0.215	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	133.2	-175.3	-51.1	0	0	0	0	109.3	L98 A99 D100	T75-L98 HydrophobicContact CG2-CD1 3.21Å; T75-L98 HydrophobicContact CG2-CD2 4.34Å; T75-L98 HydrophobicContact CG2-CG 3.7Å; T75-A99 WeakPolarHBondContact CA-O 3.26Å; T75-A99 WeakPolarHBondContact CG2-O 3.46Å; T75-D100 WeakPolarHBondContact CG2-OD1 3.21Å; T75-D100 PolarHBondContact OG1-OD1 3.49Å
76	I	81.7	Confident	79.7	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	136.4	176.4	-65.3	175.3	0	0	0	108.2	P73 Y78 A99 V101 W103 P156 L165	P73-I76 HydrophobicContact CG-CG1 4.44Å; I76-Y78 HydrophobicContact CG2-CD2 4.42Å; I76-Y78 HydrophobicContact CG2-CE1 4.5Å; I76-Y78 HydrophobicContact CG2-CE2 4.16Å; I76-A99 PolarHBondContact N-O 3.29Å; I76-A99 PolarHBondContact O-N 2.84Å; I76-V101 HydrophobicContact CB-CG2 3.98Å; I76-V101 HydrophobicContact CD1-CG2 3.6Å; I76-V101 HydrophobicContact CG1-CG2 3.58Å; I76-W103 HydrophobicContact CD1-CH2 4.25Å; I76-P156 HydrophobicContact CG2-CB 3.45Å; I76-P156 VanDerWaalsContact CG2-CB 3.45Å; I76-L165 HydrophobicContact CD1-CD1 4.14Å
77	W	79.5	Confident	78.9	Confident	75 Å²	75	60.1 Å²	60.1	28%	0.284	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	128.8	173.6	-59.2	74.8	0	0	0	108.1	M96 Y97 L98 P156 I157	W77-M96 HydrophobicContact CE3-SD 4.32Å; W77-Y97 CarbonylContact C-O 3.56Å; W77-L98 HydrophobicContact CD2-CD1 3.41Å; W77-L98 VanDerWaalsContact CD2-CD1 3.41Å; W77-L98 HydrophobicContact CE3-CB 4.49Å; W77-L98 HydrophobicContact CE3-CD1 3.68Å; W77-L98 HydrophobicContact CG-CD1 3.98Å; W77-L98 HydrophobicContact CH2-CD1 3.72Å; W77-L98 HydrophobicContact CH2-CD2 4.3Å; W77-L98 HydrophobicContact CZ2-CD1 3.46Å; W77-L98 VanDerWaalsContact CZ2-CD1 3.46Å; W77-L98 HydrophobicContact CZ3-CB 4.42Å; W77-L98 HydrophobicContact CZ3-CD1 3.82Å; W77-P156 CarbonylContact O-C 3.46Å; W77-P156 WeakPolarHBondContact O-CA 3.21Å; W77-I157 HydrophobicContact CB-CB 4.06Å; W77-I157 WeakPolarHBondContact CB-O 3.05Å; W77-I157 PolarHBondContact N-O 3.19Å; W77-I157 PolarHBondContact O-N 3.19Å
78	Y	80.6	Confident	78.2	Confident	2 Å²	2	57.3 Å²	57.3	1%	0.008	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	120.5	172.1	-75.8	-71.7	0	0	0	109.3	I76 M96 Y97 A99 L126 F141 F145 V154 P156	I76-Y78 HydrophobicContact CG2-CD2 4.42Å; I76-Y78 HydrophobicContact CG2-CE1 4.5Å; I76-Y78 HydrophobicContact CG2-CE2 4.16Å; Y78-M96 CarbonylContact O-C 3.47Å; Y78-M96 VanDerWaalsContact O-CA 3.23Å; Y78-M96 WeakPolarHBondContact O-CA 3.24Å; Y78-Y97 HydrophobicContact CD2-CD1 4.06Å; Y78-Y97 PolarHBondContact N-O 2.94Å; Y78-Y97 PolarHBondContact O-N 3.02Å; Y78-A99 HydrophobicContact CD2-CB 3.73Å; Y78-A99 HydrophobicContact CE2-CB 3.68Å; Y78-L126 WeakPolarHBondContact OH-CD2 3.3Å; Y78-F141 HydrophobicContact CE2-CD2 4.4Å; Y78-F141 AromaticContact CE2-CE2 3.78Å; Y78-F141 HydrophobicContact CE2-CE2 3.78Å; Y78-F141 AromaticContact CE2-CZ 3.84Å; Y78-F141 HydrophobicContact CE2-CZ 3.84Å; Y78-F141 AromaticContact CZ-CE2 3.84Å; Y78-F141 WeakPolarHBondContact OH-CE2 3.42Å; Y78-F145 AromaticContact CD1-CE2 3.98Å; Y78-F145 HydrophobicContact CD1-CE2 3.98Å; Y78-F145 HydrophobicContact CD1-CZ 4.03Å; Y78-F145 HydrophobicContact CD2-CD2 4.38Å; Y78-F145 AromaticContact CD2-CE2 3.51Å; Y78-F145 HydrophobicContact CD2-CE2 3.51Å; Y78-F145 HydrophobicContact CD2-CZ 4.29Å; Y78-F145 HydrophobicContact CE1-CE2 4.07Å; Y78-F145 AromaticContact CE1-CZ 3.86Å; Y78-F145 HydrophobicContact CE1-CZ 3.86Å; Y78-F145 HydrophobicContact CE2-CD2 4.5Å; Y78-F145 AromaticContact CE2-CE2 3.64Å; Y78-F145 HydrophobicContact CE2-CE2 3.64Å; Y78-F145 HydrophobicContact CE2-CZ 4.15Å; Y78-F145 AromaticContact CG-CE2 3.62Å; Y78-F145 HydrophobicContact CG-CE2 3.62Å; Y78-F145 HydrophobicContact CG-CZ 4.16Å; Y78-F145 AromaticContact CZ-CE2 3.88Å; Y78-F145 AromaticContact CZ-CZ 3.9Å; Y78-V154 HydrophobicContact CD1-CG1 3.06Å; Y78-V154 HydrophobicContact CE1-CG1 3.74Å; Y78-V154 HydrophobicContact CG-CG1 3.68Å; Y78-P156 HydrophobicContact CD1-CB 4.01Å; Y78-P156 HydrophobicContact CE1-CB 3.76Å; Y78-P156 HydrophobicContact CE1-CG 4.33Å
79	H	77.7	Confident	77.8	Confident	2 Å²	2	57.6 Å²	57.6	1%	0.009	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	130.7	174	176.2	45.6	0	0	0	109.5	W81 D88 F90 N95 V154 T155 I157	H79-W81 AromaticContact CD2-CD1 3.33Å; H79-W81 AromaticContact CD2-NE1 3.08Å; H79-W81 PolarHBondContact CD2-NE1 2.82Å; H79-W81 AromaticContact NE2-CD1 3.22Å; H79-W81 AromaticContact NE2-NE1 3.14Å; H79-W81 PolarHBondContact NE2-NE1 3.38Å; H79-W81 VanDerWaalsContact NE2-NE1 3.14Å; H79-D88 PolarHBondContact CE1-O 2.94Å; H79-F90 PolarHBondContact CE1-O 3.41Å; H79-F90 VanDerWaalsContact CE1-O 3.26Å; H79-N95 CarbonylContact C-O 3.57Å; H79-N95 WeakPolarHBondContact CA-O 3.43Å; H79-N95 VanDerWaalsContact CE1-CG 3.41Å; H79-N95 PolarHBondContact CE1-ND2 2.86Å; H79-N95 PolarHBondContact CE1-OD1 2.97Å; H79-N95 VanDerWaalsContact CE1-OD1 3.31Å; H79-N95 PolarHBondContact ND1-O 3.31Å; H79-N95 PolarHBondContact ND1-OD1 3.33Å; H79-V154 CarbonylContact O-C 3.6Å; H79-V154 WeakPolarHBondContact O-CA 3.47Å; H79-T155 PolarHBondContact N-O 3.46Å; H79-T155 PolarHBondContact O-N 3.48Å; H79-I157 HydrophobicContact CB-CD1 3.61Å; H79-I157 HydrophobicContact CB-CG1 4.4Å
80	Y	79.5	Confident	77.4	Confident	18 Å²	18	60.1 Å²	60.1	7%	0.071	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	109.4	-176.3	-61.1	-63.3	0	0	0	110.3	S82 N95 Y97 S148 H152 V154	Y80-S82 PolarHBondContact O-N 3.32Å; Y80-N95 WeakPolarHBondContact CD2-O 3.33Å; Y80-N95 PolarHBondContact N-O 3.36Å; Y80-Y97 WeakPolarHBondContact OH-CB 3.37Å; Y80-S148 WeakPolarHBondContact OH-CB 3.13Å; Y80-H152 HydrophobicContact CD1-CB 4.08Å; Y80-H152 HydrophobicContact CG-CB 4.28Å; Y80-V154 HydrophobicContact CD1-CB 4.41Å; Y80-V154 HydrophobicContact CD1-CG1 4.47Å; Y80-V154 HydrophobicContact CD1-CG2 3.87Å; Y80-V154 HydrophobicContact CE1-CB 4.44Å; Y80-V154 HydrophobicContact CE1-CG1 4.19Å; Y80-V154 HydrophobicContact CE1-CG2 3.78Å
81	W	75.3	Confident	77.4	Confident	50 Å²	50	58.5 Å²	58.5	19%	0.189	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	112.6	171.1	-69.6	-9.2	0	0	0	110.5	H79 H152 I153 Y163	H79-W81 AromaticContact CD2-CD1 3.33Å; H79-W81 AromaticContact CD2-NE1 3.08Å; H79-W81 PolarHBondContact CD2-NE1 2.82Å; H79-W81 AromaticContact NE2-CD1 3.22Å; H79-W81 AromaticContact NE2-NE1 3.14Å; H79-W81 PolarHBondContact NE2-NE1 3.38Å; H79-W81 VanDerWaalsContact NE2-NE1 3.14Å; W81-H152 CarbonylContact O-C 3.52Å; W81-H152 WeakPolarHBondContact O-CA 3.45Å; W81-I153 HydrophobicContact CB-CB 4.16Å; W81-I153 PolarHBondContact N-O 2.94Å; W81-I153 PolarHBondContact O-N 3.14Å; W81-Y163 WeakPolarHBondContact CH2-OH 3.01Å; W81-Y163 WeakPolarHBondContact CZ2-OH 3.38Å
82	S	77.3	Confident	77.2	Confident	13 Å²	13	60.9 Å²	60.9	9%	0.091	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	141.1	165.6	178.8	0	0	0	0	110	Y80 D84 T85	Y80-S82 PolarHBondContact O-N 3.32Å; S82-D84 PolarHBondContact OG-N 2.86Å; S82-T85 WeakPolarHBondContact CB-OG1 3.49Å; S82-T85 PolarHBondContact OG-N 2.86Å; S82-T85 PolarHBondContact OG-OG1 3.39Å
83	R	69.8	Low	76.7	Confident	198 Å²	198	67.6 Å²	67.6	75%	0.747	32%	0.322	S	S	*	.	S	Bend	trans	-78.4	-14.8	175.2	-58.4	177.5	87.4	169.8	5	111.9	I153	R83-I153 HydrophobicContact CG-CD1 4.45Å
84	D	76.6	Confident	76.5	Confident	155 Å²	155	70.7 Å²	70.7	83%	0.829	36%	0.355	S	S	*	.	S	Bend	trans	-114.2	-23.7	-168.2	-58.5	-35.8	0	0	0	113.9	S82	S82-D84 PolarHBondContact OG-N 2.86Å
85	T	72.4	Confident	76.3	Confident	55 Å²	55	68.4 Å²	68.4	34%	0.337	34%	0.341	S	S	.	.			trans	-122	124.8	-171.1	40.3	0	0	0	0	112	S82 E87 D88	S82-T85 WeakPolarHBondContact CB-OG1 3.49Å; S82-T85 PolarHBondContact OG-N 2.86Å; S82-T85 PolarHBondContact OG-OG1 3.39Å; T85-E87 VanDerWaalsContact C-N 3.32Å; T85-E87 PolarHBondContact O-N 3.26Å; T85-D88 PolarHBondContact OG1-OD2 2.84Å
86	Y	73.2	Confident	76.2	Confident	161 Å²	161	69.1 Å²	69.1	63%	0.631	34%	0.342	S	S	*	.	S	Bend	trans	-68.2	-30.1	179.1	-174.4	-106.1	0	0	0	112.9	D88 M89 F90	Y86-D88 VanDerWaalsContact C-N 3.28Å; Y86-D88 PolarHBondContact O-N 2.67Å; Y86-M89 HydrophobicContact CD2-SD 3.69Å; Y86-M89 HydrophobicContact CE2-SD 4.18Å; Y86-M89 VanDerWaalsContact O-CB 3.28Å; Y86-M89 WeakPolarHBondContact O-CB 3.36Å; Y86-M89 PolarHBondContact O-N 2.95Å; Y86-F90 AromaticContact CD1-CE2 3.89Å; Y86-F90 HydrophobicContact CD1-CE2 3.89Å; Y86-F90 AromaticContact CE1-CE2 3.38Å; Y86-F90 HydrophobicContact CE1-CE2 3.38Å; Y86-F90 AromaticContact CE1-CZ 3.76Å; Y86-F90 HydrophobicContact CE1-CZ 3.76Å; Y86-F90 AromaticContact CZ-CE2 3.77Å; Y86-F90 AromaticContact CZ-CZ 3.78Å
87	E	70.3	Confident	76.1	Confident	155 Å²	155	72.3 Å²	72.3	72%	0.724	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-62	-37	-179.8	-66.4	173	175.6	0	0	111.8	T85 M89 F90	T85-E87 VanDerWaalsContact C-N 3.32Å; T85-E87 PolarHBondContact O-N 3.26Å; E87-M89 PolarHBondContact O-N 2.99Å; E87-F90 PolarHBondContact O-N 2.98Å
88	D	71.8	Confident	76.3	Confident	40 Å²	40	72.7 Å²	72.7	21%	0.214	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-75.2	-4.5	177.1	-66.7	-49.9	0	0	0	113.4	H79 T85 Y86 F90 H92 N95	H79-D88 PolarHBondContact CE1-O 2.94Å; T85-D88 PolarHBondContact OG1-OD2 2.84Å; Y86-D88 VanDerWaalsContact C-N 3.28Å; Y86-D88 PolarHBondContact O-N 2.67Å; D88-F90 PolarHBondContact O-N 2.94Å; D88-H92 IonicContact OD1-CE1 2.85Å; D88-H92 IonicContact OD1-NE2 3.91Å; D88-N95 PolarHBondContact O-ND2 3.3Å
89	M	69.6	Low	76.4	Confident	52 Å²	52	72.7 Å²	72.7	26%	0.256	36%	0.363	S	S	.	.	G	3₁₀ helix	trans	-79.3	-4.9	172.4	-59.1	-174.7	176.9	0	0	112.8	Y86 E87	Y86-M89 HydrophobicContact CD2-SD 3.69Å; Y86-M89 HydrophobicContact CE2-SD 4.18Å; Y86-M89 VanDerWaalsContact O-CB 3.28Å; Y86-M89 WeakPolarHBondContact O-CB 3.36Å; Y86-M89 PolarHBondContact O-N 2.95Å; E87-M89 PolarHBondContact O-N 2.99Å
90	F	73.7	Confident	76.8	Confident	87 Å²	87	78.3 Å²	78.3	38%	0.382	39%	0.393	S	S	.	.	S	Bend	trans	-108.5	136.8	175.6	-63.3	-81.2	0	0	0	111.9	H79 Y86 E87 D88 H92 N95	H79-F90 PolarHBondContact CE1-O 3.41Å; H79-F90 VanDerWaalsContact CE1-O 3.26Å; Y86-F90 AromaticContact CD1-CE2 3.89Å; Y86-F90 HydrophobicContact CD1-CE2 3.89Å; Y86-F90 AromaticContact CE1-CE2 3.38Å; Y86-F90 HydrophobicContact CE1-CE2 3.38Å; Y86-F90 AromaticContact CE1-CZ 3.76Å; Y86-F90 HydrophobicContact CE1-CZ 3.76Å; Y86-F90 AromaticContact CZ-CE2 3.77Å; Y86-F90 AromaticContact CZ-CZ 3.78Å; E87-F90 PolarHBondContact O-N 2.98Å; D88-F90 PolarHBondContact O-N 2.94Å; F90-H92 PolarHBondContact O-CD2 3.47Å; F90-H92 PolarHBondContact O-N 3.48Å; F90-N95 PolarHBondContact O-ND2 2.84Å; F90-N95 PolarHBondContact O-OD1 2.88Å
91	P	74.3	Confident	77.1	Confident	48 Å²	48	77.8 Å²	77.8	31%	0.312	39%	0.391	S	S	.	.			trans	-63.2	119	178.2	-19.9	30.9	0	0	0	112	M96 I157	P91-M96 HydrophobicContact CB-CG 4.31Å; P91-M96 HydrophobicContact CB-SD 3.72Å; P91-I157 HydrophobicContact CG-CD1 4.48Å
92	H	78.7	Confident	77.9	Confident	73 Å²	73	79.8 Å²	79.8	34%	0.338	41%	0.405	S	S	.	.			trans	-146.1	162	172.8	63.8	59.6	0	0	0	111.4	D88 F90 G94 N95 M96	D88-H92 IonicContact OD1-CE1 2.85Å; D88-H92 IonicContact OD1-NE2 3.91Å; F90-H92 PolarHBondContact O-CD2 3.47Å; F90-H92 PolarHBondContact O-N 3.48Å; H92-G94 WeakPolarHBondContact ND1-CA 3.48Å; H92-G94 PolarHBondContact ND1-N 3.37Å; H92-G94 VanDerWaalsContact ND1-N 3.11Å; H92-G94 PolarHBondContact O-N 3.16Å; H92-N95 PolarHBondContact CD2-ND2 2.96Å; H92-N95 VanDerWaalsContact CD2-ND2 3.28Å; H92-N95 PolarHBondContact CE1-N 3.49Å; H92-N95 PolarHBondContact CE1-ND2 3.29Å; H92-N95 VanDerWaalsContact CE1-ND2 3.3Å; H92-N95 PolarHBondContact N-OD1 3.43Å; H92-N95 PolarHBondContact ND1-N 2.85Å; H92-N95 PolarHBondContact NE2-ND2 2.86Å; H92-N95 PolarHBondContact O-N 3Å; H92-N95 PolarHBondContact O-OD1 3.31Å; H92-M96 VanDerWaalsContact C-CE 3.5Å; H92-M96 WeakPolarHBondContact O-CG 3.42Å; H92-M96 PolarHBondContact O-N 3.38Å; H92-M96 VanDerWaalsContact O-N 3.14Å
93	N	76.8	Confident	78.6	Confident	140 Å²	140	79.1 Å²	79.1	75%	0.749	40%	0.401	S	S	*	.	G	3₁₀ helix	trans	-54	-32.5	-174.5	-69.4	-0.2	0	0	0	114	N95	N93-N95 VanDerWaalsContact C-N 3.34Å; N93-N95 PolarHBondContact O-N 3.14Å
94	G	79.2	Confident	79.7	Confident	72 Å²	72	72 Å²	72	74%	0.742	38%	0.381	S	S	*	.	G	3₁₀ helix	trans	-73.3	-14.7	178.4	0	0	0	0	0	116.4	H92	H92-G94 WeakPolarHBondContact ND1-CA 3.48Å; H92-G94 PolarHBondContact ND1-N 3.37Å; H92-G94 VanDerWaalsContact ND1-N 3.11Å; H92-G94 PolarHBondContact O-N 3.16Å
95	N	80.8	Confident	80.5	Confident	5 Å²	5	68.2 Å²	68.2	3%	0.027	36%	0.358	C	S	.	.	G	3₁₀ helix	trans	-128.7	14.5	-178.4	69.6	15.6	0	0	0	112.1	H79 Y80 D88 F90 H92 N93	H79-N95 CarbonylContact C-O 3.57Å; H79-N95 WeakPolarHBondContact CA-O 3.43Å; H79-N95 VanDerWaalsContact CE1-CG 3.41Å; H79-N95 PolarHBondContact CE1-ND2 2.86Å; H79-N95 PolarHBondContact CE1-OD1 2.97Å; H79-N95 VanDerWaalsContact CE1-OD1 3.31Å; H79-N95 PolarHBondContact ND1-O 3.31Å; H79-N95 PolarHBondContact ND1-OD1 3.33Å; Y80-N95 WeakPolarHBondContact CD2-O 3.33Å; Y80-N95 PolarHBondContact N-O 3.36Å; D88-N95 PolarHBondContact O-ND2 3.3Å; F90-N95 PolarHBondContact O-ND2 2.84Å; F90-N95 PolarHBondContact O-OD1 2.88Å; H92-N95 PolarHBondContact CD2-ND2 2.96Å; H92-N95 VanDerWaalsContact CD2-ND2 3.28Å; H92-N95 PolarHBondContact CE1-N 3.49Å; H92-N95 PolarHBondContact CE1-ND2 3.29Å; H92-N95 VanDerWaalsContact CE1-ND2 3.3Å; H92-N95 PolarHBondContact N-OD1 3.43Å; H92-N95 PolarHBondContact ND1-N 2.85Å; H92-N95 PolarHBondContact NE2-ND2 2.86Å; H92-N95 PolarHBondContact O-N 3Å; H92-N95 PolarHBondContact O-OD1 3.31Å; N93-N95 VanDerWaalsContact C-N 3.34Å; N93-N95 PolarHBondContact O-N 3.14Å
96	M	81.3	Confident	81.4	Confident	51 Å²	51	65.6 Å²	65.6	25%	0.251	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	130.6	175.2	-71.2	-167.8	-67.1	0	0	109.6	W77 Y78 P91 H92	W77-M96 HydrophobicContact CE3-SD 4.32Å; Y78-M96 CarbonylContact O-C 3.47Å; Y78-M96 VanDerWaalsContact O-CA 3.23Å; Y78-M96 WeakPolarHBondContact O-CA 3.24Å; P91-M96 HydrophobicContact CB-CG 4.31Å; P91-M96 HydrophobicContact CB-SD 3.72Å; H92-M96 VanDerWaalsContact C-CE 3.5Å; H92-M96 WeakPolarHBondContact O-CG 3.42Å; H92-M96 PolarHBondContact O-N 3.38Å; H92-M96 VanDerWaalsContact O-N 3.14Å
97	Y	80.1	Confident	82.2	Confident	67 Å²	67	58 Å²	58	26%	0.263	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	126.2	170.7	175.1	-102.8	0	0	0	109.2	W77 Y78 Y80 A99 F145	W77-Y97 CarbonylContact C-O 3.56Å; Y78-Y97 HydrophobicContact CD2-CD1 4.06Å; Y78-Y97 PolarHBondContact N-O 2.94Å; Y78-Y97 PolarHBondContact O-N 3.02Å; Y80-Y97 WeakPolarHBondContact OH-CB 3.37Å; Y97-A99 HydrophobicContact CD1-CB 4.06Å; Y97-A99 HydrophobicContact CE1-CB 3.7Å; Y97-F145 HydrophobicContact CD1-CD2 4.02Å; Y97-F145 HydrophobicContact CD1-CE2 4.37Å; Y97-F145 AromaticContact CE1-CD2 3.98Å; Y97-F145 HydrophobicContact CE1-CD2 3.98Å
98	L	83.5	Confident	83.2	Confident	83 Å²	83	54.1 Å²	54.1	44%	0.435	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	119.8	176.2	-172.6	66.2	0	0	0	108.8	T75 W77	T75-L98 HydrophobicContact CG2-CD1 3.21Å; T75-L98 HydrophobicContact CG2-CD2 4.34Å; T75-L98 HydrophobicContact CG2-CG 3.7Å; W77-L98 HydrophobicContact CD2-CD1 3.41Å; W77-L98 VanDerWaalsContact CD2-CD1 3.41Å; W77-L98 HydrophobicContact CE3-CB 4.49Å; W77-L98 HydrophobicContact CE3-CD1 3.68Å; W77-L98 HydrophobicContact CG-CD1 3.98Å; W77-L98 HydrophobicContact CH2-CD1 3.72Å; W77-L98 HydrophobicContact CH2-CD2 4.3Å; W77-L98 HydrophobicContact CZ2-CD1 3.46Å; W77-L98 VanDerWaalsContact CZ2-CD1 3.46Å; W77-L98 HydrophobicContact CZ3-CB 4.42Å; W77-L98 HydrophobicContact CZ3-CD1 3.82Å
99	A	83	Confident	84	Confident	2 Å²	2	54.6 Å²	54.6	2%	0.017	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	118.6	178.5	0	0	0	0	0	110.4	T75 I76 Y78 Y97 F141	T75-A99 WeakPolarHBondContact CA-O 3.26Å; T75-A99 WeakPolarHBondContact CG2-O 3.46Å; I76-A99 PolarHBondContact N-O 3.29Å; I76-A99 PolarHBondContact O-N 2.84Å; Y78-A99 HydrophobicContact CD2-CB 3.73Å; Y78-A99 HydrophobicContact CE2-CB 3.68Å; Y97-A99 HydrophobicContact CD1-CB 4.06Å; Y97-A99 HydrophobicContact CE1-CB 3.7Å; A99-F141 HydrophobicContact CB-CD1 3.98Å; A99-F141 HydrophobicContact CB-CE1 3.63Å; A99-F141 HydrophobicContact CB-CZ 4.17Å
100	D	86.2	Confident	84.7	Confident	120 Å²	120	53.4 Å²	53.4	64%	0.642	30%	0.298	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.8	130.7	166.8	-72.2	-33.4	0	0	0	109.4	T75	T75-D100 WeakPolarHBondContact CG2-OD1 3.21Å; T75-D100 PolarHBondContact OG1-OD1 3.49Å
101	V	86.3	Confident	85.2	Confident	7 Å²	7	51.7 Å²	51.7	4%	0.042	29%	0.292	C	S	.	.			trans	-102	110	-174.6	-169.1	0	0	0	0	109.5	T74 I76 W103 I106	T74-V101 PolarHBondContact O-N 2.79Å; I76-V101 HydrophobicContact CB-CG2 3.98Å; I76-V101 HydrophobicContact CD1-CG2 3.6Å; I76-V101 HydrophobicContact CG1-CG2 3.58Å; V101-W103 HydrophobicContact CB-CD2 4.45Å; V101-W103 HydrophobicContact CB-CZ2 4Å; V101-W103 HydrophobicContact CG1-CD2 3.53Å; V101-W103 VanDerWaalsContact CG1-CE2 3.45Å; V101-W103 HydrophobicContact CG1-CE3 3.63Å; V101-W103 HydrophobicContact CG1-CG 4.24Å; V101-W103 HydrophobicContact CG1-CH2 3.65Å; V101-W103 HydrophobicContact CG1-CZ2 3.53Å; V101-W103 HydrophobicContact CG1-CZ3 3.7Å; V101-W103 HydrophobicContact CG2-CZ2 4.43Å; V101-W103 PolarHBondContact O-N 3.04Å; V101-I106 HydrophobicContact CG1-CD1 3.83Å
102	N	91.3	Very high	85.5	Confident	91 Å²	91	49.4 Å²	49.4	49%	0.487	28%	0.278	S	S	.	.			trans	-90.8	85.3	171.9	-171.9	-20.4	0	0	0	109.3	P104 H105 I106	N102-P104 VanDerWaalsContact C-N 3.35Å; N102-P104 VanDerWaalsContact OD1-CD 3.23Å; N102-P104 WeakPolarHBondContact OD1-CD 3.35Å; N102-H105 HydrophobicContact CB-CB 3.79Å; N102-H105 WeakPolarHBondContact O-CB 3.27Å; N102-H105 PolarHBondContact O-N 2.9Å; N102-H105 VanDerWaalsContact O-N 3.1Å; N102-H105 PolarHBondContact OD1-N 3.14Å; N102-I106 WeakPolarHBondContact O-CG1 3.24Å; N102-I106 PolarHBondContact O-N 3.26Å; N102-I106 VanDerWaalsContact O-N 3.13Å
103	W	91.9	Very high	85.5	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-55.5	-43.9	178.3	-52	104.7	0	0	0	113.1	Y67 P73 I76 V101 H105 I106 V107 F123 L126 I174 T178	Y67-W103 AromaticContact CE2-CD1 3.84Å; P73-W103 HydrophobicContact CG-CZ2 4.2Å; P73-W103 VanDerWaalsContact O-CE2 3.32Å; P73-W103 VanDerWaalsContact O-CZ2 3.31Å; P73-W103 WeakPolarHBondContact O-CZ2 3.5Å; P73-W103 PolarHBondContact O-NE1 3.46Å; I76-W103 HydrophobicContact CD1-CH2 4.25Å; V101-W103 HydrophobicContact CB-CD2 4.45Å; V101-W103 HydrophobicContact CB-CZ2 4Å; V101-W103 HydrophobicContact CG1-CD2 3.53Å; V101-W103 VanDerWaalsContact CG1-CE2 3.45Å; V101-W103 HydrophobicContact CG1-CE3 3.63Å; V101-W103 HydrophobicContact CG1-CG 4.24Å; V101-W103 HydrophobicContact CG1-CH2 3.65Å; V101-W103 HydrophobicContact CG1-CZ2 3.53Å; V101-W103 HydrophobicContact CG1-CZ3 3.7Å; V101-W103 HydrophobicContact CG2-CZ2 4.43Å; V101-W103 PolarHBondContact O-N 3.04Å; W103-H105 VanDerWaalsContact C-N 3.3Å; W103-H105 PolarHBondContact O-N 3.38Å; W103-I106 HydrophobicContact CE3-CD1 3.89Å; W103-I106 HydrophobicContact CZ3-CD1 4.2Å; W103-I106 WeakPolarHBondContact O-CB 3.49Å; W103-I106 PolarHBondContact O-N 2.94Å; W103-V107 PolarHBondContact O-N 2.78Å; W103-V107 VanDerWaalsContact O-N 3.1Å; W103-F123 HydrophobicContact CE3-CD1 4.2Å; W103-F123 AromaticContact CE3-CE1 3.64Å; W103-F123 HydrophobicContact CE3-CE1 3.64Å; W103-F123 HydrophobicContact CE3-CZ 4.27Å; W103-F123 HydrophobicContact CZ3-CD1 4.1Å; W103-F123 HydrophobicContact CZ3-CE1 4.01Å; W103-L126 HydrophobicContact CE3-CD1 4.5Å; W103-L126 HydrophobicContact CH2-CD1 3.91Å; W103-L126 HydrophobicContact CZ3-CD1 3.49Å; W103-L126 VanDerWaalsContact CZ3-CD1 3.49Å; W103-I174 HydrophobicContact CD2-CG2 3.47Å; W103-I174 VanDerWaalsContact CD2-CG2 3.47Å; W103-I174 HydrophobicContact CE3-CG2 3.48Å; W103-I174 VanDerWaalsContact CE3-CG2 3.48Å; W103-I174 HydrophobicContact CG-CG2 4.07Å; W103-I174 HydrophobicContact CH2-CD1 4.01Å; W103-I174 HydrophobicContact CH2-CG2 3.97Å; W103-I174 HydrophobicContact CZ2-CD1 4.17Å; W103-I174 HydrophobicContact CZ2-CG2 3.97Å; W103-I174 HydrophobicContact CZ3-CG2 3.73Å; W103-T178 VanDerWaalsContact C-CG2 3.5Å; W103-T178 HydrophobicContact CB-CG2 3.86Å; W103-T178 WeakPolarHBondContact CB-OG1 3.36Å; W103-T178 WeakPolarHBondContact O-CG2 3.48Å
104	P	93	Very high	85.6	Confident	49 Å²	49	48.9 Å²	48.9	32%	0.318	27%	0.272	S	S	.	.	H	α-helix	trans	-54.2	-45	173.3	-29	35.8	0	0	0	113.4	N102 I106 V107 T108 T178 L182	N102-P104 VanDerWaalsContact C-N 3.35Å; N102-P104 VanDerWaalsContact OD1-CD 3.23Å; N102-P104 WeakPolarHBondContact OD1-CD 3.35Å; P104-I106 VanDerWaalsContact C-N 3.34Å; P104-I106 PolarHBondContact O-N 3.44Å; P104-V107 PolarHBondContact O-N 2.82Å; P104-T108 WeakPolarHBondContact O-CG2 3.18Å; P104-T108 PolarHBondContact O-N 3.38Å; P104-T108 PolarHBondContact O-OG1 3.36Å; P104-T178 HydrophobicContact CG-CG2 4.43Å; P104-L182 HydrophobicContact CB-CD1 4.18Å; P104-L182 HydrophobicContact CB-CD2 4.33Å
105	H	93.6	Very high	85.6	Confident	75 Å²	75	49.3 Å²	49.3	35%	0.347	26%	0.255	S	S	.	.	H	α-helix	trans	-58.2	-47.1	177.5	175.3	50.1	0	0	0	111.7	N102 W103 V107 T108 L109	N102-H105 HydrophobicContact CB-CB 3.79Å; N102-H105 WeakPolarHBondContact O-CB 3.27Å; N102-H105 PolarHBondContact O-N 2.9Å; N102-H105 VanDerWaalsContact O-N 3.1Å; N102-H105 PolarHBondContact OD1-N 3.14Å; W103-H105 VanDerWaalsContact C-N 3.3Å; W103-H105 PolarHBondContact O-N 3.38Å; H105-V107 VanDerWaalsContact C-N 3.3Å; H105-V107 PolarHBondContact O-N 3.43Å; H105-T108 WeakPolarHBondContact CA-OG1 3Å; H105-T108 CarbonylContact O-C 3.53Å; H105-T108 PolarHBondContact O-N 3.25Å; H105-T108 PolarHBondContact O-OG1 2.9Å; H105-L109 PolarHBondContact O-N 2.91Å; H105-L109 VanDerWaalsContact O-N 3.1Å
106	I	91.9	Very high	85.5	Confident	0 Å²	0	52 Å²	52	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-56.6	-45.8	179	-64.5	172.5	0	0	0	111.2	V101 N102 W103 P104 T108 L109 Y122 F123 L126 I140	V101-I106 HydrophobicContact CG1-CD1 3.83Å; N102-I106 WeakPolarHBondContact O-CG1 3.24Å; N102-I106 PolarHBondContact O-N 3.26Å; N102-I106 VanDerWaalsContact O-N 3.13Å; W103-I106 HydrophobicContact CE3-CD1 3.89Å; W103-I106 HydrophobicContact CZ3-CD1 4.2Å; W103-I106 WeakPolarHBondContact O-CB 3.49Å; W103-I106 PolarHBondContact O-N 2.94Å; P104-I106 VanDerWaalsContact C-N 3.34Å; P104-I106 PolarHBondContact O-N 3.44Å; I106-T108 VanDerWaalsContact C-N 3.3Å; I106-T108 PolarHBondContact O-N 3.03Å; I106-L109 WeakPolarHBondContact O-CB 3.29Å; I106-L109 PolarHBondContact O-N 2.85Å; I106-Y122 VanDerWaalsContact CG2-CB 3.46Å; I106-Y122 HydrophobicContact CG2-CG 4.29Å; I106-F123 HydrophobicContact CB-CE2 4.37Å; I106-F123 HydrophobicContact CG2-CD2 3.85Å; I106-F123 HydrophobicContact CG2-CE2 3.58Å; I106-F123 HydrophobicContact CG2-CZ 4.22Å; I106-L126 HydrophobicContact CD1-CD1 3.93Å; I106-I140 HydrophobicContact CD1-CG2 3.84Å; I106-I140 HydrophobicContact CG1-CG1 4.24Å; I106-I140 HydrophobicContact CG1-CG2 3.85Å
107	V	89.8	Confident	85.4	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-63.2	-39.1	177.9	168.7	0	0	0	0	111.4	W103 P104 H105 L109 C110 E112 F123 T178 I179 L182 Y183	W103-V107 PolarHBondContact O-N 2.78Å; W103-V107 VanDerWaalsContact O-N 3.1Å; P104-V107 PolarHBondContact O-N 2.82Å; H105-V107 VanDerWaalsContact C-N 3.3Å; H105-V107 PolarHBondContact O-N 3.43Å; V107-L109 VanDerWaalsContact C-N 3.27Å; V107-L109 PolarHBondContact O-N 2.02Å; V107-C110 VanDerWaalsContact O-O 3.12Å; V107-E112 HydrophobicContact CG1-CG 4.02Å; V107-F123 HydrophobicContact CG2-CE2 3.66Å; V107-F123 HydrophobicContact CG2-CZ 3.62Å; V107-T178 HydrophobicContact CB-CG2 4.12Å; V107-T178 HydrophobicContact CG2-CG2 3.46Å; V107-T178 VanDerWaalsContact CG2-CG2 3.46Å; V107-I179 HydrophobicContact CG1-CD1 3.45Å; V107-I179 VanDerWaalsContact CG1-CD1 3.45Å; V107-I179 HydrophobicContact CG1-CG1 4.25Å; V107-I179 HydrophobicContact CG2-CD1 4.26Å; V107-I179 HydrophobicContact CG2-CG1 4.28Å; V107-L182 HydrophobicContact CB-CD1 3.85Å; V107-L182 HydrophobicContact CG1-CD1 3.67Å; V107-Y183 HydrophobicContact CG1-CD2 4.39Å; V107-Y183 HydrophobicContact CG1-CE2 3.65Å
108	T	90.1	Very high	85.6	Confident	75 Å²	75	49.2 Å²	49.2	46%	0.46	26%	0.262	S	S	.	.	H	α-helix	trans	-77.3	-4.1	179.8	60.6	0	0	0	0	114.9	P104 H105 I106 C110 L182	P104-T108 WeakPolarHBondContact O-CG2 3.18Å; P104-T108 PolarHBondContact O-N 3.38Å; P104-T108 PolarHBondContact O-OG1 3.36Å; H105-T108 WeakPolarHBondContact CA-OG1 3Å; H105-T108 CarbonylContact O-C 3.53Å; H105-T108 PolarHBondContact O-N 3.25Å; H105-T108 PolarHBondContact O-OG1 2.9Å; I106-T108 VanDerWaalsContact C-N 3.3Å; I106-T108 PolarHBondContact O-N 3.03Å; T108-C110 PolarHBondContact O-N 3.2Å; T108-C110 VanDerWaalsContact O-N 3.14Å; T108-L182 HydrophobicContact CG2-CD1 4.22Å
109	L	90.3	Very high	85.8	Confident	49 Å²	49	45.3 Å²	45.3	26%	0.257	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-14.8	172.2	-71.4	174.1	0	0	0	112.1	H105 I106 V107 Y122 Q139 I140	H105-L109 PolarHBondContact O-N 2.91Å; H105-L109 VanDerWaalsContact O-N 3.1Å; I106-L109 WeakPolarHBondContact O-CB 3.29Å; I106-L109 PolarHBondContact O-N 2.85Å; V107-L109 VanDerWaalsContact C-N 3.27Å; V107-L109 PolarHBondContact O-N 2.02Å; L109-Y122 HydrophobicContact CB-CD2 4.18Å; L109-Y122 HydrophobicContact CB-CE2 3.73Å; L109-Y122 HydrophobicContact CD1-CD1 3.82Å; L109-Y122 HydrophobicContact CD1-CD2 4.16Å; L109-Y122 HydrophobicContact CD1-CE1 3.88Å; L109-Y122 HydrophobicContact CD1-CE2 4.24Å; L109-Y122 HydrophobicContact CD1-CG 3.99Å; L109-Q139 HydrophobicContact CD1-CB 4.24Å; L109-I140 HydrophobicContact CD1-CG1 4.2Å
110	C	84.2	Confident	86	Confident	27 Å²	27	45.2 Å²	45.2	18%	0.182	24%	0.241	C	C	.	.	S	Bend	trans	-141.4	163.2	170.1	71.3	0	0	0	0	111.5	V107 T108 E112 C118 S119	V107-C110 VanDerWaalsContact O-O 3.12Å; T108-C110 PolarHBondContact O-N 3.2Å; T108-C110 VanDerWaalsContact O-N 3.14Å; C110-E112 PolarHBondContact O-N 3.1Å; C110-C118 HydrophobicContact CB-CB 3.76Å; C110-C118 WeakPolarHBondContact CB-SG 3.32Å; C110-C118 WeakPolarHBondContact SG-CB 3.42Å; C110-C118 CovalentContact SG-SG 2.02Å; C110-C118 PolarHBondContact SG-SG 3.03Å; C110-S119 VanDerWaalsContact SG-CA 3.51Å; C110-S119 VanDerWaalsContact SG-CB 3.56Å; C110-S119 PolarHBondContact SG-N 2.78Å
111	D	82.3	Confident	85.8	Confident	51 Å²	51	40.3 Å²	40.3	27%	0.273	22%	0.217	S	C	.	.			trans	-87.7	89.2	-179.5	-171	-14	0	0	0	110.5	T113 K114 H115	D111-T113 PolarHBondContact O-N 2.93Å; D111-T113 VanDerWaalsContact O-N 3.14Å; D111-T113 PolarHBondContact OD1-N 3.37Å; D111-T113 PolarHBondContact OD1-OG1 3.36Å; D111-K114 HydrophobicContact CB-CB 4.32Å; D111-K114 HydrophobicContact CB-CD 4.45Å; D111-K114 PolarHBondContact O-N 3.36Å; D111-K114 VanDerWaalsContact O-N 3.07Å; D111-K114 PolarHBondContact OD1-N 3.38Å; D111-K114 WeakPolarHBondContact OD2-CD 3.48Å; D111-K114 WeakPolarHBondContact OD2-CE 3.35Å; D111-K114 WeakPolarHBondContact OD2-CG 3.49Å; D111-K114 IonicContact OD2-NZ 2.76Å; D111-K114 PolarHBondContact OD2-NZ 3.19Å; D111-H115 PolarHBondContact O-N 3.23Å
112	E	81.8	Confident	85.9	Confident	1 Å²	1	41.3 Å²	41.3	1%	0.005	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-22.8	179.7	-74.4	-79.8	171.9	0	0	113.7	V107 C110 P116 R117 S119 Y175 I179 Y183 I190	V107-E112 HydrophobicContact CG1-CG 4.02Å; C110-E112 PolarHBondContact O-N 3.1Å; E112-P116 WeakPolarHBondContact O-CA 3.3Å; E112-R117 VanDerWaalsContact OE2-CA 3.31Å; E112-R117 WeakPolarHBondContact OE2-CA 3.4Å; E112-R117 PolarHBondContact OE2-N 3.45Å; E112-S119 VanDerWaalsContact OE1-CB 3.23Å; E112-S119 WeakPolarHBondContact OE1-CB 3.27Å; E112-S119 PolarHBondContact OE1-N 3.14Å; E112-S119 PolarHBondContact OE1-OG 3.27Å; E112-Y175 PolarHBondContact OE1-OH 2.82Å; E112-Y175 PolarHBondContact OE2-OH 3.32Å; E112-I179 HydrophobicContact CB-CD1 4.15Å; E112-I179 VanDerWaalsContact CD-CD1 3.44Å; E112-I179 HydrophobicContact CG-CD1 3.49Å; E112-I179 VanDerWaalsContact CG-CD1 3.49Å; E112-Y183 HydrophobicContact CB-CD2 4.25Å; E112-Y183 HydrophobicContact CB-CE2 3.84Å; E112-Y183 HydrophobicContact CG-CE2 4.13Å; E112-I190 HydrophobicContact CB-CD1 4.33Å; E112-I190 WeakPolarHBondContact O-CD1 3.18Å
113	T	78.4	Confident	85.6	Confident	55 Å²	55	37 Å²	37	34%	0.337	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-33.2	177	70.5	0	0	0	0	112.2	D111 Y183 A189	D111-T113 PolarHBondContact O-N 2.93Å; D111-T113 VanDerWaalsContact O-N 3.14Å; D111-T113 PolarHBondContact OD1-N 3.37Å; D111-T113 PolarHBondContact OD1-OG1 3.36Å; T113-Y183 HydrophobicContact CG2-CD1 3.73Å; T113-Y183 HydrophobicContact CG2-CE1 3.75Å; T113-A189 HydrophobicContact CG2-CB 3.92Å
114	K	78.4	Confident	85.1	Confident	146 Å²	146	37.3 Å²	37.3	64%	0.635	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.5	-35.4	176.1	-68.6	-179	-168.4	140.4	0	112.4	D111	D111-K114 HydrophobicContact CB-CB 4.32Å; D111-K114 HydrophobicContact CB-CD 4.45Å; D111-K114 PolarHBondContact O-N 3.36Å; D111-K114 VanDerWaalsContact O-N 3.07Å; D111-K114 PolarHBondContact OD1-N 3.38Å; D111-K114 WeakPolarHBondContact OD2-CD 3.48Å; D111-K114 WeakPolarHBondContact OD2-CE 3.35Å; D111-K114 WeakPolarHBondContact OD2-CG 3.49Å; D111-K114 IonicContact OD2-NZ 2.76Å; D111-K114 PolarHBondContact OD2-NZ 3.19Å
115	H	80.3	Confident	84.5	Confident	81 Å²	81	35 Å²	35	38%	0.375	18%	0.184	S	C	.	.	S	Bend	trans	-130.1	82.5	-174.8	-57.6	-58.2	0	0	0	109.6	F27 D111 R117 C118	F27-H115 AromaticContact CE1-ND1 3.98Å; F27-H115 AromaticContact CZ-ND1 3.69Å; D111-H115 PolarHBondContact O-N 3.23Å; H115-R117 PolarHBondContact O-N 2.8Å; H115-C118 HydrophobicContact CB-CB 3.86Å; H115-C118 VanDerWaalsContact O-CB 3.25Å; H115-C118 WeakPolarHBondContact O-CB 3.34Å; H115-C118 PolarHBondContact O-N 3.17Å; H115-C118 VanDerWaalsContact O-N 3.11Å; H115-C118 PolarHBondContact O-SG 3.04Å
116	P	77.5	Confident	83.8	Confident	62 Å²	62	31.5 Å²	31.5	40%	0.403	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.3	131.8	-179.6	-27.4	35.4	0	0	0	112.1	E112 C118 I190	E112-P116 WeakPolarHBondContact O-CA 3.3Å; P116-C118 PolarHBondContact O-N 3.34Å; P116-I190 HydrophobicContact CB-CG2 4.03Å; P116-I190 HydrophobicContact CG-CG2 4.14Å
117	R	79.1	Confident	83	Confident	38 Å²	38	32.5 Å²	32.5	14%	0.143	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.6	15.3	179.7	-44.7	178.8	-167.8	175.4	2.5	115.8	E22 E112 H115 S119 W120 Y175	E22-R117 IonicContact OE2-CZ 3.61Å; E22-R117 VanDerWaalsContact OE2-CZ 3.3Å; E22-R117 IonicContact OE2-NH1 3.96Å; E22-R117 PolarHBondContact OE2-NH1 2.74Å; E22-R117 IonicContact OE2-NH2 3.91Å; E22-R117 PolarHBondContact OE2-NH2 3.48Å; E112-R117 VanDerWaalsContact OE2-CA 3.31Å; E112-R117 WeakPolarHBondContact OE2-CA 3.4Å; E112-R117 PolarHBondContact OE2-N 3.45Å; H115-R117 PolarHBondContact O-N 2.8Å; R117-S119 PolarHBondContact O-N 2.91Å; R117-W120 WeakPolarHBondContact O-CB 3.41Å; R117-W120 PolarHBondContact O-N 2.96Å; R117-W120 VanDerWaalsContact O-N 3.14Å; R117-Y175 VanDerWaalsContact CA-OH 3.25Å; R117-Y175 WeakPolarHBondContact CA-OH 3.27Å; R117-Y175 HydrophobicContact CG-CE1 4.5Å
118	C	84	Confident	81.8	Confident	22 Å²	22	33.2 Å²	33.2	15%	0.149	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-32.1	175.5	57.7	0	0	0	0	112.7	C110 H115 P116 W120	C110-C118 HydrophobicContact CB-CB 3.76Å; C110-C118 WeakPolarHBondContact CB-SG 3.32Å; C110-C118 WeakPolarHBondContact SG-CB 3.42Å; C110-C118 CovalentContact SG-SG 2.02Å; C110-C118 PolarHBondContact SG-SG 3.03Å; H115-C118 HydrophobicContact CB-CB 3.86Å; H115-C118 VanDerWaalsContact O-CB 3.25Å; H115-C118 WeakPolarHBondContact O-CB 3.34Å; H115-C118 PolarHBondContact O-N 3.17Å; H115-C118 VanDerWaalsContact O-N 3.11Å; H115-C118 PolarHBondContact O-SG 3.04Å; P116-C118 PolarHBondContact O-N 3.34Å; C118-W120 PolarHBondContact O-N 3.32Å
119	S	87.9	Confident	80.1	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-11.4	-175.5	67.9	0	0	0	0	112.4	C110 E112 R117 A121 Y122 F123 Y175	C110-S119 VanDerWaalsContact SG-CA 3.51Å; C110-S119 VanDerWaalsContact SG-CB 3.56Å; C110-S119 PolarHBondContact SG-N 2.78Å; E112-S119 VanDerWaalsContact OE1-CB 3.23Å; E112-S119 WeakPolarHBondContact OE1-CB 3.27Å; E112-S119 PolarHBondContact OE1-N 3.14Å; E112-S119 PolarHBondContact OE1-OG 3.27Å; R117-S119 PolarHBondContact O-N 2.91Å; S119-A121 PolarHBondContact O-N 2.03Å; S119-A121 VanDerWaalsContact O-N 3.13Å; S119-Y122 WeakPolarHBondContact O-CB 3.44Å; S119-Y122 WeakPolarHBondContact O-CD2 3.33Å; S119-Y122 PolarHBondContact O-N 3.4Å; S119-F123 WeakPolarHBondContact O-CD2 3.35Å; S119-Y175 WeakPolarHBondContact OG-CE2 3.47Å
120	W	86.9	Confident	78.4	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-56.5	-33.7	-177.3	-178.5	-114.8	0	0	0	113.4	I42 F44 R117 C118 Y122 F123 L124 I168 M171 S172 Y175	I42-W120 PolarHBondContact O-NE1 3.1Å; F44-W120 HydrophobicContact CB-CD2 4.14Å; F44-W120 HydrophobicContact CB-CG 4.46Å; F44-W120 HydrophobicContact CB-CZ2 4.13Å; F44-W120 HydrophobicContact CD2-CE3 4.39Å; F44-W120 HydrophobicContact CD2-CH2 4.38Å; F44-W120 HydrophobicContact CD2-CZ3 4.28Å; R117-W120 WeakPolarHBondContact O-CB 3.41Å; R117-W120 PolarHBondContact O-N 2.96Å; R117-W120 VanDerWaalsContact O-N 3.14Å; C118-W120 PolarHBondContact O-N 3.32Å; W120-Y122 VanDerWaalsContact C-N 3.27Å; W120-Y122 PolarHBondContact O-N 2.84Å; W120-F123 HydrophobicContact CE3-CB 3.87Å; W120-F123 HydrophobicContact CE3-CG 4.32Å; W120-F123 HydrophobicContact CZ3-CB 4.03Å; W120-F123 WeakPolarHBondContact O-CB 3.42Å; W120-F123 PolarHBondContact O-N 2.03Å; W120-F123 VanDerWaalsContact O-N 3.13Å; W120-L124 HydrophobicContact CD2-CG 4.46Å; W120-L124 HydrophobicContact CZ2-CD2 3.89Å; W120-L124 HydrophobicContact CZ2-CG 4.41Å; W120-L124 PolarHBondContact O-N 2.91Å; W120-I168 HydrophobicContact CH2-CD1 3.9Å; W120-I168 HydrophobicContact CZ2-CD1 3.37Å; W120-I168 HydrophobicContact CZ2-CG1 4.19Å; W120-M171 HydrophobicContact CH2-CB 3.9Å; W120-M171 HydrophobicContact CH2-CG 3.71Å; W120-M171 HydrophobicContact CZ3-CB 4.33Å; W120-M171 HydrophobicContact CZ3-CG 3.77Å; W120-S172 VanDerWaalsContact CH2-OG 3.29Å; W120-S172 WeakPolarHBondContact CH2-OG 3.24Å; W120-Y175 HydrophobicContact CE3-CD1 4.3Å; W120-Y175 AromaticContact CE3-CD2 3.94Å; W120-Y175 HydrophobicContact CE3-CD2 3.94Å; W120-Y175 AromaticContact CE3-CG 3.74Å; W120-Y175 HydrophobicContact CE3-CG 3.74Å; W120-Y175 HydrophobicContact CZ3-CG 4.05Å
121	A	83.4	Confident	77.3	Confident	17 Å²	17	33.9 Å²	33.9	14%	0.14	18%	0.184	C	C	.	.	H	α-helix	trans	-59.6	-36.8	176.7	0	0	0	0	0	112.4	S119 L124 A125 L136	S119-A121 PolarHBondContact O-N 2.03Å; S119-A121 VanDerWaalsContact O-N 3.13Å; A121-L124 PolarHBondContact O-N 2.86Å; A121-A125 PolarHBondContact O-N 2.97Å; A121-L136 HydrophobicContact CB-CD1 4.17Å
122	Y	86.9	Confident	76.7	Confident	28 Å²	28	34.9 Å²	34.9	11%	0.11	18%	0.184	C	C	.	.	H	α-helix	trans	-68.4	-37.1	175.9	-58.7	-71.7	0	0	0	112.1	I106 L109 S119 W120 A125 L126 L136 Q139 I140	I106-Y122 VanDerWaalsContact CG2-CB 3.46Å; I106-Y122 HydrophobicContact CG2-CG 4.29Å; L109-Y122 HydrophobicContact CB-CD2 4.18Å; L109-Y122 HydrophobicContact CB-CE2 3.73Å; L109-Y122 HydrophobicContact CD1-CD1 3.82Å; L109-Y122 HydrophobicContact CD1-CD2 4.16Å; L109-Y122 HydrophobicContact CD1-CE1 3.88Å; L109-Y122 HydrophobicContact CD1-CE2 4.24Å; L109-Y122 HydrophobicContact CD1-CG 3.99Å; S119-Y122 WeakPolarHBondContact O-CB 3.44Å; S119-Y122 WeakPolarHBondContact O-CD2 3.33Å; S119-Y122 PolarHBondContact O-N 3.4Å; W120-Y122 VanDerWaalsContact C-N 3.27Å; W120-Y122 PolarHBondContact O-N 2.84Å; Y122-A125 WeakPolarHBondContact O-CB 3.44Å; Y122-A125 PolarHBondContact O-N 3.25Å; Y122-L126 PolarHBondContact O-N 2.89Å; Y122-L136 HydrophobicContact CD1-CB 3.99Å; Y122-L136 HydrophobicContact CD1-CD2 3.87Å; Y122-L136 HydrophobicContact CD1-CG 4.41Å; Y122-L136 HydrophobicContact CE1-CB 4.32Å; Y122-L136 HydrophobicContact CE1-CD2 3.48Å; Y122-L136 VanDerWaalsContact CE1-CD2 3.48Å; Y122-L136 HydrophobicContact CE1-CG 4.44Å; Y122-Q139 HydrophobicContact CE1-CB 4.15Å; Y122-Q139 VanDerWaalsContact CZ-OE1 3.31Å; Y122-Q139 PolarHBondContact OH-OE1 3.1Å; Y122-I140 HydrophobicContact CD1-CD1 4.39Å; Y122-I140 HydrophobicContact CD1-CG1 4.2Å
123	F	86.5	Confident	76.4	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-64.3	-42.8	173.4	-76	-101	0	0	0	110.9	W103 I106 V107 S119 W120 A125 L126 M171 I174 Y175	W103-F123 HydrophobicContact CE3-CD1 4.2Å; W103-F123 AromaticContact CE3-CE1 3.64Å; W103-F123 HydrophobicContact CE3-CE1 3.64Å; W103-F123 HydrophobicContact CE3-CZ 4.27Å; W103-F123 HydrophobicContact CZ3-CD1 4.1Å; W103-F123 HydrophobicContact CZ3-CE1 4.01Å; I106-F123 HydrophobicContact CB-CE2 4.37Å; I106-F123 HydrophobicContact CG2-CD2 3.85Å; I106-F123 HydrophobicContact CG2-CE2 3.58Å; I106-F123 HydrophobicContact CG2-CZ 4.22Å; V107-F123 HydrophobicContact CG2-CE2 3.66Å; V107-F123 HydrophobicContact CG2-CZ 3.62Å; S119-F123 WeakPolarHBondContact O-CD2 3.35Å; W120-F123 HydrophobicContact CE3-CB 3.87Å; W120-F123 HydrophobicContact CE3-CG 4.32Å; W120-F123 HydrophobicContact CZ3-CB 4.03Å; W120-F123 WeakPolarHBondContact O-CB 3.42Å; W120-F123 PolarHBondContact O-N 2.03Å; W120-F123 VanDerWaalsContact O-N 3.13Å; F123-A125 VanDerWaalsContact C-N 3.29Å; F123-A125 PolarHBondContact O-N 3.38Å; F123-L126 WeakPolarHBondContact O-CB 3.34Å; F123-L126 PolarHBondContact O-N 3.03Å; F123-M171 HydrophobicContact CB-CG 3.8Å; F123-M171 HydrophobicContact CB-SD 3.69Å; F123-M171 HydrophobicContact CD1-CG 4.41Å; F123-M171 HydrophobicContact CD1-SD 3.59Å; F123-M171 VanDerWaalsContact CD1-SD 3.59Å; F123-M171 HydrophobicContact CG-SD 4.12Å; F123-M171 WeakPolarHBondContact O-CE 3.18Å; F123-I174 HydrophobicContact CD1-CG2 4.31Å; F123-I174 HydrophobicContact CE1-CB 4.33Å; F123-I174 HydrophobicContact CE1-CG2 3.74Å; F123-Y175 AromaticContact CD2-CD2 3.9Å; F123-Y175 HydrophobicContact CD2-CD2 3.9Å; F123-Y175 AromaticContact CE2-CD2 3.75Å; F123-Y175 HydrophobicContact CE2-CD2 3.75Å; F123-Y175 HydrophobicContact CG-CD2 4.41Å; F123-Y175 HydrophobicContact CZ-CD2 4.12Å
124	L	81.2	Confident	76.2	Confident	7 Å²	7	34 Å²	34	4%	0.037	18%	0.179	C	C	.	.	H	α-helix	trans	-61.8	-36.6	173.1	-68.3	-179	0	0	0	111.8	T41 I42 W120 A121 L126 M127 S131 I168	T41-L124 HydrophobicContact CG2-CD1 4.28Å; I42-L124 HydrophobicContact CB-CD2 4.14Å; W120-L124 HydrophobicContact CD2-CG 4.46Å; W120-L124 HydrophobicContact CZ2-CD2 3.89Å; W120-L124 HydrophobicContact CZ2-CG 4.41Å; W120-L124 PolarHBondContact O-N 2.91Å; A121-L124 PolarHBondContact O-N 2.86Å; L124-L126 PolarHBondContact O-N 3.1Å; L124-L126 VanDerWaalsContact O-N 3.14Å; L124-M127 HydrophobicContact CD2-CE 4.21Å; L124-M127 HydrophobicContact CD2-SD 4.1Å; L124-M127 WeakPolarHBondContact O-CA 3.47Å; L124-M127 WeakPolarHBondContact O-CB 2.98Å; L124-M127 PolarHBondContact O-N 3.14Å; L124-S131 WeakPolarHBondContact O-CB 3.46Å; L124-I168 HydrophobicContact CD2-CD1 3.72Å
125	A	79.1	Confident	76.2	Confident	2 Å²	2	31.1 Å²	31.1	2%	0.017	17%	0.168	C	C	.	.	H	α-helix	trans	-58.7	-27.5	177.7	0	0	0	0	0	113.5	A121 Y122 F123 S131 L136 L137	A121-A125 PolarHBondContact O-N 2.97Å; Y122-A125 WeakPolarHBondContact O-CB 3.44Å; Y122-A125 PolarHBondContact O-N 3.25Å; F123-A125 VanDerWaalsContact C-N 3.29Å; F123-A125 PolarHBondContact O-N 3.38Å; A125-S131 WeakPolarHBondContact CA-O 3.35Å; A125-L136 HydrophobicContact CB-CB 3.75Å; A125-L136 HydrophobicContact CB-CD1 4.07Å; A125-L137 HydrophobicContact CB-CD2 4.34Å; A125-L137 HydrophobicContact CB-CG 4.28Å
126	L	80.6	Confident	76.3	Confident	1 Å²	1	28.1 Å²	28.1	1%	0.005	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-16.1	174.1	-57	173.4	0	0	0	112.9	Y78 W103 I106 Y122 F123 L124 L137 I140 F141 L165 M171	Y78-L126 WeakPolarHBondContact OH-CD2 3.3Å; W103-L126 HydrophobicContact CE3-CD1 4.5Å; W103-L126 HydrophobicContact CH2-CD1 3.91Å; W103-L126 HydrophobicContact CZ3-CD1 3.49Å; W103-L126 VanDerWaalsContact CZ3-CD1 3.49Å; I106-L126 HydrophobicContact CD1-CD1 3.93Å; Y122-L126 PolarHBondContact O-N 2.89Å; F123-L126 WeakPolarHBondContact O-CB 3.34Å; F123-L126 PolarHBondContact O-N 3.03Å; L124-L126 PolarHBondContact O-N 3.1Å; L124-L126 VanDerWaalsContact O-N 3.14Å; L126-L137 HydrophobicContact CD2-CD2 3.77Å; L126-I140 HydrophobicContact CD2-CD1 4.08Å; L126-I140 HydrophobicContact CG-CD1 4.22Å; L126-F141 HydrophobicContact CD2-CE2 3.62Å; L126-F141 HydrophobicContact CD2-CZ 3.8Å; L126-L165 HydrophobicContact CB-CD1 4.03Å; L126-L165 WeakPolarHBondContact O-CD1 3.48Å; L126-M171 HydrophobicContact CB-CE 4.12Å
127	M	74.6	Confident	76.4	Confident	20 Å²	20	25.2 Å²	25.2	10%	0.099	14%	0.135	C	C	.	.	S	Bend	trans	-83.5	118.5	173.2	-65.9	-166.5	7.1	0	0	111	I42 L124 S131 I168 M171	I42-M127 HydrophobicContact CD1-CE 3.94Å; L124-M127 HydrophobicContact CD2-CE 4.21Å; L124-M127 HydrophobicContact CD2-SD 4.1Å; L124-M127 WeakPolarHBondContact O-CA 3.47Å; L124-M127 WeakPolarHBondContact O-CB 2.98Å; L124-M127 PolarHBondContact O-N 3.14Å; M127-S131 WeakPolarHBondContact O-CB 3.43Å; M127-S131 PolarHBondContact O-N 3.27Å; M127-I168 HydrophobicContact CE-CD1 3.98Å; M127-I168 HydrophobicContact SD-CD1 3.84Å; M127-M171 HydrophobicContact CG-CB 4.23Å; M127-M171 HydrophobicContact CG-CE 3.54Å; M127-M171 HydrophobicContact CG-CG 4.08Å; M127-M171 HydrophobicContact SD-CB 3.61Å; M127-M171 HydrophobicContact SD-CE 4.47Å; M127-M171 HydrophobicContact SD-CG 3.9Å
128	Q	64.8	Low	76.7	Confident	15 Å²	15	26.9 Å²	26.9	7%	0.07	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-123.8	159.7	179.6	-89.4	-163.4	-14.1	0	0	113	V154 P156 R164	Q128-V154 PolarHBondContact NE2-O 2.93Å; Q128-V154 VanDerWaalsContact OE1-C 3.3Å; Q128-V154 PolarHBondContact OE1-O 2.99Å; Q128-P156 HydrophobicContact CB-CG 4.08Å; Q128-P156 HydrophobicContact CG-CG 4.5Å; Q128-R164 WeakPolarHBondContact O-CD 3.5Å
129	P	53.8	Low	76.8	Confident	76 Å²	76	30 Å²	30	49%	0.494	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	cis	-86.8	-12.8	7.6	32.6	-34.8	0	0	0	115.2	S131	P129-S131 VanDerWaalsContact C-N 3.34Å; P129-S131 PolarHBondContact O-N 3Å
130	T	54.8	Low	76.7	Confident	67 Å²	67	30.8 Å²	30.8	41%	0.411	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-17.3	-165.9	51.6	0	0	0	0	115.4	I15	I15-T130 HydrophobicContact CD1-CG2 4.14Å
131	S	61.5	Low	76.7	Confident	23 Å²	23	32.4 Å²	32.4	16%	0.161	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-122.2	20.3	-171.2	-44.8	0	0	0	0	113.4	L124 A125 M127 P129 N133	L124-S131 WeakPolarHBondContact O-CB 3.46Å; A125-S131 WeakPolarHBondContact CA-O 3.35Å; M127-S131 WeakPolarHBondContact O-CB 3.43Å; M127-S131 PolarHBondContact O-N 3.27Å; P129-S131 VanDerWaalsContact C-N 3.34Å; P129-S131 PolarHBondContact O-N 3Å; S131-N133 PolarHBondContact O-N 3.47Å; S131-N133 VanDerWaalsContact O-N 3.16Å
132	Y	68.8	Low	76.7	Confident	71 Å²	71	33 Å²	33	28%	0.278	18%	0.175	S	C	.	.			trans	-59.8	119.2	176	178.6	-105.5	0	0	0	111.1	P134 L137 S149 V154	Y132-P134 HydrophobicContact CE1-CB 4.17Å; Y132-P134 HydrophobicContact CE1-CG 4.23Å; Y132-L137 HydrophobicContact CD2-CD1 3.37Å; Y132-L137 HydrophobicContact CE2-CD1 3.25Å; Y132-L137 HydrophobicContact CG-CD1 4.49Å; Y132-S149 WeakPolarHBondContact OH-CB 2.97Å; Y132-S149 PolarHBondContact OH-OG 2.04Å; Y132-V154 HydrophobicContact CE2-CB 4.23Å; Y132-V154 HydrophobicContact CE2-CG2 4.1Å
133	N	75.8	Confident	76.4	Confident	13 Å²	13	36.1 Å²	36.1	7%	0.07	19%	0.194	C	C	.	.			trans	-131.9	108.8	173.4	-175.4	-40	0	0	0	109	S131 H135 L136 L137	S131-N133 PolarHBondContact O-N 3.47Å; S131-N133 VanDerWaalsContact O-N 3.16Å; N133-H135 VanDerWaalsContact C-N 3.3Å; N133-H135 PolarHBondContact O-N 2.97Å; N133-H135 WeakPolarHBondContact OD1-CB 3.18Å; N133-H135 PolarHBondContact OD1-N 3.35Å; N133-L136 HydrophobicContact CB-CB 4.16Å; N133-L136 HydrophobicContact CB-CD1 3.96Å; N133-L136 HydrophobicContact CB-CG 4.05Å; N133-L136 PolarHBondContact O-N 2.81Å; N133-L136 PolarHBondContact OD1-N 3.05Å; N133-L136 VanDerWaalsContact OD1-N 3.15Å; N133-L137 WeakPolarHBondContact O-CG 3.31Å; N133-L137 PolarHBondContact O-N 2.97Å
134	P	73.8	Confident	75.8	Confident	24 Å²	24	42.8 Å²	42.8	16%	0.156	23%	0.225	C	C	.	.	H	α-helix	trans	-63.3	-35	-176.4	24.3	-32	0	0	0	112.5	Y132 L137 K138	Y132-P134 HydrophobicContact CE1-CB 4.17Å; Y132-P134 HydrophobicContact CE1-CG 4.23Å; P134-L137 PolarHBondContact O-N 3.08Å; P134-K138 VanDerWaalsContact O-CB 3.3Å; P134-K138 WeakPolarHBondContact O-CB 3.01Å; P134-K138 PolarHBondContact O-N 2.77Å
135	H	78.3	Confident	75.6	Confident	87 Å²	87	42.5 Å²	42.5	40%	0.403	22%	0.223	S	C	.	.	H	α-helix	trans	-66.3	-42.1	179.1	-62.3	-51.9	0	0	0	112	N133 K138 Q139	N133-H135 VanDerWaalsContact C-N 3.3Å; N133-H135 PolarHBondContact O-N 2.97Å; N133-H135 WeakPolarHBondContact OD1-CB 3.18Å; N133-H135 PolarHBondContact OD1-N 3.35Å; H135-K138 WeakPolarHBondContact O-CB 3.47Å; H135-Q139 PolarHBondContact O-N 3.4Å
136	L	82.7	Confident	75.4	Confident	17 Å²	17	44.4 Å²	44.4	9%	0.089	23%	0.232	C	C	.	.	H	α-helix	trans	-69.2	-41.6	175.7	-61.5	-179.6	0	0	0	111.2	A121 Y122 A125 N133 K138 Q139 I140	A121-L136 HydrophobicContact CB-CD1 4.17Å; Y122-L136 HydrophobicContact CD1-CB 3.99Å; Y122-L136 HydrophobicContact CD1-CD2 3.87Å; Y122-L136 HydrophobicContact CD1-CG 4.41Å; Y122-L136 HydrophobicContact CE1-CB 4.32Å; Y122-L136 HydrophobicContact CE1-CD2 3.48Å; Y122-L136 VanDerWaalsContact CE1-CD2 3.48Å; Y122-L136 HydrophobicContact CE1-CG 4.44Å; A125-L136 HydrophobicContact CB-CB 3.75Å; A125-L136 HydrophobicContact CB-CD1 4.07Å; N133-L136 HydrophobicContact CB-CB 4.16Å; N133-L136 HydrophobicContact CB-CD1 3.96Å; N133-L136 HydrophobicContact CB-CG 4.05Å; N133-L136 PolarHBondContact O-N 2.81Å; N133-L136 PolarHBondContact OD1-N 3.05Å; N133-L136 VanDerWaalsContact OD1-N 3.15Å; L136-K138 VanDerWaalsContact C-N 3.29Å; L136-K138 PolarHBondContact O-N 2.9Å; L136-Q139 WeakPolarHBondContact O-CB 3.15Å; L136-Q139 PolarHBondContact O-N 3.06Å; L136-Q139 VanDerWaalsContact O-N 3.08Å; L136-I140 WeakPolarHBondContact O-CG1 3.25Å; L136-I140 PolarHBondContact O-N 3.49Å; L136-I140 VanDerWaalsContact O-N 3.14Å
137	L	80.4	Confident	75.1	Confident	1 Å²	1	51.8 Å²	51.8	1%	0.005	26%	0.264	C	S	.	.	H	α-helix	trans	-65.1	-33.9	178.2	-70.4	166	0	0	0	112.5	A125 L126 Y132 N133 P134 Q139 I140 F141 F145	A125-L137 HydrophobicContact CB-CD2 4.34Å; A125-L137 HydrophobicContact CB-CG 4.28Å; L126-L137 HydrophobicContact CD2-CD2 3.77Å; Y132-L137 HydrophobicContact CD2-CD1 3.37Å; Y132-L137 HydrophobicContact CE2-CD1 3.25Å; Y132-L137 HydrophobicContact CG-CD1 4.49Å; N133-L137 WeakPolarHBondContact O-CG 3.31Å; N133-L137 PolarHBondContact O-N 2.97Å; P134-L137 PolarHBondContact O-N 3.08Å; L137-Q139 VanDerWaalsContact C-N 3.32Å; L137-Q139 PolarHBondContact O-N 3.27Å; L137-I140 HydrophobicContact CD2-CD1 4.36Å; L137-I140 PolarHBondContact O-N 3.21Å; L137-F141 HydrophobicContact CD2-CD2 4.24Å; L137-F141 HydrophobicContact CD2-CE2 3.92Å; L137-F141 PolarHBondContact O-N 2.64Å; L137-F145 HydrophobicContact CB-CD1 3.81Å; L137-F145 HydrophobicContact CB-CE1 3.58Å; L137-F145 HydrophobicContact CD1-CE1 3.66Å; L137-F145 HydrophobicContact CD1-CZ 4.19Å; L137-F145 HydrophobicContact CD2-CE1 4.34Å; L137-F145 HydrophobicContact CG-CE1 4.05Å
138	K	84.4	Confident	75.1	Confident	73 Å²	73	53 Å²	53	32%	0.317	28%	0.275	S	S	.	.	H	α-helix	trans	-60.1	-40.2	170.1	179.9	-172	-169	145.6	0	112.2	P134 H135 L136 I140 G142 D143 E146	P134-K138 VanDerWaalsContact O-CB 3.3Å; P134-K138 WeakPolarHBondContact O-CB 3.01Å; P134-K138 PolarHBondContact O-N 2.77Å; H135-K138 WeakPolarHBondContact O-CB 3.47Å; L136-K138 VanDerWaalsContact C-N 3.29Å; L136-K138 PolarHBondContact O-N 2.9Å; K138-I140 VanDerWaalsContact C-N 3.27Å; K138-I140 PolarHBondContact O-N 2.89Å; K138-G142 WeakPolarHBondContact O-CA 3.17Å; K138-G142 PolarHBondContact O-N 2.85Å; K138-D143 WeakPolarHBondContact CE-OD1 3.37Å; K138-D143 IonicContact NZ-OD1 3.39Å; K138-D143 PolarHBondContact NZ-OD1 3.46Å; K138-E146 WeakPolarHBondContact CD-OE2 3.41Å; K138-E146 WeakPolarHBondContact CE-OE2 3.45Å; K138-E146 IonicContact NZ-OE1 4Å; K138-E146 IonicContact NZ-OE2 2.75Å; K138-E146 PolarHBondContact NZ-OE2 3.5Å
139	Q	86.4	Confident	75.5	Confident	88 Å²	88	52.8 Å²	52.8	41%	0.411	28%	0.275	S	S	.	.	H	α-helix	trans	-69.4	-28.2	176.3	-66.4	-174.4	10.9	0	0	112.5	L109 Y122 H135 L136 L137	L109-Q139 HydrophobicContact CD1-CB 4.24Å; Y122-Q139 HydrophobicContact CE1-CB 4.15Å; Y122-Q139 VanDerWaalsContact CZ-OE1 3.31Å; Y122-Q139 PolarHBondContact OH-OE1 3.1Å; H135-Q139 PolarHBondContact O-N 3.4Å; L136-Q139 WeakPolarHBondContact O-CB 3.15Å; L136-Q139 PolarHBondContact O-N 3.06Å; L136-Q139 VanDerWaalsContact O-N 3.08Å; L137-Q139 VanDerWaalsContact C-N 3.32Å; L137-Q139 PolarHBondContact O-N 3.27Å
140	I	86.9	Confident	76.5	Confident	16 Å²	16	55.1 Å²	55.1	8%	0.082	28%	0.283	C	S	.	.	H	α-helix	trans	-79.7	-44.5	178	-59.8	169.1	0	0	0	112	I106 L109 Y122 L126 L136 L137 K138	I106-I140 HydrophobicContact CD1-CG2 3.84Å; I106-I140 HydrophobicContact CG1-CG1 4.24Å; I106-I140 HydrophobicContact CG1-CG2 3.85Å; L109-I140 HydrophobicContact CD1-CG1 4.2Å; Y122-I140 HydrophobicContact CD1-CD1 4.39Å; Y122-I140 HydrophobicContact CD1-CG1 4.2Å; L126-I140 HydrophobicContact CD2-CD1 4.08Å; L126-I140 HydrophobicContact CG-CD1 4.22Å; L136-I140 WeakPolarHBondContact O-CG1 3.25Å; L136-I140 PolarHBondContact O-N 3.49Å; L136-I140 VanDerWaalsContact O-N 3.14Å; L137-I140 HydrophobicContact CD2-CD1 4.36Å; L137-I140 PolarHBondContact O-N 3.21Å; K138-I140 VanDerWaalsContact C-N 3.27Å; K138-I140 PolarHBondContact O-N 2.89Å
141	F	85.9	Confident	77.3	Confident	34 Å²	34	60.1 Å²	60.1	15%	0.149	30%	0.299	C	S	.	.	H	α-helix	trans	-118.2	-7	-169	-59.2	-66.6	0	0	0	114.9	Y78 A99 L126 L137 F145	Y78-F141 HydrophobicContact CE2-CD2 4.4Å; Y78-F141 AromaticContact CE2-CE2 3.78Å; Y78-F141 HydrophobicContact CE2-CE2 3.78Å; Y78-F141 AromaticContact CE2-CZ 3.84Å; Y78-F141 HydrophobicContact CE2-CZ 3.84Å; Y78-F141 AromaticContact CZ-CE2 3.84Å; Y78-F141 WeakPolarHBondContact OH-CE2 3.42Å; A99-F141 HydrophobicContact CB-CD1 3.98Å; A99-F141 HydrophobicContact CB-CE1 3.63Å; A99-F141 HydrophobicContact CB-CZ 4.17Å; L126-F141 HydrophobicContact CD2-CE2 3.62Å; L126-F141 HydrophobicContact CD2-CZ 3.8Å; L137-F141 HydrophobicContact CD2-CD2 4.24Å; L137-F141 HydrophobicContact CD2-CE2 3.92Å; L137-F141 PolarHBondContact O-N 2.64Å; F141-F145 HydrophobicContact CB-CB 3.85Å; F141-F145 HydrophobicContact CB-CD2 4.44Å; F141-F145 HydrophobicContact CB-CG 4.15Å; F141-F145 HydrophobicContact CD2-CD2 4.3Å; F141-F145 HydrophobicContact CD2-CE2 4.49Å; F141-F145 HydrophobicContact CD2-CG 4.33Å
142	G	84	Confident	78	Confident	30 Å²	30	61.8 Å²	61.8	31%	0.309	30%	0.304	S	S	.	.			trans	85.2	-176.2	-178.2	0	0	0	0	0	115.2	K138 E144 F145	K138-G142 WeakPolarHBondContact O-CA 3.17Å; K138-G142 PolarHBondContact O-N 2.85Å; G142-E144 VanDerWaalsContact C-N 3.32Å; G142-E144 PolarHBondContact O-N 3.45Å; G142-F145 PolarHBondContact O-N 3.42Å
143	D	81.2	Confident	78.3	Confident	94 Å²	94	62.1 Å²	62.1	50%	0.503	31%	0.31	S	S	.	.	H	α-helix	trans	-64.9	-27	-171.7	-66.6	-22.4	0	0	0	114.6	K138 F145 E146 K147	K138-D143 WeakPolarHBondContact CE-OD1 3.37Å; K138-D143 IonicContact NZ-OD1 3.39Å; K138-D143 PolarHBondContact NZ-OD1 3.46Å; D143-F145 VanDerWaalsContact C-N 3.3Å; D143-F145 PolarHBondContact O-N 2.93Å; D143-E146 PolarHBondContact O-N 3.19Å; D143-K147 PolarHBondContact O-N 3.18Å
144	E	72.4	Confident	78.3	Confident	140 Å²	140	61.6 Å²	61.6	65%	0.654	31%	0.307	S	S	*	.	H	α-helix	trans	-66.8	-33.6	-177.3	-68.5	-170.2	161.9	0	0	112.4	G142 S148	G142-E144 VanDerWaalsContact C-N 3.32Å; G142-E144 PolarHBondContact O-N 3.45Å; E144-S148 PolarHBondContact O-OG 2.81Å
145	F	77.4	Confident	78.3	Confident	0 Å²	0	61 Å²	61	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-69.2	-42.4	178.7	-174.8	-90	0	0	0	111.7	Y78 Y97 L137 F141 G142 D143 K147 S148 S149 V154	Y78-F145 AromaticContact CD1-CE2 3.98Å; Y78-F145 HydrophobicContact CD1-CE2 3.98Å; Y78-F145 HydrophobicContact CD1-CZ 4.03Å; Y78-F145 HydrophobicContact CD2-CD2 4.38Å; Y78-F145 AromaticContact CD2-CE2 3.51Å; Y78-F145 HydrophobicContact CD2-CE2 3.51Å; Y78-F145 HydrophobicContact CD2-CZ 4.29Å; Y78-F145 HydrophobicContact CE1-CE2 4.07Å; Y78-F145 AromaticContact CE1-CZ 3.86Å; Y78-F145 HydrophobicContact CE1-CZ 3.86Å; Y78-F145 HydrophobicContact CE2-CD2 4.5Å; Y78-F145 AromaticContact CE2-CE2 3.64Å; Y78-F145 HydrophobicContact CE2-CE2 3.64Å; Y78-F145 HydrophobicContact CE2-CZ 4.15Å; Y78-F145 AromaticContact CG-CE2 3.62Å; Y78-F145 HydrophobicContact CG-CE2 3.62Å; Y78-F145 HydrophobicContact CG-CZ 4.16Å; Y78-F145 AromaticContact CZ-CE2 3.88Å; Y78-F145 AromaticContact CZ-CZ 3.9Å; Y97-F145 HydrophobicContact CD1-CD2 4.02Å; Y97-F145 HydrophobicContact CD1-CE2 4.37Å; Y97-F145 AromaticContact CE1-CD2 3.98Å; Y97-F145 HydrophobicContact CE1-CD2 3.98Å; L137-F145 HydrophobicContact CB-CD1 3.81Å; L137-F145 HydrophobicContact CB-CE1 3.58Å; L137-F145 HydrophobicContact CD1-CE1 3.66Å; L137-F145 HydrophobicContact CD1-CZ 4.19Å; L137-F145 HydrophobicContact CD2-CE1 4.34Å; L137-F145 HydrophobicContact CG-CE1 4.05Å; F141-F145 HydrophobicContact CB-CB 3.85Å; F141-F145 HydrophobicContact CB-CD2 4.44Å; F141-F145 HydrophobicContact CB-CG 4.15Å; F141-F145 HydrophobicContact CD2-CD2 4.3Å; F141-F145 HydrophobicContact CD2-CE2 4.49Å; F141-F145 HydrophobicContact CD2-CG 4.33Å; G142-F145 PolarHBondContact O-N 3.42Å; D143-F145 VanDerWaalsContact C-N 3.3Å; D143-F145 PolarHBondContact O-N 2.93Å; F145-K147 PolarHBondContact O-N 2.93Å; F145-S148 PolarHBondContact O-N 3.4Å; F145-S149 PolarHBondContact O-N 3.34Å; F145-V154 HydrophobicContact CE1-CG2 4.49Å; F145-V154 HydrophobicContact CE2-CG1 3.99Å; F145-V154 HydrophobicContact CZ-CB 4.33Å; F145-V154 HydrophobicContact CZ-CG1 3.53Å; F145-V154 HydrophobicContact CZ-CG2 4.19Å
146	E	74.6	Confident	78.1	Confident	42 Å²	42	57 Å²	57	20%	0.196	29%	0.285	C	S	.	.	H	α-helix	trans	-58.4	-49.7	179.1	-173.8	176.6	-145.2	0	0	111.1	K138 D143 S148 S149 D150	K138-E146 WeakPolarHBondContact CD-OE2 3.41Å; K138-E146 WeakPolarHBondContact CE-OE2 3.45Å; K138-E146 IonicContact NZ-OE1 4Å; K138-E146 IonicContact NZ-OE2 2.75Å; K138-E146 PolarHBondContact NZ-OE2 3.5Å; D143-E146 PolarHBondContact O-N 3.19Å; E146-S148 PolarHBondContact O-N 2.84Å; E146-S149 WeakPolarHBondContact O-CB 3.32Å; E146-S149 PolarHBondContact O-N 2.88Å; E146-S149 PolarHBondContact O-OG 2.93Å; E146-D150 PolarHBondContact O-N 3.39Å
147	K	74.4	Confident	77.5	Confident	156 Å²	156	57.3 Å²	57.3	68%	0.678	29%	0.286	S	S	*	.	H	α-helix	trans	-56.9	-36.2	-179.8	-69.6	175.1	-175.9	170.3	0	113.7	D143 F145 S149	D143-K147 PolarHBondContact O-N 3.18Å; F145-K147 PolarHBondContact O-N 2.93Å; K147-S149 VanDerWaalsContact C-N 3.27Å
148	S	74.1	Confident	76.9	Confident	47 Å²	47	58.3 Å²	58.3	33%	0.329	29%	0.291	S	S	.	.	H	α-helix	trans	-72.8	-26.2	-179.5	-57.9	0	0	0	0	111.9	Y80 E144 F145 E146 H152	Y80-S148 WeakPolarHBondContact OH-CB 3.13Å; E144-S148 PolarHBondContact O-OG 2.81Å; F145-S148 PolarHBondContact O-N 3.4Å; E146-S148 PolarHBondContact O-N 2.84Å; S148-H152 PolarHBondContact O-ND1 3.29Å
149	S	74	Confident	75.8	Confident	10 Å²	10	64.8 Å²	64.8	7%	0.07	31%	0.314	C	S	.	.	H	α-helix	trans	-87.2	-19.3	-172.5	77.8	0	0	0	0	115.5	Y132 F145 E146 K147 K151 H152 V154	Y132-S149 WeakPolarHBondContact OH-CB 2.97Å; Y132-S149 PolarHBondContact OH-OG 2.04Å; F145-S149 PolarHBondContact O-N 3.34Å; E146-S149 WeakPolarHBondContact O-CB 3.32Å; E146-S149 PolarHBondContact O-N 2.88Å; E146-S149 PolarHBondContact O-OG 2.93Å; K147-S149 VanDerWaalsContact C-N 3.27Å; S149-K151 PolarHBondContact O-N 2.8Å; S149-H152 PolarHBondContact O-N 3.43Å; S149-H152 VanDerWaalsContact O-N 3.15Å; S149-V154 VanDerWaalsContact CB-CG2 3.49Å
150	D	73.9	Confident	74.4	Confident	124 Å²	124	64.6 Å²	64.6	66%	0.663	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-27.9	-174	-73.7	-23.9	0	0	0	114.3	E146	E146-D150 PolarHBondContact O-N 3.39Å
151	K	72.4	Confident	72.7	Confident	172 Å²	172	65 Å²	65	75%	0.748	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.3	-6.3	179.3	-64.5	-176.7	-179.3	179.3	0	114	S149	S149-K151 PolarHBondContact O-N 2.8Å
152	H	77.4	Confident	70.7	Confident	59 Å²	59	64.9 Å²	64.9	27%	0.273	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	140.5	-169.1	-55.9	93.9	0	0	0	111.5	Y80 W81 S148 S149 V154	Y80-H152 HydrophobicContact CD1-CB 4.08Å; Y80-H152 HydrophobicContact CG-CB 4.28Å; W81-H152 CarbonylContact O-C 3.52Å; W81-H152 WeakPolarHBondContact O-CA 3.45Å; S148-H152 PolarHBondContact O-ND1 3.29Å; S149-H152 PolarHBondContact O-N 3.43Å; S149-H152 VanDerWaalsContact O-N 3.15Å; H152-V154 PolarHBondContact O-N 2.83Å; H152-V154 VanDerWaalsContact O-N 3.12Å
153	I	73.9	Confident	69.2	Low	78 Å²	78	67.1 Å²	67.1	40%	0.4	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	101.5	167.1	-55.6	169.4	0	0	0	106.4	W81 R83	W81-I153 HydrophobicContact CB-CB 4.16Å; W81-I153 PolarHBondContact N-O 2.94Å; W81-I153 PolarHBondContact O-N 3.14Å; R83-I153 HydrophobicContact CG-CD1 4.45Å
154	V	76.3	Confident	67.8	Low	1 Å²	1	67 Å²	67	1%	0.006	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59	139.5	170.4	-171.8	0	0	0	0	108.3	Y78 H79 Y80 Q128 Y132 F145 S149 H152	Y78-V154 HydrophobicContact CD1-CG1 3.06Å; Y78-V154 HydrophobicContact CE1-CG1 3.74Å; Y78-V154 HydrophobicContact CG-CG1 3.68Å; H79-V154 CarbonylContact O-C 3.6Å; H79-V154 WeakPolarHBondContact O-CA 3.47Å; Y80-V154 HydrophobicContact CD1-CB 4.41Å; Y80-V154 HydrophobicContact CD1-CG1 4.47Å; Y80-V154 HydrophobicContact CD1-CG2 3.87Å; Y80-V154 HydrophobicContact CE1-CB 4.44Å; Y80-V154 HydrophobicContact CE1-CG1 4.19Å; Y80-V154 HydrophobicContact CE1-CG2 3.78Å; Q128-V154 PolarHBondContact NE2-O 2.93Å; Q128-V154 VanDerWaalsContact OE1-C 3.3Å; Q128-V154 PolarHBondContact OE1-O 2.99Å; Y132-V154 HydrophobicContact CE2-CB 4.23Å; Y132-V154 HydrophobicContact CE2-CG2 4.1Å; F145-V154 HydrophobicContact CE1-CG2 4.49Å; F145-V154 HydrophobicContact CE2-CG1 3.99Å; F145-V154 HydrophobicContact CZ-CB 4.33Å; F145-V154 HydrophobicContact CZ-CG1 3.53Å; F145-V154 HydrophobicContact CZ-CG2 4.19Å; S149-V154 VanDerWaalsContact CB-CG2 3.49Å; H152-V154 PolarHBondContact O-N 2.83Å; H152-V154 VanDerWaalsContact O-N 3.12Å
155	T	73.3	Confident	67.1	Low	11 Å²	11	60.7 Å²	60.7	7%	0.067	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	112.8	177	-61.3	0	0	0	0	110.2	H79 Y163	H79-T155 PolarHBondContact N-O 3.46Å; H79-T155 PolarHBondContact O-N 3.48Å; T155-Y163 HydrophobicContact CG2-CE1 4Å
156	P	73.3	Confident	66.4	Low	5 Å²	5	69.4 Å²	69.4	3%	0.032	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	136.5	177.7	29.3	-33	0	0	0	111	I76 W77 Y78 Q128	I76-P156 HydrophobicContact CG2-CB 3.45Å; I76-P156 VanDerWaalsContact CG2-CB 3.45Å; W77-P156 CarbonylContact O-C 3.46Å; W77-P156 WeakPolarHBondContact O-CA 3.21Å; Y78-P156 HydrophobicContact CD1-CB 4.01Å; Y78-P156 HydrophobicContact CE1-CB 3.76Å; Y78-P156 HydrophobicContact CE1-CG 4.33Å; Q128-P156 HydrophobicContact CB-CG 4.08Å; Q128-P156 HydrophobicContact CG-CG 4.5Å
157	I	71.6	Confident	66.5	Low	22 Å²	22	70.1 Å²	70.1	11%	0.113	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	131.7	-179.3	-57.3	177.1	0	0	0	106.6	W77 H79 P91 G161	W77-I157 HydrophobicContact CB-CB 4.06Å; W77-I157 WeakPolarHBondContact CB-O 3.05Å; W77-I157 PolarHBondContact N-O 3.19Å; W77-I157 PolarHBondContact O-N 3.19Å; H79-I157 HydrophobicContact CB-CD1 3.61Å; H79-I157 HydrophobicContact CB-CG1 4.4Å; P91-I157 HydrophobicContact CG-CD1 4.48Å; I157-G161 WeakPolarHBondContact CG2-O 3.49Å
158	I	68.1	Low	66.9	Low	22 Å²	22	63.4 Å²	63.4	11%	0.113	32%	0.322	C	S	.	.	B	Isolated β-bridge	trans	-97	143.9	173.8	-58.5	169	0	0	0	107.6	P73 G160 G161 L165	P73-I158 HydrophobicContact CB-CG2 3.96Å; P73-I158 HydrophobicContact CG-CD1 4.05Å; P73-I158 HydrophobicContact CG-CG1 4.25Å; P73-I158 HydrophobicContact CG-CG2 4.42Å; I158-G160 PolarHBondContact O-N 3.46Å; I158-G161 PolarHBondContact O-N 3.18Å; I158-L165 HydrophobicContact CD1-CD2 4.1Å; I158-L165 HydrophobicContact CD1-CG 4.1Å
159	R	61.4	Low	67.5	Low	209 Å²	209	61.3 Å²	61.3	79%	0.789	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.5	115.8	177.9	-144.1	-178.8	-171.1	177.3	3	110
160	G	56.5	Low	68.1	Low	84 Å²	84	60.9 Å²	60.9	87%	0.866	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	107.8	4.2	178.8	0	0	0	0	0	117.1	I158	I158-G160 PolarHBondContact O-N 3.46Å
161	G	51.7	Low	68.7	Low	26 Å²	26	55 Å²	55	27%	0.268	27%	0.272	S	S	.	.	B	Isolated β-bridge	trans	-175.5	149	168.2	0	0	0	0	0	115	I157 I158 Y163	I157-G161 WeakPolarHBondContact CG2-O 3.49Å; I158-G161 PolarHBondContact O-N 3.18Å; G161-Y163 PolarHBondContact O-N 2.83Å
162	C	44	Very low	69.5	Low	31 Å²	31	46.8 Å²	46.8	21%	0.209	24%	0.236	C	C	.	.	S	Bend	trans	-66.2	123.7	163.7	-55.8	0	0	0	0	107.9	I4 C6	I4-C162 WeakPolarHBondContact CG2-SG 3.48Å; C6-C162 HydrophobicContact CB-CB 3.84Å; C6-C162 WeakPolarHBondContact CB-SG 3.07Å; C6-C162 WeakPolarHBondContact SG-CB 3.3Å; C6-C162 CovalentContact SG-SG 2.05Å; C6-C162 PolarHBondContact SG-SG 3.16Å
163	Y	51	Low	70.2	Confident	77 Å²	77	44 Å²	44	30%	0.302	22%	0.223	S	C	.	.	S	Bend	trans	66.4	151.5	-178.2	-55.3	-82.1	0	0	0	115.4	W81 T155 G161	W81-Y163 WeakPolarHBondContact CH2-OH 3.01Å; W81-Y163 WeakPolarHBondContact CZ2-OH 3.38Å; T155-Y163 HydrophobicContact CG2-CE1 4Å; G161-Y163 PolarHBondContact O-N 2.83Å
164	R	51.8	Low	71	Confident	90 Å²	90	40.3 Å²	40.3	34%	0.34	20%	0.204	S	C	.	.			cis	-144.8	159.4	-16.1	-135.1	173.1	-98.3	-167.1	1.9	101.8	Q128 R166	Q128-R164 WeakPolarHBondContact O-CD 3.5Å; R164-R166 WeakPolarHBondContact O-CA 3.23Å; R164-R166 WeakPolarHBondContact O-CG 3.47Å; R164-R166 PolarHBondContact O-N 2.03Å
165	L	59	Low	71.7	Confident	9 Å²	9	40.3 Å²	40.3	5%	0.047	21%	0.205	C	C	.	.	S	Bend	trans	-52	104.2	148.4	-76.3	148.3	0	0	0	105.2	I76 L126 I158 T167 M171 I174	I76-L165 HydrophobicContact CD1-CD1 4.14Å; L126-L165 HydrophobicContact CB-CD1 4.03Å; L126-L165 WeakPolarHBondContact O-CD1 3.48Å; I158-L165 HydrophobicContact CD1-CD2 4.1Å; I158-L165 HydrophobicContact CD1-CG 4.1Å; L165-T167 PolarHBondContact O-N 3.3Å; L165-T167 VanDerWaalsContact O-N 3.15Å; L165-M171 HydrophobicContact CB-CE 3.91Å; L165-M171 HydrophobicContact CD1-CE 3.34Å; L165-M171 HydrophobicContact CD2-CE 3.75Å; L165-M171 HydrophobicContact CG-CE 3.82Å; L165-I174 HydrophobicContact CD2-CD1 3.6Å
166	R	61.4	Low	72.5	Confident	182 Å²	182	39.8 Å²	39.8	69%	0.687	20%	0.201	S	C	*	.			trans	-68.8	-28.7	-141.2	-72	-174.6	172.1	-160.7	-2.6	112.6	R164 Q170	R164-R166 WeakPolarHBondContact O-CA 3.23Å; R164-R166 WeakPolarHBondContact O-CG 3.47Å; R164-R166 PolarHBondContact O-N 2.03Å; R166-Q170 VanDerWaalsContact CB-OE1 3.31Å
167	T	77.1	Confident	73.4	Confident	58 Å²	58	40.7 Å²	40.7	36%	0.356	20%	0.204	S	C	.	.			trans	-158	161.9	-175.9	57.9	0	0	0	0	108.5	L165 D169 Q170 M171	L165-T167 PolarHBondContact O-N 3.3Å; L165-T167 VanDerWaalsContact O-N 3.15Å; T167-D169 PolarHBondContact O-N 3.11Å; T167-D169 WeakPolarHBondContact OG1-CB 3.32Å; T167-D169 PolarHBondContact OG1-N 3.35Å; T167-Q170 PolarHBondContact O-N 2.75Å; T167-Q170 VanDerWaalsContact O-N 3.12Å; T167-Q170 PolarHBondContact OG1-N 3.13Å; T167-M171 PolarHBondContact O-N 3.43Å
168	I	82.8	Confident	74.3	Confident	15 Å²	15	39.9 Å²	39.9	8%	0.077	20%	0.2	C	C	.	.	H	α-helix	trans	-53.7	-32.6	165	-170.3	67.5	0	0	0	112	I42 R45 W120 L124 M127 Q170 M171 S172	I42-I168 HydrophobicContact CB-CD1 4.06Å; I42-I168 HydrophobicContact CG2-CB 3.98Å; I42-I168 HydrophobicContact CG2-CD1 3.31Å; I42-I168 HydrophobicContact CG2-CG1 3.56Å; R45-I168 VanDerWaalsContact NE-CG2 3.29Å; R45-I168 VanDerWaalsContact NH1-CG2 3.35Å; W120-I168 HydrophobicContact CH2-CD1 3.9Å; W120-I168 HydrophobicContact CZ2-CD1 3.37Å; W120-I168 HydrophobicContact CZ2-CG1 4.19Å; L124-I168 HydrophobicContact CD2-CD1 3.72Å; M127-I168 HydrophobicContact CE-CD1 3.98Å; M127-I168 HydrophobicContact SD-CD1 3.84Å; I168-Q170 PolarHBondContact O-N 2.84Å; I168-M171 PolarHBondContact O-N 2.02Å; I168-S172 WeakPolarHBondContact O-CB 3.22Å; I168-S172 PolarHBondContact O-N 2.78Å; I168-S172 PolarHBondContact O-OG 2.91Å
169	D	87.2	Confident	75.4	Confident	3 Å²	3	38.8 Å²	38.8	2%	0.016	20%	0.195	C	C	.	.	H	α-helix	trans	-61.3	-45.8	176.3	-56.1	-15.7	0	0	0	111.5	R45 M50 H51 N52 Y55 T167 M171 S172 L173	R45-D169 WeakPolarHBondContact CD-OD1 3.5Å; R45-D169 IonicContact CZ-OD1 3.03Å; R45-D169 IonicContact NE-OD1 2.85Å; R45-D169 IonicContact NH1-OD1 3.3Å; R45-D169 PolarHBondContact NH1-OD1 2.97Å; M50-D169 WeakPolarHBondContact CA-OD1 3.19Å; M50-D169 HydrophobicContact CB-CB 4.08Å; M50-D169 HydrophobicContact CG-CB 3.86Å; M50-D169 HydrophobicContact SD-CB 4.41Å; H51-D169 PolarHBondContact N-OD1 2.95Å; H51-D169 PolarHBondContact N-OD2 2.58Å; N52-D169 PolarHBondContact N-OD2 3.26Å; Y55-D169 HydrophobicContact CD2-CB 3.57Å; Y55-D169 HydrophobicContact CE2-CB 4.08Å; T167-D169 PolarHBondContact O-N 3.11Å; T167-D169 WeakPolarHBondContact OG1-CB 3.32Å; T167-D169 PolarHBondContact OG1-N 3.35Å; D169-M171 VanDerWaalsContact C-N 3.32Å; D169-M171 PolarHBondContact O-N 2.99Å; D169-S172 PolarHBondContact O-N 2.87Å; D169-L173 WeakPolarHBondContact O-CG 3.06Å; D169-L173 PolarHBondContact O-N 2.94Å
170	Q	85.2	Confident	76.7	Confident	1 Å²	1	28.9 Å²	28.9	1%	0.005	16%	0.158	C	C	.	.	H	α-helix	trans	-62	-43.2	177.6	-178.6	177.8	3.5	0	0	110.7	Y55 S70 I71 R166 T167 I168 S172 L173 I174	Y55-Q170 HydrophobicContact CE2-CB 4.35Å; S70-Q170 PolarHBondContact O-NE2 2.78Å; I71-Q170 WeakPolarHBondContact O-CG 2.95Å; I71-Q170 PolarHBondContact O-NE2 3.44Å; R166-Q170 VanDerWaalsContact CB-OE1 3.31Å; T167-Q170 PolarHBondContact O-N 2.75Å; T167-Q170 VanDerWaalsContact O-N 3.12Å; T167-Q170 PolarHBondContact OG1-N 3.13Å; I168-Q170 PolarHBondContact O-N 2.84Å; Q170-S172 VanDerWaalsContact C-N 3.31Å; Q170-S172 PolarHBondContact O-N 2.89Å; Q170-L173 WeakPolarHBondContact O-CB 3.24Å; Q170-L173 PolarHBondContact O-N 3.32Å; Q170-L173 VanDerWaalsContact O-N 3.15Å; Q170-I174 HydrophobicContact CG-CD1 4.4Å; Q170-I174 WeakPolarHBondContact O-CG1 3.49Å; Q170-I174 PolarHBondContact O-N 3.41Å
171	M	87.1	Confident	78.3	Confident	0 Å²	0	29 Å²	29	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-63.7	-40.3	178	-167.7	54.9	75.9	0	0	111.6	W120 F123 L126 M127 L165 T167 I168 D169 L173 I174 Y175	W120-M171 HydrophobicContact CH2-CB 3.9Å; W120-M171 HydrophobicContact CH2-CG 3.71Å; W120-M171 HydrophobicContact CZ3-CB 4.33Å; W120-M171 HydrophobicContact CZ3-CG 3.77Å; F123-M171 HydrophobicContact CB-CG 3.8Å; F123-M171 HydrophobicContact CB-SD 3.69Å; F123-M171 HydrophobicContact CD1-CG 4.41Å; F123-M171 HydrophobicContact CD1-SD 3.59Å; F123-M171 VanDerWaalsContact CD1-SD 3.59Å; F123-M171 HydrophobicContact CG-SD 4.12Å; F123-M171 WeakPolarHBondContact O-CE 3.18Å; L126-M171 HydrophobicContact CB-CE 4.12Å; M127-M171 HydrophobicContact CG-CB 4.23Å; M127-M171 HydrophobicContact CG-CE 3.54Å; M127-M171 HydrophobicContact CG-CG 4.08Å; M127-M171 HydrophobicContact SD-CB 3.61Å; M127-M171 HydrophobicContact SD-CE 4.47Å; M127-M171 HydrophobicContact SD-CG 3.9Å; L165-M171 HydrophobicContact CB-CE 3.91Å; L165-M171 HydrophobicContact CD1-CE 3.34Å; L165-M171 HydrophobicContact CD2-CE 3.75Å; L165-M171 HydrophobicContact CG-CE 3.82Å; T167-M171 PolarHBondContact O-N 3.43Å; I168-M171 PolarHBondContact O-N 2.02Å; D169-M171 VanDerWaalsContact C-N 3.32Å; D169-M171 PolarHBondContact O-N 2.99Å; M171-L173 VanDerWaalsContact C-N 3.32Å; M171-L173 PolarHBondContact O-N 3.4Å; M171-I174 PolarHBondContact O-N 3.08Å; M171-I174 HydrophobicContact SD-CD1 4.24Å; M171-Y175 WeakPolarHBondContact O-CB 3.37Å; M171-Y175 PolarHBondContact O-N 3.4Å
172	S	90	Very high	80	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-63.1	-36.5	173.4	-63.5	0	0	0	0	112	R45 W120 I168 D169 Q170 Y175 I176	R45-S172 PolarHBondContact N-OG 3.23Å; R45-S172 VanDerWaalsContact O-CB 3.29Å; R45-S172 WeakPolarHBondContact O-CB 3.31Å; W120-S172 VanDerWaalsContact CH2-OG 3.29Å; W120-S172 WeakPolarHBondContact CH2-OG 3.24Å; I168-S172 WeakPolarHBondContact O-CB 3.22Å; I168-S172 PolarHBondContact O-N 2.78Å; I168-S172 PolarHBondContact O-OG 2.91Å; D169-S172 PolarHBondContact O-N 2.87Å; Q170-S172 VanDerWaalsContact C-N 3.31Å; Q170-S172 PolarHBondContact O-N 2.89Å; S172-Y175 PolarHBondContact O-N 3.15Å; S172-I176 WeakPolarHBondContact O-CB 3.41Å; S172-I176 WeakPolarHBondContact O-CD1 3.37Å; S172-I176 WeakPolarHBondContact O-CG1 3.35Å; S172-I176 PolarHBondContact O-N 3.07Å
173	L	91	Very high	81.9	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-63.6	-44.4	173.6	-70.6	178.8	0	0	0	112.7	F47 M50 Y55 Y58 F62 I71 D169 Q170 M171 Y175 I176 Y177	F47-L173 HydrophobicContact CD1-CD2 4.04Å; F47-L173 HydrophobicContact CE1-CD2 3.44Å; F47-L173 VanDerWaalsContact CE1-CD2 3.44Å; F47-L173 HydrophobicContact CZ-CD2 4.45Å; M50-L173 HydrophobicContact CE-CD2 3.56Å; M50-L173 HydrophobicContact CE-CG 3.94Å; M50-L173 HydrophobicContact SD-CD2 3.74Å; M50-L173 HydrophobicContact SD-CG 4.11Å; Y55-L173 HydrophobicContact CD1-CD1 3.48Å; Y55-L173 VanDerWaalsContact CD1-CD1 3.48Å; Y55-L173 HydrophobicContact CD2-CD1 3.97Å; Y55-L173 HydrophobicContact CE1-CD1 3.88Å; Y55-L173 HydrophobicContact CE2-CD1 4.32Å; Y55-L173 HydrophobicContact CG-CD1 3.52Å; Y55-L173 HydrophobicContact CG-CG 4.47Å; Y58-L173 HydrophobicContact CD2-CD1 3.7Å; Y58-L173 HydrophobicContact CD2-CD2 3.83Å; Y58-L173 HydrophobicContact CD2-CG 4.43Å; Y58-L173 HydrophobicContact CE2-CD1 3.84Å; F62-L173 HydrophobicContact CE1-CB 4.5Å; F62-L173 HydrophobicContact CE1-CD2 4.02Å; I71-L173 HydrophobicContact CG2-CD1 4.05Å; D169-L173 WeakPolarHBondContact O-CG 3.06Å; D169-L173 PolarHBondContact O-N 2.94Å; Q170-L173 WeakPolarHBondContact O-CB 3.24Å; Q170-L173 PolarHBondContact O-N 3.32Å; Q170-L173 VanDerWaalsContact O-N 3.15Å; M171-L173 VanDerWaalsContact C-N 3.32Å; M171-L173 PolarHBondContact O-N 3.4Å; L173-Y175 VanDerWaalsContact C-N 3.35Å; L173-I176 PolarHBondContact O-N 3.12Å; L173-Y177 VanDerWaalsContact O-CB 3.27Å; L173-Y177 WeakPolarHBondContact O-CB 3.23Å; L173-Y177 PolarHBondContact O-N 2.91Å
174	I	90.8	Very high	83.2	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-61.3	-48.9	177.3	-59.9	166.8	0	0	0	108.9	I72 W103 F123 L165 Q170 M171 I176 Y177 T178	I72-I174 HydrophobicContact CB-CG1 4.41Å; I72-I174 HydrophobicContact CG1-CG1 4Å; I72-I174 HydrophobicContact CG2-CG1 4.36Å; I72-I174 HydrophobicContact CG2-CG2 4.26Å; W103-I174 HydrophobicContact CD2-CG2 3.47Å; W103-I174 VanDerWaalsContact CD2-CG2 3.47Å; W103-I174 HydrophobicContact CE3-CG2 3.48Å; W103-I174 VanDerWaalsContact CE3-CG2 3.48Å; W103-I174 HydrophobicContact CG-CG2 4.07Å; W103-I174 HydrophobicContact CH2-CD1 4.01Å; W103-I174 HydrophobicContact CH2-CG2 3.97Å; W103-I174 HydrophobicContact CZ2-CD1 4.17Å; W103-I174 HydrophobicContact CZ2-CG2 3.97Å; W103-I174 HydrophobicContact CZ3-CG2 3.73Å; F123-I174 HydrophobicContact CD1-CG2 4.31Å; F123-I174 HydrophobicContact CE1-CB 4.33Å; F123-I174 HydrophobicContact CE1-CG2 3.74Å; L165-I174 HydrophobicContact CD2-CD1 3.6Å; Q170-I174 HydrophobicContact CG-CD1 4.4Å; Q170-I174 WeakPolarHBondContact O-CG1 3.49Å; Q170-I174 PolarHBondContact O-N 3.41Å; M171-I174 PolarHBondContact O-N 3.08Å; M171-I174 HydrophobicContact SD-CD1 4.24Å; I174-I176 PolarHBondContact O-N 2.92Å; I174-Y177 PolarHBondContact O-N 2.92Å; I174-T178 PolarHBondContact O-N 2.86Å; I174-T178 PolarHBondContact O-OG1 2.82Å
175	Y	90.7	Very high	84.2	Confident	2 Å²	2	30.8 Å²	30.8	1%	0.008	15%	0.147	C	C	.	.	H	α-helix	trans	-57.3	-50.9	177.1	174.1	-96	0	0	0	112.3	F44 E112 R117 S119 W120 F123 M171 S172 L173 Y177 T178 I179	F44-Y175 AromaticContact CD2-CD1 3.72Å; F44-Y175 HydrophobicContact CD2-CD1 3.72Å; F44-Y175 HydrophobicContact CD2-CE1 4.17Å; F44-Y175 AromaticContact CE2-CD1 3.57Å; F44-Y175 HydrophobicContact CE2-CD1 3.57Å; F44-Y175 HydrophobicContact CE2-CE1 4.09Å; F44-Y175 HydrophobicContact CZ-CD1 4.36Å; E112-Y175 PolarHBondContact OE1-OH 2.82Å; E112-Y175 PolarHBondContact OE2-OH 3.32Å; R117-Y175 VanDerWaalsContact CA-OH 3.25Å; R117-Y175 WeakPolarHBondContact CA-OH 3.27Å; R117-Y175 HydrophobicContact CG-CE1 4.5Å; S119-Y175 WeakPolarHBondContact OG-CE2 3.47Å; W120-Y175 HydrophobicContact CE3-CD1 4.3Å; W120-Y175 AromaticContact CE3-CD2 3.94Å; W120-Y175 HydrophobicContact CE3-CD2 3.94Å; W120-Y175 AromaticContact CE3-CG 3.74Å; W120-Y175 HydrophobicContact CE3-CG 3.74Å; W120-Y175 HydrophobicContact CZ3-CG 4.05Å; F123-Y175 AromaticContact CD2-CD2 3.9Å; F123-Y175 HydrophobicContact CD2-CD2 3.9Å; F123-Y175 AromaticContact CE2-CD2 3.75Å; F123-Y175 HydrophobicContact CE2-CD2 3.75Å; F123-Y175 HydrophobicContact CG-CD2 4.41Å; F123-Y175 HydrophobicContact CZ-CD2 4.12Å; M171-Y175 WeakPolarHBondContact O-CB 3.37Å; M171-Y175 PolarHBondContact O-N 3.4Å; S172-Y175 PolarHBondContact O-N 3.15Å; L173-Y175 VanDerWaalsContact C-N 3.35Å; Y175-Y177 VanDerWaalsContact C-N 3.34Å; Y175-Y177 PolarHBondContact O-N 2.74Å; Y175-T178 PolarHBondContact O-N 2.92Å; Y175-I179 HydrophobicContact CD1-CG1 4.36Å; Y175-I179 HydrophobicContact CD2-CG1 4.01Å; Y175-I179 HydrophobicContact CE1-CG1 3.97Å; Y175-I179 HydrophobicContact CE2-CD1 3.9Å; Y175-I179 HydrophobicContact CE2-CG1 3.57Å; Y175-I179 HydrophobicContact CG-CG1 4.37Å; Y175-I179 WeakPolarHBondContact O-CB 3.28Å; Y175-I179 WeakPolarHBondContact O-CG1 3.26Å; Y175-I179 PolarHBondContact O-N 2.95Å
176	I	91.1	Very high	84.6	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-56.7	-49.2	176.8	-70.2	162.5	0	0	0	110.2	F44 F47 M50 F62 S172 L173 I174 T178 I179 C180 V195	F44-I176 HydrophobicContact CE2-CD1 3.86Å; F44-I176 HydrophobicContact CE2-CG1 3.65Å; F44-I176 HydrophobicContact CZ-CD1 3.77Å; F44-I176 HydrophobicContact CZ-CG1 3.65Å; F47-I176 HydrophobicContact CD1-CD1 4.49Å; F47-I176 HydrophobicContact CD2-CD1 4.49Å; F47-I176 HydrophobicContact CE1-CD1 4.18Å; F47-I176 HydrophobicContact CE2-CD1 4.22Å; F47-I176 HydrophobicContact CE2-CG2 4.01Å; F47-I176 HydrophobicContact CZ-CD1 4.01Å; F47-I176 HydrophobicContact CZ-CG2 3.75Å; M50-I176 HydrophobicContact CE-CD1 3.79Å; F62-I176 HydrophobicContact CE2-CG2 4.37Å; F62-I176 HydrophobicContact CZ-CB 4.5Å; F62-I176 HydrophobicContact CZ-CG2 4.09Å; S172-I176 WeakPolarHBondContact O-CB 3.41Å; S172-I176 WeakPolarHBondContact O-CD1 3.37Å; S172-I176 WeakPolarHBondContact O-CG1 3.35Å; S172-I176 PolarHBondContact O-N 3.07Å; L173-I176 PolarHBondContact O-N 3.12Å; I174-I176 PolarHBondContact O-N 2.92Å; I176-T178 VanDerWaalsContact C-N 3.34Å; I176-T178 PolarHBondContact O-N 3.19Å; I176-I179 PolarHBondContact O-N 3.29Å; I176-C180 VanDerWaalsContact O-CB 3.31Å; I176-C180 WeakPolarHBondContact O-CB 3.18Å; I176-C180 PolarHBondContact O-N 3.25Å; I176-C180 PolarHBondContact O-SG 3.38Å; I176-V195 HydrophobicContact CG1-CB 4.24Å; I176-V195 HydrophobicContact CG1-CG2 4.44Å; I176-V195 VanDerWaalsContact CG2-O 3.23Å; I176-V195 WeakPolarHBondContact CG2-O 3.05Å
177	Y	92.1	Very high	84.3	Confident	23 Å²	23	33.2 Å²	33.2	9%	0.09	17%	0.169	C	C	.	.	H	α-helix	trans	-55.9	-50.1	-179.1	-177	-86.2	0	0	0	111.1	F62 I66 Y67 I72 L173 I174 Y175 H181 H222	F62-Y177 HydrophobicContact CD1-CD2 4.37Å; F62-Y177 AromaticContact CD2-CD2 3.53Å; F62-Y177 HydrophobicContact CD2-CD2 3.53Å; F62-Y177 HydrophobicContact CD2-CE2 4.18Å; F62-Y177 HydrophobicContact CE1-CD2 4.44Å; F62-Y177 AromaticContact CE2-CD2 3.64Å; F62-Y177 HydrophobicContact CE2-CD2 3.64Å; F62-Y177 HydrophobicContact CE2-CG 4.24Å; F62-Y177 AromaticContact CG-CD2 3.91Å; F62-Y177 HydrophobicContact CG-CD2 3.91Å; F62-Y177 HydrophobicContact CG-CE2 4.43Å; F62-Y177 HydrophobicContact CZ-CD2 4.11Å; F62-Y177 HydrophobicContact CZ-CG 4.48Å; I66-Y177 HydrophobicContact CG2-CD2 3.86Å; I66-Y177 HydrophobicContact CG2-CE2 3.44Å; I66-Y177 VanDerWaalsContact CG2-CE2 3.44Å; Y67-Y177 HydrophobicContact CD2-CD1 4.34Å; Y67-Y177 AromaticContact CD2-CE1 3.69Å; Y67-Y177 HydrophobicContact CD2-CE1 3.69Å; Y67-Y177 HydrophobicContact CE2-CE1 4.47Å; Y67-Y177 HydrophobicContact CG-CE1 4.35Å; I72-Y177 HydrophobicContact CD1-CD1 3.99Å; I72-Y177 HydrophobicContact CD1-CD2 3.74Å; I72-Y177 HydrophobicContact CD1-CE2 4.41Å; I72-Y177 HydrophobicContact CD1-CG 3.5Å; L173-Y177 VanDerWaalsContact O-CB 3.27Å; L173-Y177 WeakPolarHBondContact O-CB 3.23Å; L173-Y177 PolarHBondContact O-N 2.91Å; I174-Y177 PolarHBondContact O-N 2.92Å; Y175-Y177 VanDerWaalsContact C-N 3.34Å; Y175-Y177 PolarHBondContact O-N 2.74Å; Y177-H181 AromaticContact CD1-ND1 3.83Å; Y177-H181 AromaticContact CD2-CE1 3.8Å; Y177-H181 AromaticContact CE1-CE1 3.72Å; Y177-H181 AromaticContact CE1-ND1 3.68Å; Y177-H181 AromaticContact CE2-CE1 3.34Å; Y177-H181 WeakPolarHBondContact CE2-CE1 3.4Å; Y177-H181 AromaticContact CE2-ND1 3.98Å; Y177-H181 AromaticContact CZ-CE1 3.29Å; Y177-H181 AromaticContact CZ-ND1 3.76Å; Y177-H181 AromaticContact CZ-NE2 3.87Å; Y177-H181 PolarHBondContact O-N 3.19Å; Y177-H181 PolarHBondContact O-ND1 3.47Å; Y177-H222 AromaticContact CE2-CE1 3.9Å; Y177-H222 AromaticContact CE2-NE2 3.85Å; Y177-H222 PolarHBondContact OH-NE2 2.96Å
178	T	91.6	Very high	83	Confident	5 Å²	5	39.5 Å²	39.5	3%	0.031	19%	0.194	C	C	.	.	H	α-helix	trans	-68	-45.4	-176.9	-52.9	0	0	0	0	112.1	W103 P104 V107 I174 Y175 I176 C180 H181 L182	W103-T178 VanDerWaalsContact C-CG2 3.5Å; W103-T178 HydrophobicContact CB-CG2 3.86Å; W103-T178 WeakPolarHBondContact CB-OG1 3.36Å; W103-T178 WeakPolarHBondContact O-CG2 3.48Å; P104-T178 HydrophobicContact CG-CG2 4.43Å; V107-T178 HydrophobicContact CB-CG2 4.12Å; V107-T178 HydrophobicContact CG2-CG2 3.46Å; V107-T178 VanDerWaalsContact CG2-CG2 3.46Å; I174-T178 PolarHBondContact O-N 2.86Å; I174-T178 PolarHBondContact O-OG1 2.82Å; Y175-T178 PolarHBondContact O-N 2.92Å; I176-T178 VanDerWaalsContact C-N 3.34Å; I176-T178 PolarHBondContact O-N 3.19Å; T178-C180 PolarHBondContact O-N 3.03Å; T178-H181 PolarHBondContact O-N 3.35Å; T178-L182 HydrophobicContact CG2-CD1 4.14Å; T178-L182 PolarHBondContact O-N 3.3Å; T178-L182 VanDerWaalsContact O-N 3.08Å
179	I	89.2	Confident	81.4	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-61.5	-43.2	178.7	-74.7	-79	0	0	0	111.5	V107 E112 Y175 I176 H181 L182 Y183 L193	V107-I179 HydrophobicContact CG1-CD1 3.45Å; V107-I179 VanDerWaalsContact CG1-CD1 3.45Å; V107-I179 HydrophobicContact CG1-CG1 4.25Å; V107-I179 HydrophobicContact CG2-CD1 4.26Å; V107-I179 HydrophobicContact CG2-CG1 4.28Å; E112-I179 HydrophobicContact CB-CD1 4.15Å; E112-I179 VanDerWaalsContact CD-CD1 3.44Å; E112-I179 HydrophobicContact CG-CD1 3.49Å; E112-I179 VanDerWaalsContact CG-CD1 3.49Å; Y175-I179 HydrophobicContact CD1-CG1 4.36Å; Y175-I179 HydrophobicContact CD2-CG1 4.01Å; Y175-I179 HydrophobicContact CE1-CG1 3.97Å; Y175-I179 HydrophobicContact CE2-CD1 3.9Å; Y175-I179 HydrophobicContact CE2-CG1 3.57Å; Y175-I179 HydrophobicContact CG-CG1 4.37Å; Y175-I179 WeakPolarHBondContact O-CB 3.28Å; Y175-I179 WeakPolarHBondContact O-CG1 3.26Å; Y175-I179 PolarHBondContact O-N 2.95Å; I176-I179 PolarHBondContact O-N 3.29Å; I179-H181 VanDerWaalsContact C-N 3.33Å; I179-H181 PolarHBondContact O-N 3.07Å; I179-L182 PolarHBondContact O-N 2.77Å; I179-Y183 HydrophobicContact CD1-CD2 4.11Å; I179-Y183 HydrophobicContact CD1-CE2 4.32Å; I179-Y183 PolarHBondContact O-N 2.03Å; I179-L193 HydrophobicContact CG2-CD1 3.74Å; I179-L193 HydrophobicContact CG2-CD2 3.82Å; I179-L193 HydrophobicContact CG2-CG 4.2Å
180	C	89.4	Confident	79.7	Confident	1 Å²	1	40.8 Å²	40.8	1%	0.007	21%	0.205	C	C	.	.	H	α-helix	trans	-66.1	-36.4	179.9	-64.6	0	0	0	0	112.5	I176 T178 G184 C196 Y221	I176-C180 VanDerWaalsContact O-CB 3.31Å; I176-C180 WeakPolarHBondContact O-CB 3.18Å; I176-C180 PolarHBondContact O-N 3.25Å; I176-C180 PolarHBondContact O-SG 3.38Å; T178-C180 PolarHBondContact O-N 3.03Å; C180-G184 VanDerWaalsContact O-CA 3.22Å; C180-G184 WeakPolarHBondContact O-CA 3.31Å; C180-G184 PolarHBondContact O-N 3.26Å; C180-C196 VanDerWaalsContact CA-SG 3.51Å; C180-C196 HydrophobicContact CB-CB 3.97Å; C180-C196 WeakPolarHBondContact CB-SG 3.47Å; C180-C196 WeakPolarHBondContact SG-CA 3.19Å; C180-C196 WeakPolarHBondContact SG-CB 3.25Å; C180-C196 CovalentContact SG-SG 2.03Å; C180-C196 PolarHBondContact SG-SG 3.1Å; C180-Y221 VanDerWaalsContact C-CE2 3.49Å; C180-Y221 HydrophobicContact CB-CD1 3.93Å; C180-Y221 HydrophobicContact CB-CD2 3.97Å; C180-Y221 HydrophobicContact CB-CE1 3.9Å; C180-Y221 HydrophobicContact CB-CE2 3.97Å; C180-Y221 HydrophobicContact CB-CG 3.97Å; C180-Y221 WeakPolarHBondContact O-CE2 3.33Å; C180-Y221 VanDerWaalsContact O-CZ 3.26Å; C180-Y221 PolarHBondContact O-OH 2.77Å
181	H	89.5	Confident	78.1	Confident	86 Å²	86	46.2 Å²	46.2	40%	0.398	24%	0.241	S	C	.	.	H	α-helix	trans	-72.5	-27	176.2	-75.7	84.1	0	0	0	113.5	Y177 T178 I179 Y221	Y177-H181 AromaticContact CD1-ND1 3.83Å; Y177-H181 AromaticContact CD2-CE1 3.8Å; Y177-H181 AromaticContact CE1-CE1 3.72Å; Y177-H181 AromaticContact CE1-ND1 3.68Å; Y177-H181 AromaticContact CE2-CE1 3.34Å; Y177-H181 WeakPolarHBondContact CE2-CE1 3.4Å; Y177-H181 AromaticContact CE2-ND1 3.98Å; Y177-H181 AromaticContact CZ-CE1 3.29Å; Y177-H181 AromaticContact CZ-ND1 3.76Å; Y177-H181 AromaticContact CZ-NE2 3.87Å; Y177-H181 PolarHBondContact O-N 3.19Å; Y177-H181 PolarHBondContact O-ND1 3.47Å; T178-H181 PolarHBondContact O-N 3.35Å; I179-H181 VanDerWaalsContact C-N 3.33Å; I179-H181 PolarHBondContact O-N 3.07Å; H181-Y221 AromaticContact CE1-CD2 3.9Å
182	L	88.5	Confident	76.4	Confident	73 Å²	73	51.2 Å²	51.2	38%	0.382	27%	0.268	S	S	.	.	H	α-helix	trans	-89.7	-39.8	178.5	-72.1	178.6	0	0	0	113.7	P104 V107 T108 T178 I179	P104-L182 HydrophobicContact CB-CD1 4.18Å; P104-L182 HydrophobicContact CB-CD2 4.33Å; V107-L182 HydrophobicContact CB-CD1 3.85Å; V107-L182 HydrophobicContact CG1-CD1 3.67Å; T108-L182 HydrophobicContact CG2-CD1 4.22Å; T178-L182 HydrophobicContact CG2-CD1 4.14Å; T178-L182 PolarHBondContact O-N 3.3Å; T178-L182 VanDerWaalsContact O-N 3.08Å; I179-L182 PolarHBondContact O-N 2.77Å
183	Y	83.8	Confident	74.8	Confident	38 Å²	38	52.8 Å²	52.8	15%	0.149	28%	0.276	C	S	.	.	H	α-helix	trans	-125.7	-2.7	-169.3	-59.6	-77.4	0	0	0	114	V107 E112 T113 I179 D185 T186	V107-Y183 HydrophobicContact CG1-CD2 4.39Å; V107-Y183 HydrophobicContact CG1-CE2 3.65Å; E112-Y183 HydrophobicContact CB-CD2 4.25Å; E112-Y183 HydrophobicContact CB-CE2 3.84Å; E112-Y183 HydrophobicContact CG-CE2 4.13Å; T113-Y183 HydrophobicContact CG2-CD1 3.73Å; T113-Y183 HydrophobicContact CG2-CE1 3.75Å; I179-Y183 HydrophobicContact CD1-CD2 4.11Å; I179-Y183 HydrophobicContact CD1-CE2 4.32Å; I179-Y183 PolarHBondContact O-N 2.03Å; Y183-D185 PolarHBondContact O-N 3.07Å; Y183-T186 PolarHBondContact O-N 2.86Å; Y183-T186 PolarHBondContact O-OG1 3.38Å
184	G	78.3	Confident	73.8	Confident	7 Å²	7	61.7 Å²	61.7	7%	0.072	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-14.3	-171.7	0	0	0	0	0	115.2	C180 R218 Y221	C180-G184 VanDerWaalsContact O-CA 3.22Å; C180-G184 WeakPolarHBondContact O-CA 3.31Å; C180-G184 PolarHBondContact O-N 3.26Å; G184-R218 PolarHBondContact O-NH2 3.02Å; G184-Y221 WeakPolarHBondContact CA-OH 3.46Å; G184-Y221 PolarHBondContact O-OH 3.29Å
185	D	72.5	Confident	73.3	Confident	143 Å²	143	62 Å²	62	77%	0.765	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-25	170	-73.5	-24.6	0	0	0	112.7	Y183 K187	Y183-D185 PolarHBondContact O-N 3.07Å; D185-K187 PolarHBondContact O-N 2.95Å
186	T	66.4	Low	73.3	Confident	72 Å²	72	62.8 Å²	62.8	44%	0.442	33%	0.325	S	S	.	.			trans	-76	68	170	55	0	0	0	0	109.3	Y183 E188 A189	Y183-T186 PolarHBondContact O-N 2.86Å; Y183-T186 PolarHBondContact O-OG1 3.38Å; T186-E188 PolarHBondContact O-N 3.36Å; T186-A189 PolarHBondContact O-N 3.28Å; T186-A189 VanDerWaalsContact O-N 3.14Å
187	K	55.8	Low	73.3	Confident	171 Å²	171	62.8 Å²	62.8	74%	0.743	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-19.9	-177	-72.1	-173.4	178.2	-178.9	0	114.1	D185	D185-K187 PolarHBondContact O-N 2.95Å
188	E	50.1	Low	73.3	Confident	189 Å²	189	64.7 Å²	64.7	88%	0.883	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	-18.2	-176	-67.4	178.7	171.9	0	0	113.5	T186	T186-E188 PolarHBondContact O-N 3.36Å
189	A	48.9	Very low	73.3	Confident	35 Å²	35	64.7 Å²	64.7	29%	0.289	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-25	-166	0	0	0	0	0	113.9	T113 T186	T113-A189 HydrophobicContact CG2-CB 3.92Å; T186-A189 PolarHBondContact O-N 3.28Å; T186-A189 VanDerWaalsContact O-N 3.14Å
190	I	52.3	Low	73.5	Confident	10 Å²	10	65.7 Å²	65.7	5%	0.051	34%	0.344	C	S	.	.			trans	-136.8	94.6	-174.7	-51.1	168.4	0	0	0	108.9	E112 P116 D192 L193	E112-I190 HydrophobicContact CB-CD1 4.33Å; E112-I190 WeakPolarHBondContact O-CD1 3.18Å; P116-I190 HydrophobicContact CB-CG2 4.03Å; P116-I190 HydrophobicContact CG-CG2 4.14Å; I190-D192 PolarHBondContact O-N 2.8Å; I190-D192 VanDerWaalsContact O-N 3.13Å; I190-L193 HydrophobicContact CB-CB 3.87Å; I190-L193 HydrophobicContact CB-CD1 3.83Å; I190-L193 HydrophobicContact CB-CG 4.31Å; I190-L193 HydrophobicContact CD1-CD1 3.75Å; I190-L193 HydrophobicContact CD1-CD2 4.35Å; I190-L193 HydrophobicContact CG1-CD1 4.38Å; I190-L193 HydrophobicContact CG2-CB 3.96Å; I190-L193 HydrophobicContact CG2-CD1 3.49Å; I190-L193 VanDerWaalsContact CG2-CD1 3.49Å; I190-L193 HydrophobicContact CG2-CG 4.32Å; I190-L193 VanDerWaalsContact O-CB 3.25Å; I190-L193 WeakPolarHBondContact O-CB 3.48Å; I190-L193 PolarHBondContact O-N 2.73Å
191	P	50.1	Low	73.5	Confident	116 Å²	116	70.5 Å²	70.5	75%	0.753	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-29.2	179.4	-24.9	32.8	0	0	0	113.6	L193	P191-L193 VanDerWaalsContact C-N 3.27Å; P191-L193 PolarHBondContact O-N 2.04Å
192	D	52.8	Low	73.6	Confident	104 Å²	104	72.7 Å²	72.7	56%	0.556	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	5.6	178.3	-68.5	-25	0	0	0	113.6	I190 E194	I190-D192 PolarHBondContact O-N 2.8Å; I190-D192 VanDerWaalsContact O-N 3.13Å; D192-E194 PolarHBondContact O-N 3.26Å
193	L	56.8	Low	73.8	Confident	34 Å²	34	77.9 Å²	77.9	18%	0.178	38%	0.384	C	S	.	.			trans	-87.5	28.4	-178.4	-129.8	82	0	0	0	114.4	I179 I190 P191 V195 C196	I179-L193 HydrophobicContact CG2-CD1 3.74Å; I179-L193 HydrophobicContact CG2-CD2 3.82Å; I179-L193 HydrophobicContact CG2-CG 4.2Å; I190-L193 HydrophobicContact CB-CB 3.87Å; I190-L193 HydrophobicContact CB-CD1 3.83Å; I190-L193 HydrophobicContact CB-CG 4.31Å; I190-L193 HydrophobicContact CD1-CD1 3.75Å; I190-L193 HydrophobicContact CD1-CD2 4.35Å; I190-L193 HydrophobicContact CG1-CD1 4.38Å; I190-L193 HydrophobicContact CG2-CB 3.96Å; I190-L193 HydrophobicContact CG2-CD1 3.49Å; I190-L193 VanDerWaalsContact CG2-CD1 3.49Å; I190-L193 HydrophobicContact CG2-CG 4.32Å; I190-L193 VanDerWaalsContact O-CB 3.25Å; I190-L193 WeakPolarHBondContact O-CB 3.48Å; I190-L193 PolarHBondContact O-N 2.73Å; P191-L193 VanDerWaalsContact C-N 3.27Å; P191-L193 PolarHBondContact O-N 2.04Å; L193-V195 HydrophobicContact CD1-CG2 4.04Å; L193-V195 HydrophobicContact CG-CG2 3.82Å; L193-V195 PolarHBondContact O-N 3.17Å; L193-C196 PolarHBondContact O-N 3.18Å
194	E	68.1	Low	74.3	Confident	186 Å²	186	77 Å²	77	87%	0.869	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	17.2	156.6	-70.6	-165.2	162.7	0	0	112.4	D192	D192-E194 PolarHBondContact O-N 3.26Å
195	V	82.3	Confident	75.1	Confident	7 Å²	7	76.8 Å²	76.8	4%	0.042	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-13.6	172.8	-59	0	0	0	0	112.8	F44 T46 F47 I176 L193	F44-V195 HydrophobicContact CE1-CG1 3.77Å; F44-V195 HydrophobicContact CZ-CB 4.27Å; F44-V195 HydrophobicContact CZ-CG1 3.85Å; T46-V195 HydrophobicContact CG2-CG1 4.11Å; F47-V195 WeakPolarHBondContact CE2-O 3.39Å; I176-V195 HydrophobicContact CG1-CB 4.24Å; I176-V195 HydrophobicContact CG1-CG2 4.44Å; I176-V195 VanDerWaalsContact CG2-O 3.23Å; I176-V195 WeakPolarHBondContact CG2-O 3.05Å; L193-V195 HydrophobicContact CD1-CG2 4.04Å; L193-V195 HydrophobicContact CG-CG2 3.82Å; L193-V195 PolarHBondContact O-N 3.17Å
196	C	89.4	Confident	76.2	Confident	18 Å²	18	76 Å²	76	12%	0.122	37%	0.371	C	S	.	.	S	Bend	trans	-76.4	135.3	-177.9	-69.2	0	0	0	0	112.7	C180 L193 Y221	C180-C196 VanDerWaalsContact CA-SG 3.51Å; C180-C196 HydrophobicContact CB-CB 3.97Å; C180-C196 WeakPolarHBondContact CB-SG 3.47Å; C180-C196 WeakPolarHBondContact SG-CA 3.19Å; C180-C196 WeakPolarHBondContact SG-CB 3.25Å; C180-C196 CovalentContact SG-SG 2.03Å; C180-C196 PolarHBondContact SG-SG 3.1Å; L193-C196 PolarHBondContact O-N 3.18Å; C196-Y221 HydrophobicContact CB-CD1 4.07Å; C196-Y221 HydrophobicContact CB-CE1 3.83Å
197	P	91.6	Very high	77.5	Confident	0 Å²	0	81.4 Å²	81.4	0%	0	39%	0.385	C	S	.	.			trans	-54.6	145.4	175.5	-24	29.7	0	0	0	113.1	F47 Y58 E59 F62	F47-P197 HydrophobicContact CE2-CG 3.96Å; F47-P197 HydrophobicContact CZ-CG 3.75Å; Y58-P197 WeakPolarHBondContact O-CB 3.35Å; Y58-P197 WeakPolarHBondContact O-CG 3.48Å; E59-P197 CarbonylContact O-C 3.46Å; E59-P197 VanDerWaalsContact O-CA 3.3Å; E59-P197 WeakPolarHBondContact O-CA 3.46Å; F62-P197 HydrophobicContact CD2-CG 3.59Å; F62-P197 HydrophobicContact CE2-CG 3.33Å; F62-P197 HydrophobicContact CG-CG 4.49Å; F62-P197 HydrophobicContact CZ-CG 4.06Å
198	N	90.9	Very high	79.3	Confident	63 Å²	63	74.8 Å²	74.8	34%	0.337	36%	0.357	S	S	.	.			trans	-129.9	101.7	173.4	-172.1	-3.9	0	0	0	110.6	E59 C200 K201	E59-N198 PolarHBondContact O-N 2.91Å; N198-C200 PolarHBondContact O-N 2.76Å; N198-C200 VanDerWaalsContact O-N 3.12Å; N198-C200 VanDerWaalsContact OD1-CB 3.31Å; N198-C200 WeakPolarHBondContact OD1-CB 3.49Å; N198-C200 PolarHBondContact OD1-N 2.92Å; N198-K201 HydrophobicContact CB-CB 4.44Å; N198-K201 VanDerWaalsContact O-CB 3.24Å; N198-K201 WeakPolarHBondContact O-CB 3.03Å; N198-K201 PolarHBondContact O-N 2.81Å
199	P	92.4	Very high	81.4	Confident	5 Å²	5	73.2 Å²	73.2	3%	0.032	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-58.3	-24.5	175.9	23	-33.7	0	0	0	113.7	N60 K201 R218 K223 D225 Y226	N60-P199 VanDerWaalsContact O-CA 3.29Å; N60-P199 WeakPolarHBondContact O-CA 3.17Å; P199-K201 VanDerWaalsContact C-N 3.25Å; P199-K201 PolarHBondContact O-N 3.28Å; P199-R218 HydrophobicContact CG-CG 4.19Å; P199-K223 WeakPolarHBondContact CB-O 3.42Å; P199-D225 WeakPolarHBondContact CG-O 3.5Å; P199-Y226 HydrophobicContact CB-CD1 4.08Å
200	C	93.3	Very high	83.4	Confident	21 Å²	21	73 Å²	73	14%	0.142	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-74.5	-10.6	176.7	-65.9	0	0	0	0	114.5	N198 R202 R203 C216 K217 R218	N198-C200 PolarHBondContact O-N 2.76Å; N198-C200 VanDerWaalsContact O-N 3.12Å; N198-C200 VanDerWaalsContact OD1-CB 3.31Å; N198-C200 WeakPolarHBondContact OD1-CB 3.49Å; N198-C200 PolarHBondContact OD1-N 2.92Å; C200-R202 VanDerWaalsContact C-N 3.27Å; C200-R202 PolarHBondContact O-N 2.02Å; C200-R203 PolarHBondContact O-N 3.22Å; C200-C216 WeakPolarHBondContact CA-SG 3.46Å; C200-C216 HydrophobicContact CB-CB 3.61Å; C200-C216 WeakPolarHBondContact CB-SG 3.38Å; C200-C216 WeakPolarHBondContact SG-CB 3.23Å; C200-C216 PolarHBondContact SG-O 3.39Å; C200-C216 CovalentContact SG-SG 2.04Å; C200-C216 PolarHBondContact SG-SG 3.34Å; C200-K217 VanDerWaalsContact SG-C 3.56Å; C200-R218 PolarHBondContact SG-N 3.17Å
201	K	90.2	Very high	85.5	Confident	102 Å²	102	73 Å²	73	44%	0.443	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-61.3	-35.4	-178	-166.5	175.9	-173.8	-177.1	0	112.3	E59 N198 P199 R203	E59-K201 HydrophobicContact CG-CD 4.34Å; E59-K201 IonicContact OE1-NZ 2.78Å; E59-K201 PolarHBondContact OE1-NZ 3Å; E59-K201 IonicContact OE2-NZ 2.83Å; E59-K201 PolarHBondContact OE2-NZ 2.83Å; N198-K201 HydrophobicContact CB-CB 4.44Å; N198-K201 VanDerWaalsContact O-CB 3.24Å; N198-K201 WeakPolarHBondContact O-CB 3.03Å; N198-K201 PolarHBondContact O-N 2.81Å; P199-K201 VanDerWaalsContact C-N 3.25Å; P199-K201 PolarHBondContact O-N 3.28Å; K201-R203 VanDerWaalsContact C-N 3.25Å; K201-R203 PolarHBondContact O-N 3.26Å
202	R	90.5	Very high	87.7	Confident	133 Å²	133	70.6 Å²	70.6	50%	0.502	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	-80.7	3.4	175.5	-72	-172.1	177.2	-167.8	-2.9	114.4	E57 N60 C200	E57-R202 IonicContact OE1-CZ 3.68Å; E57-R202 IonicContact OE1-NH2 3.89Å; E57-R202 PolarHBondContact OE1-NH2 2.03Å; N60-R202 HydrophobicContact CB-CG 4.07Å; N60-R202 PolarHBondContact ND2-NE 3.39Å; N60-R202 VanDerWaalsContact ND2-NE 3.15Å; N60-R202 WeakPolarHBondContact OD1-CG 3.21Å; C200-R202 VanDerWaalsContact C-N 3.27Å; C200-R202 PolarHBondContact O-N 2.02Å
203	R	93.5	Very high	89.6	Confident	182 Å²	182	67.9 Å²	67.9	69%	0.687	33%	0.325	S	S	*	.			trans	51.9	55.2	-178.6	-56.6	180	177.7	171.8	-1.4	112.8	C200 K201 C205 H206	C200-R203 PolarHBondContact O-N 3.22Å; K201-R203 VanDerWaalsContact C-N 3.25Å; K201-R203 PolarHBondContact O-N 3.26Å; R203-C205 VanDerWaalsContact C-N 3.27Å; R203-C205 PolarHBondContact O-N 3.29Å; R203-H206 WeakPolarHBondContact O-CB 3.01Å; R203-H206 PolarHBondContact O-N 2.65Å; R203-H206 VanDerWaalsContact O-N 3.07Å
204	P	93.9	Very high	91.3	Very high	20 Å²	20	69.3 Å²	69.3	13%	0.13	35%	0.348	C	S	.	.	G	3₁₀ helix	trans	-57.4	-38.6	-174.6	24.4	-34.1	0	0	0	112.9	H206 Y207 Y226	P204-H206 PolarHBondContact O-N 2.63Å; P204-Y207 PolarHBondContact O-N 2.67Å; P204-Y226 HydrophobicContact CB-CD2 4.19Å; P204-Y226 HydrophobicContact CB-CE1 4.22Å; P204-Y226 HydrophobicContact CB-CE2 3.6Å; P204-Y226 HydrophobicContact CG-CD1 4.28Å; P204-Y226 HydrophobicContact CG-CD2 3.65Å; P204-Y226 HydrophobicContact CG-CE1 4.25Å; P204-Y226 HydrophobicContact CG-CE2 3.61Å; P204-Y226 HydrophobicContact CG-CG 4Å
205	C	95.8	Very high	92.6	Very high	1 Å²	1	61.5 Å²	61.5	1%	0.007	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-62.1	-12.4	179.6	-50.5	0	0	0	0	115	R203 Y207 A211 C216 C228	R203-C205 VanDerWaalsContact C-N 3.27Å; R203-C205 PolarHBondContact O-N 3.29Å; C205-Y207 VanDerWaalsContact C-N 3.34Å; C205-A211 HydrophobicContact CB-CB 4.43Å; C205-C216 WeakPolarHBondContact SG-CA 3.45Å; C205-C216 WeakPolarHBondContact SG-CB 3.21Å; C205-C228 WeakPolarHBondContact CA-SG 3.44Å; C205-C228 HydrophobicContact CB-CB 3.78Å; C205-C228 WeakPolarHBondContact CB-SG 3.24Å; C205-C228 VanDerWaalsContact SG-CA 3.56Å; C205-C228 WeakPolarHBondContact SG-CB 3.46Å; C205-C228 CovalentContact SG-SG 2.02Å; C205-C228 PolarHBondContact SG-SG 3.1Å
206	H	95.2	Very high	93.2	Very high	126 Å²	126	62.6 Å²	62.6	58%	0.583	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-75.3	-26	174.8	-173.5	60.7	0	0	0	112.7	R203 P204	R203-H206 WeakPolarHBondContact O-CB 3.01Å; R203-H206 PolarHBondContact O-N 2.65Å; R203-H206 VanDerWaalsContact O-N 3.07Å; P204-H206 PolarHBondContact O-N 2.63Å
207	Y	92.9	Very high	93.4	Very high	187 Å²	187	67.7 Å²	67.7	73%	0.733	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104	-4.4	-175.1	-54.4	-74.4	0	0	0	113.1	P204 C205	P204-Y207 PolarHBondContact O-N 2.67Å; C205-Y207 VanDerWaalsContact C-N 3.34Å
208	I	94.5	Very high	93.4	Very high	31 Å²	31	70.9 Å²	70.9	16%	0.159	35%	0.354	C	S	.	.	S	Bend	trans	-90.4	129	179.7	-64.7	163.2	0	0	0	108.9	A211 Y226 W236	I208-A211 HydrophobicContact CB-CB 3.81Å; I208-A211 HydrophobicContact CG2-CB 3.83Å; I208-A211 WeakPolarHBondContact O-CB 3.36Å; I208-A211 PolarHBondContact O-N 2.72Å; I208-Y226 HydrophobicContact CD1-CE2 3.82Å; I208-W236 HydrophobicContact CD1-CH2 3.79Å; I208-W236 HydrophobicContact CD1-CZ3 3.97Å; I208-W236 HydrophobicContact CG2-CZ3 4.31Å
209	Q	93.2	Very high	93.3	Very high	157 Å²	157	74.4 Å²	74.4	73%	0.734	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	138.2	178.8	-167.2	-179.7	-13.2	0	0	111.1	A211	Q209-A211 PolarHBondContact O-N 3.07Å; Q209-A211 VanDerWaalsContact O-N 3.14Å
210	N	92.3	Very high	93.2	Very high	31 Å²	31	74.7 Å²	74.7	17%	0.166	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	60.7	13.4	-177.5	-41	-50.6	0	0	0	114.5	C230 E231 Y234 C243	N210-C230 CarbonylContact O-C 3.56Å; N210-C230 WeakPolarHBondContact O-CA 3.22Å; N210-E231 PolarHBondContact O-N 2.85Å; N210-Y234 HydrophobicContact CB-CD1 3.79Å; N210-Y234 HydrophobicContact CB-CD2 3.93Å; N210-Y234 HydrophobicContact CB-CE1 4.02Å; N210-Y234 HydrophobicContact CB-CE2 4.13Å; N210-Y234 HydrophobicContact CB-CG 3.76Å; N210-Y234 VanDerWaalsContact CG-CE1 3.5Å; N210-Y234 WeakPolarHBondContact ND2-CE1 3.32Å; N210-C243 HydrophobicContact CB-CB 3.98Å
211	A	95.8	Very high	93.1	Very high	10 Å²	10	74.3 Å²	74.3	8%	0.083	36%	0.362	C	S	.	.	B	Isolated β-bridge	trans	-95.1	144.1	172.1	0	0	0	0	0	110.6	C205 I208 Q209 G213 C228 L229	C205-A211 HydrophobicContact CB-CB 4.43Å; I208-A211 HydrophobicContact CB-CB 3.81Å; I208-A211 HydrophobicContact CG2-CB 3.83Å; I208-A211 WeakPolarHBondContact O-CB 3.36Å; I208-A211 PolarHBondContact O-N 2.72Å; Q209-A211 PolarHBondContact O-N 3.07Å; Q209-A211 VanDerWaalsContact O-N 3.14Å; A211-G213 PolarHBondContact O-N 2.74Å; A211-C228 HydrophobicContact CB-CB 4Å; A211-L229 WeakPolarHBondContact CA-O 3.46Å
212	V	96	Very high	93.2	Very high	64 Å²	64	70.8 Å²	70.8	39%	0.388	35%	0.347	S	S	.	.	P	Polyproline II helix	trans	-76.9	118.3	178.2	-179.5	0	0	0	0	109.5	G214 S215 L229 E231	V212-G214 PolarHBondContact O-N 3.24Å; V212-S215 VanDerWaalsContact O-CB 3.22Å; V212-S215 WeakPolarHBondContact O-CB 3.34Å; V212-S215 PolarHBondContact O-N 2.76Å; V212-S215 VanDerWaalsContact O-N 3.08Å; V212-S215 PolarHBondContact O-OG 2.9Å; V212-L229 HydrophobicContact CB-CB 4.35Å; V212-L229 HydrophobicContact CG2-CB 4.36Å; V212-L229 PolarHBondContact N-O 3.27Å; V212-E231 HydrophobicContact CG2-CG 4.43Å
213	G	93	Very high	93.3	Very high	48 Å²	48	67.9 Å²	67.9	50%	0.495	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	129.1	177.5	0	0	0	0	0	112.2	A211 S215	A211-G213 PolarHBondContact O-N 2.74Å; G213-S215 VanDerWaalsContact C-N 3.29Å; G213-S215 PolarHBondContact O-N 3.43Å
214	G	91.8	Very high	93.3	Very high	64 Å²	64	62.5 Å²	62.5	66%	0.66	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.6	-1.7	179.6	0	0	0	0	0	115.5	V212 C216	V212-G214 PolarHBondContact O-N 3.24Å; G214-C216 PolarHBondContact O-N 3.32Å; G214-C216 VanDerWaalsContact O-N 3.13Å
215	S	95.8	Very high	93.2	Very high	22 Å²	22	64 Å²	64	15%	0.154	33%	0.33	C	S	.	.			trans	-79.6	14.5	-179.2	78.8	0	0	0	0	114.8	V212 G213 K217 L229	V212-S215 VanDerWaalsContact O-CB 3.22Å; V212-S215 WeakPolarHBondContact O-CB 3.34Å; V212-S215 PolarHBondContact O-N 2.76Å; V212-S215 VanDerWaalsContact O-N 3.08Å; V212-S215 PolarHBondContact O-OG 2.9Å; G213-S215 VanDerWaalsContact C-N 3.29Å; G213-S215 PolarHBondContact O-N 3.43Å; S215-K217 PolarHBondContact O-N 3.25Å; S215-L229 PolarHBondContact OG-N 2.86Å
216	C	95.8	Very high	93.1	Very high	29 Å²	29	65.2 Å²	65.2	20%	0.196	33%	0.334	C	S	.	.			trans	-67.6	128.6	-169.8	-172.5	0	0	0	0	111.2	C200 C205 G214	C200-C216 WeakPolarHBondContact CA-SG 3.46Å; C200-C216 HydrophobicContact CB-CB 3.61Å; C200-C216 WeakPolarHBondContact CB-SG 3.38Å; C200-C216 WeakPolarHBondContact SG-CB 3.23Å; C200-C216 PolarHBondContact SG-O 3.39Å; C200-C216 CovalentContact SG-SG 2.04Å; C200-C216 PolarHBondContact SG-SG 3.34Å; C205-C216 WeakPolarHBondContact SG-CA 3.45Å; C205-C216 WeakPolarHBondContact SG-CB 3.21Å; G214-C216 PolarHBondContact O-N 3.32Å; G214-C216 VanDerWaalsContact O-N 3.13Å
217	K	93.9	Very high	93.1	Very high	125 Å²	125	61.4 Å²	61.4	54%	0.543	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	121.8	174.6	-179.8	172.6	162.3	-143.1	0	110.1	C200 S215 Y226 E227	C200-K217 VanDerWaalsContact SG-C 3.56Å; S215-K217 PolarHBondContact O-N 3.25Å; K217-Y226 CarbonylContact O-C 3.53Å; K217-Y226 VanDerWaalsContact O-CA 3.32Å; K217-Y226 WeakPolarHBondContact O-CA 3.41Å; K217-E227 HydrophobicContact CB-CG 3.89Å; K217-E227 HydrophobicContact CD-CG 4.37Å; K217-E227 VanDerWaalsContact CD-OE1 3.31Å; K217-E227 WeakPolarHBondContact CD-OE1 3.32Å; K217-E227 WeakPolarHBondContact CE-OE1 3.33Å; K217-E227 HydrophobicContact CG-CG 4.32Å; K217-E227 PolarHBondContact N-O 2.95Å; K217-E227 IonicContact NZ-OE1 3.64Å; K217-E227 PolarHBondContact NZ-OE1 3.49Å; K217-E227 PolarHBondContact O-N 3.41Å
218	R	90.1	Very high	93.3	Very high	68 Å²	68	52.8 Å²	52.8	26%	0.257	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	129	175.2	-175.4	-172.6	80.8	175.5	7.7	109.7	G184 P199 C200 G220	G184-R218 PolarHBondContact O-NH2 3.02Å; P199-R218 HydrophobicContact CG-CG 4.19Å; C200-R218 PolarHBondContact SG-N 3.17Å; R218-G220 WeakPolarHBondContact CD-O 3.06Å; R218-G220 WeakPolarHBondContact CG-O 3.41Å
219	R	89.5	Confident	93.4	Very high	137 Å²	137	57 Å²	57	52%	0.517	31%	0.306	S	S	.	.			trans	-107.7	-19.2	172.1	-67.6	-171.7	65.6	-139.8	-9.8	113.6	D225 E227	R219-D225 PolarHBondContact N-O 2.78Å; R219-E227 WeakPolarHBondContact CD-OE2 3.14Å; R219-E227 HydrophobicContact CG-CB 4.48Å; R219-E227 HydrophobicContact CG-CG 4.08Å; R219-E227 IonicContact NE-OE2 2.72Å
220	G	89.8	Confident	93.5	Very high	11 Å²	11	51 Å²	51	11%	0.113	28%	0.281	C	S	.	.	S	Bend	trans	-169.6	-156.7	-175.1	0	0	0	0	0	111.5	R218 D225	R218-G220 WeakPolarHBondContact CD-O 3.06Å; R218-G220 WeakPolarHBondContact CG-O 3.41Å; G220-D225 VanDerWaalsContact CA-CB 3.46Å; G220-D225 WeakPolarHBondContact CA-OD2 3.46Å; G220-D225 PolarHBondContact N-O 3.14Å
221	Y	91	Very high	93.5	Very high	12 Å²	12	54 Å²	54	5%	0.047	29%	0.294	C	S	.	.	S	Bend	trans	-117.9	-1.3	-170.8	-53.1	-69	0	0	0	113.6	G61 F62 C180 H181 G184 C196 D225	G61-Y221 CarbonylContact C-O 3.56Å; G61-Y221 VanDerWaalsContact CA-O 3.26Å; G61-Y221 WeakPolarHBondContact CA-O 3.45Å; F62-Y221 PolarHBondContact N-O 3.32Å; C180-Y221 VanDerWaalsContact C-CE2 3.49Å; C180-Y221 HydrophobicContact CB-CD1 3.93Å; C180-Y221 HydrophobicContact CB-CD2 3.97Å; C180-Y221 HydrophobicContact CB-CE1 3.9Å; C180-Y221 HydrophobicContact CB-CE2 3.97Å; C180-Y221 HydrophobicContact CB-CG 3.97Å; C180-Y221 WeakPolarHBondContact O-CE2 3.33Å; C180-Y221 VanDerWaalsContact O-CZ 3.26Å; C180-Y221 PolarHBondContact O-OH 2.77Å; H181-Y221 AromaticContact CE1-CD2 3.9Å; G184-Y221 WeakPolarHBondContact CA-OH 3.46Å; G184-Y221 PolarHBondContact O-OH 3.29Å; C196-Y221 HydrophobicContact CB-CD1 4.07Å; C196-Y221 HydrophobicContact CB-CE1 3.83Å; Y221-D225 PolarHBondContact N-OD2 3.28Å
222	H	93.3	Very high	92.9	Very high	28 Å²	28	59.2 Å²	59.2	13%	0.13	33%	0.33	C	S	.	.	B	Isolated β-bridge	trans	-84.1	161.1	170.4	-64.6	-96.3	0	0	0	111.5	F62 P63 Y177 D224 D225	F62-H222 CarbonylContact O-C 3.22Å; F62-H222 WeakPolarHBondContact O-CA 3.41Å; F62-H222 WeakPolarHBondContact O-CB 3.35Å; F62-H222 PolarHBondContact O-ND1 3.31Å; P63-H222 PolarHBondContact O-ND1 3.38Å; P63-H222 VanDerWaalsContact O-ND1 3.09Å; Y177-H222 AromaticContact CE2-CE1 3.9Å; Y177-H222 AromaticContact CE2-NE2 3.85Å; Y177-H222 PolarHBondContact OH-NE2 2.96Å; H222-D224 PolarHBondContact O-N 3.31Å; H222-D224 VanDerWaalsContact O-N 3.15Å; H222-D225 HydrophobicContact CB-CB 4.47Å; H222-D225 VanDerWaalsContact CB-OD2 3.31Å; H222-D225 WeakPolarHBondContact CB-OD2 3.02Å; H222-D225 IonicContact CD2-OD2 2.66Å; H222-D225 PolarHBondContact CD2-OD2 2.81Å; H222-D225 VanDerWaalsContact CD2-OD2 3.31Å; H222-D225 IonicContact CG-OD2 3.79Å; H222-D225 PolarHBondContact N-OD2 3.45Å; H222-D225 PolarHBondContact O-N 2.84Å; H222-D225 VanDerWaalsContact O-N 3.09Å
223	K	92.4	Very high	92.1	Very high	72 Å²	72	58 Å²	58	31%	0.313	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-32.7	-179.9	-70.9	-172.5	177.2	-175.5	0	112.9	G61 F62 P199 Y226	G61-K223 WeakPolarHBondContact O-CE 3.16Å; G61-K223 WeakPolarHBondContact O-CG 3.39Å; F62-K223 PolarHBondContact O-N 2.59Å; P199-K223 WeakPolarHBondContact CB-O 3.42Å; K223-Y226 WeakPolarHBondContact O-CD1 3.49Å; K223-Y226 WeakPolarHBondContact O-CE1 3.15Å
224	D	92.9	Very high	91.9	Very high	70 Å²	70	58.4 Å²	58.4	37%	0.374	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	0.8	-174.7	-58.5	-26.6	0	0	0	112.7	P64 H222 Y226 L241	P64-D224 WeakPolarHBondContact CG-OD2 3.35Å; H222-D224 PolarHBondContact O-N 3.31Å; H222-D224 VanDerWaalsContact O-N 3.15Å; D224-Y226 PolarHBondContact O-N 3.2Å; D224-L241 HydrophobicContact CB-CD1 3.66Å; D224-L241 HydrophobicContact CB-CD2 4.33Å
225	D	92.3	Very high	91.9	Very high	51 Å²	51	62.3 Å²	62.3	27%	0.273	32%	0.316	S	S	.	.			trans	-82.7	58.5	-179.2	-68.8	-21.7	0	0	0	112.1	P199 R219 G220 Y221 H222	P199-D225 WeakPolarHBondContact CG-O 3.5Å; R219-D225 PolarHBondContact N-O 2.78Å; G220-D225 VanDerWaalsContact CA-CB 3.46Å; G220-D225 WeakPolarHBondContact CA-OD2 3.46Å; G220-D225 PolarHBondContact N-O 3.14Å; Y221-D225 PolarHBondContact N-OD2 3.28Å; H222-D225 HydrophobicContact CB-CB 4.47Å; H222-D225 VanDerWaalsContact CB-OD2 3.31Å; H222-D225 WeakPolarHBondContact CB-OD2 3.02Å; H222-D225 IonicContact CD2-OD2 2.66Å; H222-D225 PolarHBondContact CD2-OD2 2.81Å; H222-D225 VanDerWaalsContact CD2-OD2 3.31Å; H222-D225 IonicContact CG-OD2 3.79Å; H222-D225 PolarHBondContact N-OD2 3.45Å; H222-D225 PolarHBondContact O-N 2.84Å; H222-D225 VanDerWaalsContact O-N 3.09Å
226	Y	93.5	Very high	91.8	Very high	26 Å²	26	62.8 Å²	62.8	10%	0.102	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	160.8	174.3	66.8	-84.7	0	0	0	111.4	P199 P204 I208 K217 K223 D224 W236	P199-Y226 HydrophobicContact CB-CD1 4.08Å; P204-Y226 HydrophobicContact CB-CD2 4.19Å; P204-Y226 HydrophobicContact CB-CE1 4.22Å; P204-Y226 HydrophobicContact CB-CE2 3.6Å; P204-Y226 HydrophobicContact CG-CD1 4.28Å; P204-Y226 HydrophobicContact CG-CD2 3.65Å; P204-Y226 HydrophobicContact CG-CE1 4.25Å; P204-Y226 HydrophobicContact CG-CE2 3.61Å; P204-Y226 HydrophobicContact CG-CG 4Å; I208-Y226 HydrophobicContact CD1-CE2 3.82Å; K217-Y226 CarbonylContact O-C 3.53Å; K217-Y226 VanDerWaalsContact O-CA 3.32Å; K217-Y226 WeakPolarHBondContact O-CA 3.41Å; K223-Y226 WeakPolarHBondContact O-CD1 3.49Å; K223-Y226 WeakPolarHBondContact O-CE1 3.15Å; D224-Y226 PolarHBondContact O-N 3.2Å; Y226-W236 HydrophobicContact CD2-CH2 4.22Å; Y226-W236 HydrophobicContact CD2-CZ2 4.21Å; Y226-W236 AromaticContact CE2-CH2 3.68Å; Y226-W236 HydrophobicContact CE2-CH2 3.68Å; Y226-W236 AromaticContact CE2-CZ2 4Å; Y226-W236 HydrophobicContact CE2-CZ2 4Å
227	E	95.8	Very high	91.6	Very high	46 Å²	46	65.4 Å²	65.4	22%	0.215	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	145.5	168.4	64.5	-173.3	-175.1	0	0	109.8	K217 R219 W236	K217-E227 HydrophobicContact CB-CG 3.89Å; K217-E227 HydrophobicContact CD-CG 4.37Å; K217-E227 VanDerWaalsContact CD-OE1 3.31Å; K217-E227 WeakPolarHBondContact CD-OE1 3.32Å; K217-E227 WeakPolarHBondContact CE-OE1 3.33Å; K217-E227 HydrophobicContact CG-CG 4.32Å; K217-E227 PolarHBondContact N-O 2.95Å; K217-E227 IonicContact NZ-OE1 3.64Å; K217-E227 PolarHBondContact NZ-OE1 3.49Å; K217-E227 PolarHBondContact O-N 3.41Å; R219-E227 WeakPolarHBondContact CD-OE2 3.14Å; R219-E227 HydrophobicContact CG-CB 4.48Å; R219-E227 HydrophobicContact CG-CG 4.08Å; R219-E227 IonicContact NE-OE2 2.72Å; E227-W236 HydrophobicContact CB-CG 4.35Å
228	C	96.8	Very high	91.5	Very high	7 Å²	7	65.1 Å²	65.1	5%	0.047	32%	0.322	C	S	.	.			trans	-108.5	152.3	174.6	-57	0	0	0	0	109.9	C205 A211 W236	C205-C228 WeakPolarHBondContact CA-SG 3.44Å; C205-C228 HydrophobicContact CB-CB 3.78Å; C205-C228 WeakPolarHBondContact CB-SG 3.24Å; C205-C228 VanDerWaalsContact SG-CA 3.56Å; C205-C228 WeakPolarHBondContact SG-CB 3.46Å; C205-C228 CovalentContact SG-SG 2.02Å; C205-C228 PolarHBondContact SG-SG 3.1Å; A211-C228 HydrophobicContact CB-CB 4Å; C228-W236 HydrophobicContact CB-CD2 4.46Å; C228-W236 HydrophobicContact CB-CE3 3.7Å; C228-W236 HydrophobicContact CB-CH2 4.2Å; C228-W236 HydrophobicContact CB-CZ3 3.55Å
229	L	97	Very high	91.4	Very high	118 Å²	118	69.6 Å²	69.6	62%	0.618	35%	0.351	S	S	*	.	P	Polyproline II helix	trans	-77.3	139.4	162.9	-61.2	178.8	0	0	0	107.6	A211 V212 S215	A211-L229 WeakPolarHBondContact CA-O 3.46Å; V212-L229 HydrophobicContact CB-CB 4.35Å; V212-L229 HydrophobicContact CG2-CB 4.36Å; V212-L229 PolarHBondContact N-O 3.27Å; S215-L229 PolarHBondContact OG-N 2.86Å
230	C	94.3	Very high	91.5	Very high	31 Å²	31	65.7 Å²	65.7	21%	0.209	35%	0.345	C	S	.	.	B	Isolated β-bridge	trans	-101.8	155.3	178.3	-58.2	0	0	0	0	111	N210 W236 C243	N210-C230 CarbonylContact O-C 3.56Å; N210-C230 WeakPolarHBondContact O-CA 3.22Å; C230-W236 PolarHBondContact SG-N 3.35Å; C230-C243 WeakPolarHBondContact CA-SG 3.01Å; C230-C243 HydrophobicContact CB-CB 3.71Å; C230-C243 WeakPolarHBondContact CB-SG 3.46Å; C230-C243 VanDerWaalsContact SG-CA 3.57Å; C230-C243 WeakPolarHBondContact SG-CB 3.02Å; C230-C243 CovalentContact SG-SG 2.03Å; C230-C243 PolarHBondContact SG-SG 3.29Å
231	E	92	Very high	91.7	Very high	96 Å²	96	67 Å²	67	45%	0.449	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-62.5	162.3	171.3	-67.9	177.3	-172.8	0	0	111.5	N210 V212 G233 Y234	N210-E231 PolarHBondContact O-N 2.85Å; V212-E231 HydrophobicContact CG2-CG 4.43Å; E231-G233 PolarHBondContact O-N 2.85Å; E231-Y234 HydrophobicContact CB-CD2 4.29Å; E231-Y234 WeakPolarHBondContact O-CB 3.45Å; E231-Y234 PolarHBondContact O-N 3.03Å
232	S	84.1	Confident	91.8	Very high	119 Å²	119	68.2 Å²	68.2	83%	0.832	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	129.4	-179.6	53.9	0	0	0	0	111.5
233	G	79.1	Confident	91.8	Very high	37 Å²	37	67.2 Å²	67.2	38%	0.381	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	92.3	-3.1	-176.2	0	0	0	0	0	114.4	E231 I246	E231-G233 PolarHBondContact O-N 2.85Å; G233-I246 WeakPolarHBondContact O-CB 3.05Å; G233-I246 WeakPolarHBondContact O-CG1 3.42Å; G233-I246 PolarHBondContact O-N 2.9Å
234	Y	89.2	Confident	91.6	Very high	58 Å²	58	66.1 Å²	66.1	23%	0.227	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	155.5	178.8	-64	-94	0	0	0	112.1	N210 E231 T244 I245	N210-Y234 HydrophobicContact CB-CD1 3.79Å; N210-Y234 HydrophobicContact CB-CD2 3.93Å; N210-Y234 HydrophobicContact CB-CE1 4.02Å; N210-Y234 HydrophobicContact CB-CE2 4.13Å; N210-Y234 HydrophobicContact CB-CG 3.76Å; N210-Y234 VanDerWaalsContact CG-CE1 3.5Å; N210-Y234 WeakPolarHBondContact ND2-CE1 3.32Å; E231-Y234 HydrophobicContact CB-CD2 4.29Å; E231-Y234 WeakPolarHBondContact O-CB 3.45Å; E231-Y234 PolarHBondContact O-N 3.03Å; Y234-T244 CarbonylContact C-O 3.56Å; Y234-T244 VanDerWaalsContact CA-O 3.27Å; Y234-T244 WeakPolarHBondContact CA-O 3Å; Y234-I245 HydrophobicContact CD1-CB 4.17Å; Y234-I245 HydrophobicContact CE1-CB 3.96Å; Y234-I245 HydrophobicContact CE1-CG1 4.43Å
235	K	90.5	Very high	91.2	Very high	145 Å²	145	65.1 Å²	65.1	63%	0.63	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.7	142.5	178.1	-177.9	179.2	178.7	-175.7	0	110.4	E237 C243 T244 I246	K235-E237 PolarHBondContact O-N 2.88Å; K235-C243 WeakPolarHBondContact O-CA 3.33Å; K235-T244 PolarHBondContact N-O 2.03Å; K235-T244 PolarHBondContact O-N 2.86Å; K235-I246 HydrophobicContact CB-CG1 3.83Å
236	W	94.5	Very high	90.6	Very high	32 Å²	32	65.5 Å²	65.5	12%	0.121	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	123.3	177.1	-177.5	-104.7	0	0	0	110.7	I208 Y226 E227 C228 C230 L241	I208-W236 HydrophobicContact CD1-CH2 3.79Å; I208-W236 HydrophobicContact CD1-CZ3 3.97Å; I208-W236 HydrophobicContact CG2-CZ3 4.31Å; Y226-W236 HydrophobicContact CD2-CH2 4.22Å; Y226-W236 HydrophobicContact CD2-CZ2 4.21Å; Y226-W236 AromaticContact CE2-CH2 3.68Å; Y226-W236 HydrophobicContact CE2-CH2 3.68Å; Y226-W236 AromaticContact CE2-CZ2 4Å; Y226-W236 HydrophobicContact CE2-CZ2 4Å; E227-W236 HydrophobicContact CB-CG 4.35Å; C228-W236 HydrophobicContact CB-CD2 4.46Å; C228-W236 HydrophobicContact CB-CE3 3.7Å; C228-W236 HydrophobicContact CB-CH2 4.2Å; C228-W236 HydrophobicContact CB-CZ3 3.55Å; C230-W236 PolarHBondContact SG-N 3.35Å; W236-L241 HydrophobicContact CH2-CB 4.2Å; W236-L241 VanDerWaalsContact CH2-O 3.24Å; W236-L241 WeakPolarHBondContact CH2-O 3.43Å; W236-L241 HydrophobicContact CZ2-CB 4.19Å; W236-L241 HydrophobicContact CZ2-CD2 4.01Å
237	E	92.7	Very high	89.8	Confident	85 Å²	85	67.1 Å²	67.1	40%	0.397	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	120	173.5	-176.6	171.2	-120	0	0	110	K235 D239 S240 L241 S242 T244	K235-E237 PolarHBondContact O-N 2.88Å; E237-D239 PolarHBondContact O-N 2.64Å; E237-S240 WeakPolarHBondContact CB-OG 3.34Å; E237-S240 WeakPolarHBondContact CG-OG 3.19Å; E237-S240 WeakPolarHBondContact OE2-CB 3.43Å; E237-S240 PolarHBondContact OE2-OG 3.22Å; E237-L241 WeakPolarHBondContact O-CA 3.47Å; E237-L241 PolarHBondContact O-N 3.01Å; E237-S242 PolarHBondContact N-O 3.46Å; E237-S242 PolarHBondContact O-N 2.89Å; E237-T244 HydrophobicContact CB-CG2 4.21Å; E237-T244 WeakPolarHBondContact OE2-CG2 3.37Å
238	K	90.1	Very high	88.8	Confident	118 Å²	118	66.7 Å²	66.7	51%	0.513	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-33.4	-170	-67.3	175.9	178.7	176.2	0	113.1	L241	K238-L241 WeakPolarHBondContact O-CD2 3.47Å
239	D	88.3	Confident	88	Confident	162 Å²	162	67.3 Å²	67.3	87%	0.866	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-34.4	-175.1	-58.5	-34.6	0	0	0	112	E237	E237-D239 PolarHBondContact O-N 2.64Å
240	S	91.9	Very high	87.1	Confident	56 Å²	56	69.4 Å²	69.4	39%	0.392	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91	-9.4	177.8	67.4	0	0	0	0	113.7	E237 S242	E237-S240 WeakPolarHBondContact CB-OG 3.34Å; E237-S240 WeakPolarHBondContact CG-OG 3.19Å; E237-S240 WeakPolarHBondContact OE2-CB 3.43Å; E237-S240 PolarHBondContact OE2-OG 3.22Å; S240-S242 PolarHBondContact O-N 3.04Å; S240-S242 PolarHBondContact OG-OG 3.4Å
241	L	93.6	Very high	86.5	Confident	38 Å²	38	74.6 Å²	74.6	20%	0.199	40%	0.395	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.6	41.4	-174.9	-57.7	171.4	0	0	0	112.5	D224 W236 E237 K238	D224-L241 HydrophobicContact CB-CD1 3.66Å; D224-L241 HydrophobicContact CB-CD2 4.33Å; W236-L241 HydrophobicContact CH2-CB 4.2Å; W236-L241 VanDerWaalsContact CH2-O 3.24Å; W236-L241 WeakPolarHBondContact CH2-O 3.43Å; W236-L241 HydrophobicContact CZ2-CB 4.19Å; W236-L241 HydrophobicContact CZ2-CD2 4.01Å; E237-L241 WeakPolarHBondContact O-CA 3.47Å; E237-L241 PolarHBondContact O-N 3.01Å; K238-L241 WeakPolarHBondContact O-CD2 3.47Å
242	S	94.4	Very high	86	Confident	37 Å²	37	75.1 Å²	75.1	26%	0.259	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	159.3	-175.1	74.3	0	0	0	0	112.5	E237 S240 T244	E237-S242 PolarHBondContact N-O 3.46Å; E237-S242 PolarHBondContact O-N 2.89Å; S240-S242 PolarHBondContact O-N 3.04Å; S240-S242 PolarHBondContact OG-OG 3.4Å; S242-T244 PolarHBondContact O-N 3.08Å
243	C	92.9	Very high	86.3	Confident	7 Å²	7	70.1 Å²	70.1	5%	0.047	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	101.2	171.9	-74	0	0	0	0	109.2	N210 C230 K235	N210-C243 HydrophobicContact CB-CB 3.98Å; C230-C243 WeakPolarHBondContact CA-SG 3.01Å; C230-C243 HydrophobicContact CB-CB 3.71Å; C230-C243 WeakPolarHBondContact CB-SG 3.46Å; C230-C243 VanDerWaalsContact SG-CA 3.57Å; C230-C243 WeakPolarHBondContact SG-CB 3.02Å; C230-C243 CovalentContact SG-SG 2.03Å; C230-C243 PolarHBondContact SG-SG 3.29Å; K235-C243 WeakPolarHBondContact O-CA 3.33Å
244	T	88	Confident	86.7	Confident	50 Å²	50	70.4 Å²	70.4	31%	0.307	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	150.2	178	57.4	0	0	0	0	110.6	Y234 K235 E237 S242 I246	Y234-T244 CarbonylContact C-O 3.56Å; Y234-T244 VanDerWaalsContact CA-O 3.27Å; Y234-T244 WeakPolarHBondContact CA-O 3Å; K235-T244 PolarHBondContact N-O 2.03Å; K235-T244 PolarHBondContact O-N 2.86Å; E237-T244 HydrophobicContact CB-CG2 4.21Å; E237-T244 WeakPolarHBondContact OE2-CG2 3.37Å; S242-T244 PolarHBondContact O-N 3.08Å; T244-I246 PolarHBondContact O-N 3.24Å
245	I	83.6	Confident	86.6	Confident	49 Å²	49	75.5 Å²	75.5	25%	0.251	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	135.7	178.2	-167.7	162.7	0	0	0	109	Y234 D247 L263 Q265	Y234-I245 HydrophobicContact CD1-CB 4.17Å; Y234-I245 HydrophobicContact CE1-CB 3.96Å; Y234-I245 HydrophobicContact CE1-CG1 4.43Å; I245-D247 PolarHBondContact O-N 3.41Å; I245-D247 VanDerWaalsContact O-N 3.1Å; I245-L263 HydrophobicContact CD1-CD2 3.66Å; I245-L263 HydrophobicContact CD1-CG 4.09Å; I245-L263 HydrophobicContact CG1-CD2 3.97Å; I245-L263 HydrophobicContact CG2-CD2 3.8Å; I245-Q265 HydrophobicContact CD1-CB 4.47Å
246	I	80.6	Confident	86.6	Confident	59 Å²	59	76 Å²	76	30%	0.303	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-62.4	119	173	-64.8	167.6	0	0	0	106.3	G233 K235 T244 T248 L251	G233-I246 WeakPolarHBondContact O-CB 3.05Å; G233-I246 WeakPolarHBondContact O-CG1 3.42Å; G233-I246 PolarHBondContact O-N 2.9Å; K235-I246 HydrophobicContact CB-CG1 3.83Å; T244-I246 PolarHBondContact O-N 3.24Å; I246-T248 HydrophobicContact CG2-CG2 4.25Å; I246-T248 PolarHBondContact O-N 3.13Å; I246-L251 HydrophobicContact CG2-CD1 4.19Å
247	D	75.7	Confident	86.3	Confident	60 Å²	60	74.9 Å²	74.9	32%	0.321	38%	0.381	S	S	.	.			trans	-66.5	79.6	175.6	-172.9	-12.3	0	0	0	109.2	I245 C249 K250	I245-D247 PolarHBondContact O-N 3.41Å; I245-D247 VanDerWaalsContact O-N 3.1Å; D247-C249 PolarHBondContact O-N 3.49Å; D247-C249 WeakPolarHBondContact OD1-CB 3.48Å; D247-C249 PolarHBondContact OD1-N 3.07Å; D247-K250 PolarHBondContact O-N 3.38Å; D247-K250 PolarHBondContact OD1-N 2.02Å; D247-K250 WeakPolarHBondContact OD2-CD 3.26Å; D247-K250 WeakPolarHBondContact OD2-CE 3.36Å; D247-K250 WeakPolarHBondContact OD2-CG 3.4Å; D247-K250 IonicContact OD2-NZ 3.64Å; D247-K250 PolarHBondContact OD2-NZ 2.87Å
248	T	74.8	Confident	86.2	Confident	37 Å²	37	71.7 Å²	71.7	23%	0.227	37%	0.367	C	S	.	.	H	α-helix	trans	-68	-19.1	179.3	40.3	0	0	0	0	111.3	I246 L251 F252 L263 G268	I246-T248 HydrophobicContact CG2-CG2 4.25Å; I246-T248 PolarHBondContact O-N 3.13Å; T248-L251 PolarHBondContact O-N 2.04Å; T248-F252 WeakPolarHBondContact O-CB 3.48Å; T248-F252 PolarHBondContact O-N 3.03Å; T248-L263 WeakPolarHBondContact OG1-CD1 3.43Å; T248-G268 PolarHBondContact OG1-O 3.31Å
249	C	80.6	Confident	86.3	Confident	20 Å²	20	71.1 Å²	71.1	14%	0.135	37%	0.366	C	S	.	.	H	α-helix	trans	-59.4	-48.5	171.3	-74.9	0	0	0	0	111.5	D247 L251 C253 C261	D247-C249 PolarHBondContact O-N 3.49Å; D247-C249 WeakPolarHBondContact OD1-CB 3.48Å; D247-C249 PolarHBondContact OD1-N 3.07Å; C249-L251 PolarHBondContact O-N 2.98Å; C249-C253 WeakPolarHBondContact O-CB 3.05Å; C249-C253 PolarHBondContact O-N 2.92Å; C249-C261 WeakPolarHBondContact CA-SG 3.45Å; C249-C261 HydrophobicContact CB-CB 3.63Å; C249-C261 WeakPolarHBondContact CB-SG 3.03Å; C249-C261 WeakPolarHBondContact SG-CB 2.94Å; C249-C261 CovalentContact SG-SG 2.02Å; C249-C261 PolarHBondContact SG-SG 3.02Å
250	K	79.1	Confident	86.3	Confident	161 Å²	161	69.1 Å²	69.1	70%	0.7	35%	0.35	S	S	*	.	H	α-helix	trans	-66.7	-24.2	176.7	-73.9	179.9	-172.6	138.3	0	113.9	D247	D247-K250 PolarHBondContact O-N 3.38Å; D247-K250 PolarHBondContact OD1-N 2.02Å; D247-K250 WeakPolarHBondContact OD2-CD 3.26Å; D247-K250 WeakPolarHBondContact OD2-CE 3.36Å; D247-K250 WeakPolarHBondContact OD2-CG 3.4Å; D247-K250 IonicContact OD2-NZ 3.64Å; D247-K250 PolarHBondContact OD2-NZ 2.87Å
251	L	79.7	Confident	86.1	Confident	140 Å²	140	68.4 Å²	68.4	73%	0.733	35%	0.345	S	S	*	.	H	α-helix	trans	-89.4	-31.6	-175.9	-118.1	133.2	0	0	0	112.6	I246 T248 C249	I246-L251 HydrophobicContact CG2-CD1 4.19Å; T248-L251 PolarHBondContact O-N 2.04Å; C249-L251 PolarHBondContact O-N 2.98Å
252	F	83.5	Confident	85.7	Confident	108 Å²	108	72.6 Å²	72.6	47%	0.474	36%	0.361	S	S	.	.	H	α-helix	trans	-108.1	-40.6	-170.8	-171.6	-101.6	0	0	0	113.2	T248 A270 Y281 D282	T248-F252 WeakPolarHBondContact O-CB 3.48Å; T248-F252 PolarHBondContact O-N 3.03Å; F252-A270 HydrophobicContact CB-CB 4.48Å; F252-Y281 WeakPolarHBondContact CE1-O 3.44Å; F252-D282 VanDerWaalsContact O-CB 3.31Å; F252-D282 WeakPolarHBondContact O-CB 3.41Å
253	C	88.6	Confident	85	Confident	14 Å²	14	73.1 Å²	73.1	10%	0.095	36%	0.361	C	S	.	.	S	Bend	trans	-85.9	139.3	-177.9	-55.3	0	0	0	0	111	C249 H255 T258 C261 C272	C249-C253 WeakPolarHBondContact O-CB 3.05Å; C249-C253 PolarHBondContact O-N 2.92Å; C253-H255 PolarHBondContact O-N 3.36Å; C253-T258 HydrophobicContact CB-CG2 4.04Å; C253-T258 WeakPolarHBondContact CB-OG1 3.39Å; C253-C261 PolarHBondContact SG-SG 3.12Å; C253-C272 WeakPolarHBondContact CA-SG 3.31Å; C253-C272 HydrophobicContact CB-CB 3.87Å; C253-C272 WeakPolarHBondContact CB-SG 3.4Å; C253-C272 WeakPolarHBondContact SG-CB 3.19Å; C253-C272 CovalentContact SG-SG 2.03Å; C253-C272 PolarHBondContact SG-SG 3.01Å
254	N	89	Confident	84.2	Confident	43 Å²	43	76.6 Å²	76.6	23%	0.23	38%	0.379	C	S	.	.			trans	-69.6	119	170.4	179.7	-31.8	0	0	0	110.3	E256 T257 T258 D282 N284	N254-E256 VanDerWaalsContact C-N 3.28Å; N254-E256 PolarHBondContact O-N 3.32Å; N254-E256 WeakPolarHBondContact OD1-CB 3.31Å; N254-E256 PolarHBondContact OD1-N 3.15Å; N254-T257 WeakPolarHBondContact CB-OG1 3.43Å; N254-T257 PolarHBondContact O-N 2.85Å; N254-T257 PolarHBondContact OD1-N 3.15Å; N254-T258 WeakPolarHBondContact O-CB 3.41Å; N254-T258 PolarHBondContact O-N 2.89Å; N254-T258 PolarHBondContact O-OG1 3.3Å; N254-D282 WeakPolarHBondContact CB-O 3.17Å; N254-D282 PolarHBondContact N-O 2.76Å; N254-N284 WeakPolarHBondContact CB-OD1 3.47Å; N254-N284 VanDerWaalsContact CG-OD1 3.32Å; N254-N284 PolarHBondContact ND2-OD1 2.69Å
255	H	86.5	Confident	83.3	Confident	165 Å²	165	81.4 Å²	81.4	76%	0.764	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-29.4	-176.4	-170.3	-86.1	0	0	0	114.2	C253	C253-H255 PolarHBondContact O-N 3.36Å
256	E	89.5	Confident	82.5	Confident	154 Å²	154	85.7 Å²	85.7	72%	0.72	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-34.6	-178.2	-61.6	-173.9	168.6	0	0	112.1	N254 K275	N254-E256 VanDerWaalsContact C-N 3.28Å; N254-E256 PolarHBondContact O-N 3.32Å; N254-E256 WeakPolarHBondContact OD1-CB 3.31Å; N254-E256 PolarHBondContact OD1-N 3.15Å; E256-K275 WeakPolarHBondContact O-CE 3.44Å; E256-K275 PolarHBondContact O-NZ 2.75Å
257	T	90.1	Very high	81.9	Confident	10 Å²	10	86.2 Å²	86.2	6%	0.061	44%	0.436	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.2	-6.2	-170.6	60.7	0	0	0	0	113.9	N254 K275 Y278 C283	N254-T257 WeakPolarHBondContact CB-OG1 3.43Å; N254-T257 PolarHBondContact O-N 2.85Å; N254-T257 PolarHBondContact OD1-N 3.15Å; T257-K275 WeakPolarHBondContact O-CB 3.49Å; T257-K275 WeakPolarHBondContact O-CG 3.08Å; T257-K275 PolarHBondContact O-N 3.31Å; T257-Y278 HydrophobicContact CG2-CD1 3.58Å; T257-Y278 HydrophobicContact CG2-CD2 4.09Å; T257-Y278 HydrophobicContact CG2-CE1 3.37Å; T257-Y278 HydrophobicContact CG2-CE2 3.9Å; T257-Y278 HydrophobicContact CG2-CG 3.94Å; T257-C283 VanDerWaalsContact CB-O 3.28Å; T257-C283 WeakPolarHBondContact CB-O 3.49Å; T257-C283 PolarHBondContact OG1-O 3.09Å
258	T	90.6	Very high	81.5	Confident	18 Å²	18	84.4 Å²	84.4	11%	0.11	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	132.5	173.8	-57	0	0	0	0	110.6	C253 N254 F260 C261 C272 V273 K275	C253-T258 HydrophobicContact CB-CG2 4.04Å; C253-T258 WeakPolarHBondContact CB-OG1 3.39Å; N254-T258 WeakPolarHBondContact O-CB 3.41Å; N254-T258 PolarHBondContact O-N 2.89Å; N254-T258 PolarHBondContact O-OG1 3.3Å; T258-F260 WeakPolarHBondContact CG2-O 2.97Å; T258-C261 HydrophobicContact CG2-CB 4.5Å; T258-C272 HydrophobicContact CG2-CB 4.1Å; T258-V273 WeakPolarHBondContact CG2-O 3.35Å; T258-K275 VanDerWaalsContact O-CE 3.31Å; T258-K275 WeakPolarHBondContact O-CE 3.41Å
259	E	90.3	Very high	81.7	Confident	106 Å²	106	86.6 Å²	86.6	50%	0.495	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	-48.8	176.1	-163.2	179.6	166.2	0	0	111.2	V273 K275	E259-V273 PolarHBondContact N-O 2.85Å; E259-K275 HydrophobicContact CB-CG 3.79Å; E259-K275 HydrophobicContact CG-CG 4.35Å
260	F	89.1	Confident	81.7	Confident	119 Å²	119	86.2 Å²	86.2	52%	0.522	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	149.2	176.1	-60.4	-78.4	0	0	0	110.6	T258 F262 V273	T258-F260 WeakPolarHBondContact CG2-O 2.97Å; F260-F262 HydrophobicContact CB-CE2 4.32Å; F260-F262 HydrophobicContact CB-CZ 4.44Å; F260-V273 HydrophobicContact CB-CB 4.14Å; F260-V273 HydrophobicContact CB-CG2 4.44Å; F260-V273 PolarHBondContact N-O 3Å; F260-V273 PolarHBondContact O-N 3.15Å
261	C	87.2	Confident	82.1	Confident	42 Å²	42	82.5 Å²	82.5	28%	0.284	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	131.2	168.6	-179	0	0	0	0	110.4	C249 C253 T258 T271	C249-C261 WeakPolarHBondContact CA-SG 3.45Å; C249-C261 HydrophobicContact CB-CB 3.63Å; C249-C261 WeakPolarHBondContact CB-SG 3.03Å; C249-C261 WeakPolarHBondContact SG-CB 2.94Å; C249-C261 CovalentContact SG-SG 2.02Å; C249-C261 PolarHBondContact SG-SG 3.02Å; C253-C261 PolarHBondContact SG-SG 3.12Å; T258-C261 HydrophobicContact CG2-CB 4.5Å; C261-T271 WeakPolarHBondContact CA-O 3.41Å
262	F	85.9	Confident	82.5	Confident	126 Å²	126	76.6 Å²	76.6	55%	0.553	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.2	125.6	174.6	-60.3	-76.9	0	0	0	109.6	F260 A270 T271 V273	F260-F262 HydrophobicContact CB-CE2 4.32Å; F260-F262 HydrophobicContact CB-CZ 4.44Å; F262-A270 CarbonylContact O-C 3.54Å; F262-A270 WeakPolarHBondContact O-CA 3.28Å; F262-T271 PolarHBondContact N-O 3.31Å; F262-T271 PolarHBondContact O-N 3.17Å; F262-V273 HydrophobicContact CD2-CG2 4.06Å; F262-V273 HydrophobicContact CE2-CG2 3.67Å
263	L	79.8	Confident	82.7	Confident	48 Å²	48	74.1 Å²	74.1	25%	0.251	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	116.5	173.4	-177.8	60.2	0	0	0	109.4	I245 T248 Q265	I245-L263 HydrophobicContact CD1-CD2 3.66Å; I245-L263 HydrophobicContact CD1-CG 4.09Å; I245-L263 HydrophobicContact CG1-CD2 3.97Å; I245-L263 HydrophobicContact CG2-CD2 3.8Å; T248-L263 WeakPolarHBondContact OG1-CD1 3.43Å; L263-Q265 PolarHBondContact O-N 2.83Å
264	N	75.6	Confident	82.6	Confident	79 Å²	79	75 Å²	75	42%	0.422	40%	0.403	S	S	.	.			trans	-74.5	108	167.6	-175.5	-32.4	0	0	0	108.7	T266 S267 G268 V269	N264-T266 PolarHBondContact O-N 3.45Å; N264-T266 VanDerWaalsContact O-N 3.17Å; N264-T266 WeakPolarHBondContact OD1-CB 3.34Å; N264-T266 PolarHBondContact OD1-N 3.5Å; N264-S267 WeakPolarHBondContact CB-OG 3.49Å; N264-S267 VanDerWaalsContact CG-OG 3.25Å; N264-S267 PolarHBondContact O-N 3.18Å; N264-S267 PolarHBondContact OD1-N 3.33Å; N264-G268 WeakPolarHBondContact O-CA 3.1Å; N264-G268 PolarHBondContact O-N 3.48Å; N264-V269 PolarHBondContact N-O 3.04Å
265	Q	68.7	Low	82.6	Confident	151 Å²	151	77 Å²	77	71%	0.706	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-24.4	-176.8	-66.4	-175.5	-15.3	0	0	113.6	I245 L263	I245-Q265 HydrophobicContact CD1-CB 4.47Å; L263-Q265 PolarHBondContact O-N 2.83Å
266	T	67.8	Low	82.4	Confident	139 Å²	139	74.8 Å²	74.8	85%	0.853	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-38.6	-177.6	-43.4	0	0	0	0	112.3	N264	N264-T266 PolarHBondContact O-N 3.45Å; N264-T266 VanDerWaalsContact O-N 3.17Å; N264-T266 WeakPolarHBondContact OD1-CB 3.34Å; N264-T266 PolarHBondContact OD1-N 3.5Å
267	S	67.8	Low	82	Confident	71 Å²	71	68.3 Å²	68.3	50%	0.497	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	-16.3	-178.4	64.9	0	0	0	0	114	N264 V269	N264-S267 WeakPolarHBondContact CB-OG 3.49Å; N264-S267 VanDerWaalsContact CG-OG 3.25Å; N264-S267 PolarHBondContact O-N 3.18Å; N264-S267 PolarHBondContact OD1-N 3.33Å; S267-V269 PolarHBondContact O-N 3.47Å; S267-V269 WeakPolarHBondContact OG-CB 3.32Å; S267-V269 WeakPolarHBondContact OG-CG2 3.34Å; S267-V269 PolarHBondContact OG-N 2.84Å
268	G	67	Low	81.8	Confident	21 Å²	21	72.5 Å²	72.5	22%	0.216	40%	0.398	C	S	.	.			trans	70.8	5.6	-171.8	0	0	0	0	0	114.1	T248 N264	T248-G268 PolarHBondContact OG1-O 3.31Å; N264-G268 WeakPolarHBondContact O-CA 3.1Å; N264-G268 PolarHBondContact O-N 3.48Å
269	V	78.4	Confident	81.6	Confident	84 Å²	84	73.5 Å²	73.5	51%	0.509	40%	0.404	S	S	.	.			trans	-77.8	126.8	-179.2	179.3	0	0	0	0	109.5	N264 S267	N264-V269 PolarHBondContact N-O 3.04Å; S267-V269 PolarHBondContact O-N 3.47Å; S267-V269 WeakPolarHBondContact OG-CB 3.32Å; S267-V269 WeakPolarHBondContact OG-CG2 3.34Å; S267-V269 PolarHBondContact OG-N 2.84Å
270	A	82.3	Confident	81.3	Confident	12 Å²	12	69.6 Å²	69.6	10%	0.099	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	134.6	172.6	0	0	0	0	0	110.1	F252 F262	F252-A270 HydrophobicContact CB-CB 4.48Å; F262-A270 CarbonylContact O-C 3.54Å; F262-A270 WeakPolarHBondContact O-CA 3.28Å
271	T	85.7	Confident	81.1	Confident	82 Å²	82	73.6 Å²	73.6	50%	0.503	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	114.3	171.7	-56.6	0	0	0	0	108.7	C261 F262	C261-T271 WeakPolarHBondContact CA-O 3.41Å; F262-T271 PolarHBondContact N-O 3.31Å; F262-T271 PolarHBondContact O-N 3.17Å
272	C	89	Confident	81.2	Confident	17 Å²	17	73.8 Å²	73.8	12%	0.115	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	128.8	179.2	-41.9	0	0	0	0	109.8	C253 T258 Y281	C253-C272 WeakPolarHBondContact CA-SG 3.31Å; C253-C272 HydrophobicContact CB-CB 3.87Å; C253-C272 WeakPolarHBondContact CB-SG 3.4Å; C253-C272 WeakPolarHBondContact SG-CB 3.19Å; C253-C272 CovalentContact SG-SG 2.03Å; C253-C272 PolarHBondContact SG-SG 3.01Å; T258-C272 HydrophobicContact CG2-CB 4.1Å; C272-Y281 PolarHBondContact SG-O 2.93Å
273	V	87.7	Confident	81.4	Confident	56 Å²	56	67.8 Å²	67.8	34%	0.339	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	117.8	168.1	179.5	0	0	0	0	107.5	T258 E259 F260 F262	T258-V273 WeakPolarHBondContact CG2-O 3.35Å; E259-V273 PolarHBondContact N-O 2.85Å; F260-V273 HydrophobicContact CB-CB 4.14Å; F260-V273 HydrophobicContact CB-CG2 4.44Å; F260-V273 PolarHBondContact N-O 3Å; F260-V273 PolarHBondContact O-N 3.15Å; F262-V273 HydrophobicContact CD2-CG2 4.06Å; F262-V273 HydrophobicContact CE2-CG2 3.67Å
274	C	87.7	Confident	81.8	Confident	31 Å²	31	69.4 Å²	69.4	21%	0.209	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	146.2	-172.3	-49.6	0	0	0	0	112	Y278 C283	C274-Y278 WeakPolarHBondContact CB-O 3.34Å; C274-C283 WeakPolarHBondContact CA-SG 3.09Å; C274-C283 HydrophobicContact CB-CB 3.65Å; C274-C283 WeakPolarHBondContact CB-SG 3.27Å; C274-C283 PolarHBondContact N-SG 2.87Å; C274-C283 VanDerWaalsContact N-SG 3.38Å; C274-C283 WeakPolarHBondContact SG-CA 3.44Å; C274-C283 WeakPolarHBondContact SG-CB 3.16Å; C274-C283 CovalentContact SG-SG 2.04Å; C274-C283 PolarHBondContact SG-SG 3.36Å
275	K	87.8	Confident	82.4	Confident	85 Å²	85	71.1 Å²	71.1	37%	0.37	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-63	157.5	168.7	-68.6	177.8	-176.9	170.4	0	110.2	E256 T257 T258 E259 G277 Y278	E256-K275 WeakPolarHBondContact O-CE 3.44Å; E256-K275 PolarHBondContact O-NZ 2.75Å; T257-K275 WeakPolarHBondContact O-CB 3.49Å; T257-K275 WeakPolarHBondContact O-CG 3.08Å; T257-K275 PolarHBondContact O-N 3.31Å; T258-K275 VanDerWaalsContact O-CE 3.31Å; T258-K275 WeakPolarHBondContact O-CE 3.41Å; E259-K275 HydrophobicContact CB-CG 3.79Å; E259-K275 HydrophobicContact CG-CG 4.35Å; K275-G277 PolarHBondContact O-N 2.65Å; K275-Y278 HydrophobicContact CB-CD2 4.43Å; K275-Y278 PolarHBondContact O-N 3.04Å; K275-Y278 VanDerWaalsContact O-N 3.07Å
276	T	82.4	Confident	83.1	Confident	119 Å²	119	68 Å²	68	73%	0.73	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51	127.2	173.1	52.4	0	0	0	0	111.2
277	G	81.4	Confident	83.9	Confident	19 Å²	19	61.5 Å²	61.5	20%	0.196	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	95.4	0.2	-178.4	0	0	0	0	0	114.8	K275 P286 F287	K275-G277 PolarHBondContact O-N 2.65Å; G277-P286 CarbonylContact O-C 3.25Å; G277-P286 WeakPolarHBondContact O-CA 3.48Å; G277-F287 PolarHBondContact O-N 3.16Å
278	Y	86.5	Confident	84.8	Confident	97 Å²	97	60 Å²	60	38%	0.38	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	155.1	177.1	-63.4	-88.2	0	0	0	112.1	T257 C274 K275 Q285	T257-Y278 HydrophobicContact CG2-CD1 3.58Å; T257-Y278 HydrophobicContact CG2-CD2 4.09Å; T257-Y278 HydrophobicContact CG2-CE1 3.37Å; T257-Y278 HydrophobicContact CG2-CE2 3.9Å; T257-Y278 HydrophobicContact CG2-CG 3.94Å; C274-Y278 WeakPolarHBondContact CB-O 3.34Å; K275-Y278 HydrophobicContact CB-CD2 4.43Å; K275-Y278 PolarHBondContact O-N 3.04Å; K275-Y278 VanDerWaalsContact O-N 3.07Å; Y278-Q285 CarbonylContact C-O 3.58Å; Y278-Q285 VanDerWaalsContact CA-O 3.26Å; Y278-Q285 WeakPolarHBondContact CA-O 3.07Å
279	T	85.1	Confident	85.7	Confident	39 Å²	39	59 Å²	59	24%	0.239	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	-177.6	-178.3	-167.3	0	0	0	0	110.4	C283 Q285	T279-C283 CarbonylContact O-C 3.39Å; T279-C283 WeakPolarHBondContact O-CA 3.02Å; T279-Q285 HydrophobicContact CG2-CB 3.97Å; T279-Q285 PolarHBondContact N-O 2.87Å; T279-Q285 WeakPolarHBondContact O-CB 3.17Å; T279-Q285 PolarHBondContact O-N 3.39Å; T279-Q285 VanDerWaalsContact O-N 3.17Å
280	G	84	Confident	86.2	Confident	24 Å²	24	55.1 Å²	55.1	25%	0.247	30%	0.297	C	S	.	.	S	Bend	trans	92.2	164.6	-176.2	0	0	0	0	0	113	D282 C283	G280-D282 PolarHBondContact O-N 2.94Å; G280-C283 PolarHBondContact O-N 3.28Å
281	Y	85.8	Confident	86.4	Confident	204 Å²	204	59.5 Å²	59.5	80%	0.8	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-27.3	-175.4	-66.6	-76.8	0	0	0	113.7	F252 C272	F252-Y281 WeakPolarHBondContact CE1-O 3.44Å; C272-Y281 PolarHBondContact SG-O 2.93Å
282	D	88.5	Confident	85.9	Confident	46 Å²	46	57.1 Å²	57.1	25%	0.246	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.2	4.4	-179.2	61.1	-4.6	0	0	0	113.1	F252 N254 G280 N284	F252-D282 VanDerWaalsContact O-CB 3.31Å; F252-D282 WeakPolarHBondContact O-CB 3.41Å; N254-D282 WeakPolarHBondContact CB-O 3.17Å; N254-D282 PolarHBondContact N-O 2.76Å; G280-D282 PolarHBondContact O-N 2.94Å; D282-N284 VanDerWaalsContact CG-ND2 3.29Å; D282-N284 PolarHBondContact O-N 3.33Å; D282-N284 WeakPolarHBondContact OD1-CB 3.49Å; D282-N284 PolarHBondContact OD1-N 3.39Å; D282-N284 PolarHBondContact OD2-ND2 2.8Å
283	C	89.8	Confident	84.8	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	32%	0.315	C	S	.	.	S	Bend	trans	61.1	19.1	-175.1	-54.2	0	0	0	0	115.4	T257 C274 T279 G280 Q285	T257-C283 VanDerWaalsContact CB-O 3.28Å; T257-C283 WeakPolarHBondContact CB-O 3.49Å; T257-C283 PolarHBondContact OG1-O 3.09Å; C274-C283 WeakPolarHBondContact CA-SG 3.09Å; C274-C283 HydrophobicContact CB-CB 3.65Å; C274-C283 WeakPolarHBondContact CB-SG 3.27Å; C274-C283 PolarHBondContact N-SG 2.87Å; C274-C283 VanDerWaalsContact N-SG 3.38Å; C274-C283 WeakPolarHBondContact SG-CA 3.44Å; C274-C283 WeakPolarHBondContact SG-CB 3.16Å; C274-C283 CovalentContact SG-SG 2.04Å; C274-C283 PolarHBondContact SG-SG 3.36Å; T279-C283 CarbonylContact O-C 3.39Å; T279-C283 WeakPolarHBondContact O-CA 3.02Å; G280-C283 PolarHBondContact O-N 3.28Å; C283-Q285 VanDerWaalsContact C-N 3.35Å
284	N	89.6	Confident	83.5	Confident	81 Å²	81	57.8 Å²	57.8	43%	0.433	31%	0.306	S	S	.	.			trans	-80.3	-14	179.5	-84.3	-37.1	0	0	0	114.3	N254 D282	N254-N284 WeakPolarHBondContact CB-OD1 3.47Å; N254-N284 VanDerWaalsContact CG-OD1 3.32Å; N254-N284 PolarHBondContact ND2-OD1 2.69Å; D282-N284 VanDerWaalsContact CG-ND2 3.29Å; D282-N284 PolarHBondContact O-N 3.33Å; D282-N284 WeakPolarHBondContact OD1-CB 3.49Å; D282-N284 PolarHBondContact OD1-N 3.39Å; D282-N284 PolarHBondContact OD2-ND2 2.8Å
285	Q	86.5	Confident	81.9	Confident	116 Å²	116	60.7 Å²	60.7	54%	0.542	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	131.5	-173.6	-61.4	179	-2.6	0	0	109.9	Y278 T279 C283	Y278-Q285 CarbonylContact C-O 3.58Å; Y278-Q285 VanDerWaalsContact CA-O 3.26Å; Y278-Q285 WeakPolarHBondContact CA-O 3.07Å; T279-Q285 HydrophobicContact CG2-CB 3.97Å; T279-Q285 PolarHBondContact N-O 2.87Å; T279-Q285 WeakPolarHBondContact O-CB 3.17Å; T279-Q285 PolarHBondContact O-N 3.39Å; T279-Q285 VanDerWaalsContact O-N 3.17Å; C283-Q285 VanDerWaalsContact C-N 3.35Å
286	P	84.5	Confident	80	Confident	85 Å²	85	62.4 Å²	62.4	55%	0.552	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.9	141.1	167	-21	32.9	0	0	0	110.2	G277 D288	G277-P286 CarbonylContact O-C 3.25Å; G277-P286 WeakPolarHBondContact O-CA 3.48Å; P286-D288 PolarHBondContact O-N 3.43Å
287	F	85.4	Confident	78.2	Confident	2 Å²	2	64.6 Å²	64.6	1%	0.009	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-64	127.1	174.1	179.6	-98.6	0	0	0	109.8	G277 A289 T294 L296 N328 L331	G277-F287 PolarHBondContact O-N 3.16Å; F287-A289 HydrophobicContact CE1-CB 3.73Å; F287-A289 HydrophobicContact CZ-CB 4.35Å; F287-T294 HydrophobicContact CZ-CG2 4.16Å; F287-L296 HydrophobicContact CD2-CD1 3.81Å; F287-L296 HydrophobicContact CE2-CD1 3.55Å; F287-L296 HydrophobicContact CZ-CD1 4.4Å; F287-N328 PolarHBondContact O-OD1 3.33Å; F287-N328 VanDerWaalsContact O-OD1 3.07Å; F287-L331 HydrophobicContact CB-CD2 4.11Å; F287-L331 HydrophobicContact CD1-CB 4.14Å; F287-L331 HydrophobicContact CD1-CD2 3.41Å; F287-L331 VanDerWaalsContact CD1-CD2 3.41Å; F287-L331 HydrophobicContact CD1-CG 4.39Å; F287-L331 HydrophobicContact CE1-CB 3.84Å; F287-L331 HydrophobicContact CE1-CD2 3.99Å; F287-L331 HydrophobicContact CG-CD2 3.84Å
288	D	86.1	Confident	76.7	Confident	41 Å²	41	67.3 Å²	67.3	22%	0.219	34%	0.339	C	S	.	.			trans	-120.8	106.9	175.8	-173.9	-17.8	0	0	0	109.1	P286 C290 I291 S292 P326	P286-D288 PolarHBondContact O-N 3.43Å; D288-C290 PolarHBondContact O-N 3.03Å; D288-C290 WeakPolarHBondContact OD1-CA 3.46Å; D288-C290 WeakPolarHBondContact OD1-CB 3.42Å; D288-C290 PolarHBondContact OD1-N 3.21Å; D288-I291 HydrophobicContact CB-CD1 4.18Å; D288-I291 HydrophobicContact CB-CG1 4.35Å; D288-I291 PolarHBondContact O-N 3.18Å; D288-I291 WeakPolarHBondContact OD2-CD1 3.03Å; D288-S292 WeakPolarHBondContact O-CB 3.02Å; D288-S292 PolarHBondContact O-N 3.09Å; D288-P326 WeakPolarHBondContact OD1-CB 3.48Å
289	A	85.9	Confident	74.7	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-16.3	179.9	0	0	0	0	0	113.2	F287 I291 T294 G310 T332 Y333	F287-A289 HydrophobicContact CE1-CB 3.73Å; F287-A289 HydrophobicContact CZ-CB 4.35Å; A289-I291 VanDerWaalsContact C-N 3.34Å; A289-T294 HydrophobicContact CB-CG2 4.42Å; A289-G310 PolarHBondContact O-N 3.15Å; A289-T332 WeakPolarHBondContact CB-O 3.37Å; A289-Y333 HydrophobicContact CB-CD1 3.99Å; A289-Y333 WeakPolarHBondContact O-CD1 3.31Å
290	C	89.3	Confident	73.1	Confident	1 Å²	1	71.6 Å²	71.6	1%	0.007	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-29.2	173.8	-66.1	0	0	0	0	112.1	D288 G310 Y311 C324 P326	D288-C290 PolarHBondContact O-N 3.03Å; D288-C290 WeakPolarHBondContact OD1-CA 3.46Å; D288-C290 WeakPolarHBondContact OD1-CB 3.42Å; D288-C290 PolarHBondContact OD1-N 3.21Å; C290-G310 PolarHBondContact O-N 3.42Å; C290-Y311 HydrophobicContact CB-CD1 4.26Å; C290-Y311 HydrophobicContact CB-CD2 4.5Å; C290-Y311 HydrophobicContact CB-CE1 4.07Å; C290-Y311 HydrophobicContact CB-CE2 4.34Å; C290-Y311 HydrophobicContact CB-CG 4.46Å; C290-Y311 WeakPolarHBondContact O-CB 3.36Å; C290-Y311 WeakPolarHBondContact O-CD2 3.24Å; C290-Y311 VanDerWaalsContact O-CG 3.28Å; C290-Y311 PolarHBondContact O-N 2.83Å; C290-C324 WeakPolarHBondContact CA-SG 3.42Å; C290-C324 HydrophobicContact CB-CB 3.84Å; C290-C324 WeakPolarHBondContact CB-SG 3.4Å; C290-C324 WeakPolarHBondContact SG-CB 3.5Å; C290-C324 CovalentContact SG-SG 2.03Å; C290-C324 PolarHBondContact SG-SG 3.46Å; C290-P326 VanDerWaalsContact SG-CD 3.57Å
291	I	84.9	Confident	71.6	Confident	105 Å²	105	77.5 Å²	77.5	54%	0.538	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	-44.4	-178.6	-56.4	172.5	0	0	0	111.1	D288 A289 Y311	D288-I291 HydrophobicContact CB-CD1 4.18Å; D288-I291 HydrophobicContact CB-CG1 4.35Å; D288-I291 PolarHBondContact O-N 3.18Å; D288-I291 WeakPolarHBondContact OD2-CD1 3.03Å; A289-I291 VanDerWaalsContact C-N 3.34Å; I291-Y311 HydrophobicContact CG1-CD2 4.33Å; I291-Y311 HydrophobicContact CG1-CE2 3.73Å
292	S	75.2	Confident	69.8	Low	32 Å²	32	72.9 Å²	72.9	22%	0.224	39%	0.388	C	S	.	.	S	Bend	trans	-92.1	134.4	-172	-58.5	0	0	0	0	111.3	D288 T294	D288-S292 WeakPolarHBondContact O-CB 3.02Å; D288-S292 PolarHBondContact O-N 3.09Å; S292-T294 PolarHBondContact O-N 3.31Å
293	D	67.5	Low	68.2	Low	64 Å²	64	76 Å²	76	34%	0.342	42%	0.42	S	S	.	.			trans	-61.7	133.8	166.6	-60.4	-39.9	0	0	0	109.1	I295 S309	D293-I295 HydrophobicContact CB-CD1 3.97Å; D293-I295 HydrophobicContact CB-CG1 3.88Å; D293-I295 PolarHBondContact O-N 3.49Å; D293-S309 WeakPolarHBondContact OD1-CB 3.47Å; D293-S309 PolarHBondContact OD1-N 3.2Å
294	T	59.2	Low	66.6	Low	22 Å²	22	79 Å²	79	14%	0.135	44%	0.441	C	S	.	.	S	Bend	trans	-79.4	54.2	-176.7	52.5	0	0	0	0	111.3	F287 A289 S292 L296 I307 L331	F287-T294 HydrophobicContact CZ-CG2 4.16Å; A289-T294 HydrophobicContact CB-CG2 4.42Å; S292-T294 PolarHBondContact O-N 3.31Å; T294-L296 PolarHBondContact O-N 3.47Å; T294-I307 WeakPolarHBondContact OG1-CB 3.22Å; T294-I307 VanDerWaalsContact OG1-CG2 3.23Å; T294-I307 WeakPolarHBondContact OG1-CG2 3.03Å; T294-I307 PolarHBondContact OG1-O 3.09Å; T294-L331 WeakPolarHBondContact CG2-O 3.37Å
295	I	53.6	Low	65.4	Low	92 Å²	92	78.6 Å²	78.6	47%	0.472	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-9.3	177.9	-55	175.8	0	0	0	111	D293 K297 M298	D293-I295 HydrophobicContact CB-CD1 3.97Å; D293-I295 HydrophobicContact CB-CG1 3.88Å; D293-I295 PolarHBondContact O-N 3.49Å; I295-K297 PolarHBondContact O-N 3.43Å; I295-M298 HydrophobicContact CG2-SD 4.08Å; I295-M298 PolarHBondContact O-N 3.18Å
296	L	49.7	Very low	64.7	Low	121 Å²	121	79.1 Å²	79.1	63%	0.634	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-0.5	-170.8	-72.8	170.2	0	0	0	116.1	F287 T294	F287-L296 HydrophobicContact CD2-CD1 3.81Å; F287-L296 HydrophobicContact CE2-CD1 3.55Å; F287-L296 HydrophobicContact CZ-CD1 4.4Å; T294-L296 PolarHBondContact O-N 3.47Å
297	K	44.8	Very low	64.5	Low	166 Å²	166	77.9 Å²	77.9	72%	0.722	43%	0.431	S	S	*	.	S	Bend	trans	-121.1	61.2	169	-72.8	-173.5	179.7	174.7	0	111.1	I295	I295-K297 PolarHBondContact O-N 3.43Å
298	M	48.3	Very low	64.5	Low	75 Å²	75	77.9 Å²	77.9	37%	0.369	43%	0.431	S	S	.	.			trans	-128.7	87.3	177	-65.9	-173.5	-178.9	0	0	110.4	I295 P300	I295-M298 HydrophobicContact CG2-SD 4.08Å; I295-M298 PolarHBondContact O-N 3.18Å; M298-P300 WeakPolarHBondContact O-CD 3.45Å
299	N	45.9	Very low	64.6	Low	97 Å²	97	76.7 Å²	76.7	52%	0.519	43%	0.426	S	S	.	.			trans	-57.2	122.3	147.3	-166.8	-4.2	0	0	0	105.6	L301 D302	N299-L301 PolarHBondContact O-N 3.5Å; N299-D302 PolarHBondContact O-N 3.44Å
300	P	50.2	Low	64.8	Low	129 Å²	129	76.7 Å²	76.7	84%	0.838	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-8.5	-175.7	19.8	-31.9	0	0	0	114.2	M298	M298-P300 WeakPolarHBondContact O-CD 3.45Å
301	L	52.8	Low	65	Low	149 Å²	149	81.3 Å²	81.3	78%	0.78	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-18.3	174	-78.4	144.5	0	0	0	114.3	N299 A303	N299-L301 PolarHBondContact O-N 3.5Å; L301-A303 PolarHBondContact O-N 3.26Å
302	D	49.1	Very low	65.3	Low	107 Å²	107	80.5 Å²	80.5	57%	0.572	44%	0.438	S	S	*	.			trans	-86.1	105.1	174.5	-87.3	-32.6	0	0	0	109	N299 S304	N299-D302 PolarHBondContact O-N 3.44Å; D302-S304 PolarHBondContact O-N 2.91Å
303	A	54.2	Low	66.1	Low	111 Å²	111	79 Å²	79	92%	0.917	43%	0.427	S	S	*	.			trans	-70.6	49.5	167.5	0	0	0	0	0	111	L301	L301-A303 PolarHBondContact O-N 3.26Å
304	S	55.2	Low	67.4	Low	63 Å²	63	76 Å²	76	44%	0.441	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-73.7	149.8	176.8	56.5	0	0	0	0	110.3	D302 Y306	D302-S304 PolarHBondContact O-N 2.91Å; S304-Y306 PolarHBondContact O-N 3.27Å
305	S	64.8	Low	68.9	Low	73 Å²	73	75 Å²	75	51%	0.51	41%	0.405	S	S	.	.	P	Polyproline II helix	trans	-61.3	133.2	178.9	-56.8	0	0	0	0	110.5	I307	S305-I307 PolarHBondContact O-N 3.28Å
306	Y	72.4	Confident	70.6	Confident	126 Å²	126	72 Å²	72	49%	0.494	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-56.6	124.3	169.1	171.8	-101.2	0	0	0	109.8	S304 P308	S304-Y306 PolarHBondContact O-N 3.27Å; Y306-P308 HydrophobicContact CE1-CB 3.76Å; Y306-P308 HydrophobicContact CE1-CG 4.36Å
307	I	79.9	Confident	72.3	Confident	60 Å²	60	72.9 Å²	72.9	31%	0.308	40%	0.396	S	S	.	.			trans	-111.3	110.7	174.7	-59.8	170.7	0	0	0	107	T294 S305 Y333	T294-I307 WeakPolarHBondContact OG1-CB 3.22Å; T294-I307 VanDerWaalsContact OG1-CG2 3.23Å; T294-I307 WeakPolarHBondContact OG1-CG2 3.03Å; T294-I307 PolarHBondContact OG1-O 3.09Å; S305-I307 PolarHBondContact O-N 3.28Å; I307-Y333 HydrophobicContact CG2-CE1 4.01Å; I307-Y333 WeakPolarHBondContact CG2-OH 3.4Å
308	P	86	Confident	74.2	Confident	2 Å²	2	72.2 Å²	72.2	1%	0.013	39%	0.393	C	S	.	.			trans	-69.9	171.6	-179.8	28.1	-31.8	0	0	0	111.7	Y306 E312 A313 Y333 Y349	Y306-P308 HydrophobicContact CE1-CB 3.76Å; Y306-P308 HydrophobicContact CE1-CG 4.36Å; P308-E312 HydrophobicContact CB-CB 4.27Å; P308-E312 HydrophobicContact CB-CG 4.28Å; P308-A313 HydrophobicContact CG-CB 4.16Å; P308-Y333 WeakPolarHBondContact O-CE1 3.32Å; P308-Y333 PolarHBondContact O-OH 3.21Å; P308-Y349 HydrophobicContact CG-CE1 4.43Å; P308-Y349 HydrophobicContact CG-CE2 4.03Å
309	S	88.8	Confident	76.1	Confident	16 Å²	16	70.3 Å²	70.3	11%	0.112	38%	0.384	C	S	.	.			trans	-53.4	145.9	168.6	69	0	0	0	0	111.8	D293 Y311 E312 A313	D293-S309 WeakPolarHBondContact OD1-CB 3.47Å; D293-S309 PolarHBondContact OD1-N 3.2Å; S309-Y311 PolarHBondContact O-N 3.41Å; S309-E312 PolarHBondContact O-N 3.08Å; S309-E312 VanDerWaalsContact O-N 3.07Å; S309-A313 PolarHBondContact O-N 3.45Å
310	G	90	Very high	78.1	Confident	0 Å²	0	70.9 Å²	70.9	0%	0	39%	0.394	C	S	.	.	H	α-helix	trans	-62.5	-27.9	-178.8	0	0	0	0	0	113.9	A289 C290 E312 C314 C324	A289-G310 PolarHBondContact O-N 3.15Å; C290-G310 PolarHBondContact O-N 3.42Å; G310-E312 VanDerWaalsContact C-N 3.34Å; G310-C314 WeakPolarHBondContact O-CB 3.33Å; G310-C314 PolarHBondContact O-N 3.13Å; G310-C314 PolarHBondContact O-SG 3.24Å; G310-C324 VanDerWaalsContact C-SG 3.57Å; G310-C324 VanDerWaalsContact CA-SG 3.54Å
311	Y	92.4	Very high	79.9	Confident	98 Å²	98	67.9 Å²	67.9	38%	0.384	37%	0.373	S	S	.	.	H	α-helix	trans	-66.3	-35.7	173.4	-74.4	-38.4	0	0	0	113.5	C290 I291 S309 G315 V316 C324	C290-Y311 HydrophobicContact CB-CD1 4.26Å; C290-Y311 HydrophobicContact CB-CD2 4.5Å; C290-Y311 HydrophobicContact CB-CE1 4.07Å; C290-Y311 HydrophobicContact CB-CE2 4.34Å; C290-Y311 HydrophobicContact CB-CG 4.46Å; C290-Y311 WeakPolarHBondContact O-CB 3.36Å; C290-Y311 WeakPolarHBondContact O-CD2 3.24Å; C290-Y311 VanDerWaalsContact O-CG 3.28Å; C290-Y311 PolarHBondContact O-N 2.83Å; I291-Y311 HydrophobicContact CG1-CD2 4.33Å; I291-Y311 HydrophobicContact CG1-CE2 3.73Å; S309-Y311 PolarHBondContact O-N 3.41Å; Y311-G315 PolarHBondContact O-N 2.8Å; Y311-V316 HydrophobicContact CD1-CB 3.97Å; Y311-V316 HydrophobicContact CD1-CG1 4.1Å; Y311-V316 HydrophobicContact CD1-CG2 3.89Å; Y311-V316 PolarHBondContact O-N 3.45Å; Y311-C324 HydrophobicContact CD1-CB 3.96Å; Y311-C324 HydrophobicContact CE1-CB 4.17Å
312	E	91.4	Very high	81.9	Confident	88 Å²	88	60.9 Å²	60.9	41%	0.411	34%	0.336	S	S	.	.	H	α-helix	trans	-72.2	-50.7	173	-175.8	178.9	176	0	0	110.6	P308 S309 G310 C314 G315	P308-E312 HydrophobicContact CB-CB 4.27Å; P308-E312 HydrophobicContact CB-CG 4.28Å; S309-E312 PolarHBondContact O-N 3.08Å; S309-E312 VanDerWaalsContact O-N 3.07Å; G310-E312 VanDerWaalsContact C-N 3.34Å; E312-C314 PolarHBondContact O-N 3.2Å; E312-G315 WeakPolarHBondContact O-CA 3.45Å; E312-G315 PolarHBondContact O-N 2.61Å
313	A	91.3	Very high	84	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-61.4	-45.4	-178.5	0	0	0	0	0	113.1	P308 S309 G315 Y333 Y349 N351 C352	P308-A313 HydrophobicContact CG-CB 4.16Å; S309-A313 PolarHBondContact O-N 3.45Å; A313-G315 PolarHBondContact O-N 3.43Å; A313-Y333 HydrophobicContact CB-CE2 3.56Å; A313-Y333 VanDerWaalsContact CB-CZ 3.5Å; A313-Y333 WeakPolarHBondContact CB-OH 2.99Å; A313-Y349 HydrophobicContact CB-CD2 4.02Å; A313-Y349 HydrophobicContact CB-CE2 3.95Å; A313-N351 VanDerWaalsContact O-CA 3.25Å; A313-N351 WeakPolarHBondContact O-CA 3.43Å; A313-N351 WeakPolarHBondContact O-CB 3.47Å; A313-C352 PolarHBondContact O-N 3.17Å
314	C	94.4	Very high	85.9	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	1.1	177.3	-53.9	0	0	0	0	112.4	G310 E312 V316 N322 C324 C335 C352	G310-C314 WeakPolarHBondContact O-CB 3.33Å; G310-C314 PolarHBondContact O-N 3.13Å; G310-C314 PolarHBondContact O-SG 3.24Å; E312-C314 PolarHBondContact O-N 3.2Å; C314-V316 HydrophobicContact CB-CG2 3.88Å; C314-V316 PolarHBondContact O-N 2.85Å; C314-N322 WeakPolarHBondContact O-CB 3.46Å; C314-N322 PolarHBondContact O-ND2 3.48Å; C314-N322 VanDerWaalsContact O-ND2 3.16Å; C314-C324 HydrophobicContact CB-CB 4.17Å; C314-C335 WeakPolarHBondContact CA-SG 3.35Å; C314-C335 HydrophobicContact CB-CB 3.68Å; C314-C335 WeakPolarHBondContact CB-SG 3.11Å; C314-C335 WeakPolarHBondContact SG-CA 3.42Å; C314-C335 WeakPolarHBondContact SG-CB 3.48Å; C314-C335 CovalentContact SG-SG 2.02Å; C314-C335 PolarHBondContact SG-SG 3.08Å; C314-C352 WeakPolarHBondContact O-CB 3.07Å
315	G	91.4	Very high	87.7	Confident	1 Å²	1	57.8 Å²	57.8	1%	0.01	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.2	29.7	178.8	0	0	0	0	0	113.3	Y311 E312 A313 L317 F318 N319	Y311-G315 PolarHBondContact O-N 2.8Å; E312-G315 WeakPolarHBondContact O-CA 3.45Å; E312-G315 PolarHBondContact O-N 2.61Å; A313-G315 PolarHBondContact O-N 3.43Å; G315-L317 PolarHBondContact O-N 3.26Å; G315-F318 PolarHBondContact O-N 2.88Å; G315-F318 VanDerWaalsContact O-N 3.11Å; G315-N319 PolarHBondContact O-N 2.72Å
316	V	90.5	Very high	88.8	Confident	29 Å²	29	57.1 Å²	57.1	18%	0.176	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-33.7	-178.5	-178	0	0	0	0	110.5	Y311 C314 N319 P320 N322 C324	Y311-V316 HydrophobicContact CD1-CB 3.97Å; Y311-V316 HydrophobicContact CD1-CG1 4.1Å; Y311-V316 HydrophobicContact CD1-CG2 3.89Å; Y311-V316 PolarHBondContact O-N 3.45Å; C314-V316 HydrophobicContact CB-CG2 3.88Å; C314-V316 PolarHBondContact O-N 2.85Å; V316-N319 CarbonylContact O-C 3.47Å; V316-P320 WeakPolarHBondContact O-CA 3.43Å; V316-N322 HydrophobicContact CG2-CB 4.48Å; V316-C324 HydrophobicContact CG2-CB 4.28Å
317	L	84.6	Confident	89.4	Confident	140 Å²	140	54.6 Å²	54.6	73%	0.733	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-33.8	175.5	-65	172.2	0	0	0	112.7	G315	G315-L317 PolarHBondContact O-N 3.26Å
318	F	84.8	Confident	89.2	Confident	153 Å²	153	54.9 Å²	54.9	67%	0.671	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-39.6	177.9	-61	-66.4	0	0	0	111.9	G315 L353	G315-F318 PolarHBondContact O-N 2.88Å; G315-F318 VanDerWaalsContact O-N 3.11Å; F318-L353 HydrophobicContact CD2-CD2 4.27Å; F318-L353 HydrophobicContact CE2-CD2 4.27Å
319	N	87.9	Confident	88.7	Confident	34 Å²	34	62.9 Å²	62.9	18%	0.182	33%	0.326	C	S	.	.			trans	-138.2	107	175.6	-168.6	-17.6	0	0	0	110.6	G315 V316 T321 N322 Y341	G315-N319 PolarHBondContact O-N 2.72Å; V316-N319 CarbonylContact O-C 3.47Å; N319-T321 PolarHBondContact ND2-OG1 3.41Å; N319-T321 PolarHBondContact O-N 3.25Å; N319-T321 WeakPolarHBondContact OD1-CB 3.31Å; N319-T321 PolarHBondContact OD1-N 2.88Å; N319-T321 VanDerWaalsContact OD1-N 3.13Å; N319-T321 PolarHBondContact OD1-OG1 3.27Å; N319-N322 WeakPolarHBondContact O-CB 3.43Å; N319-N322 PolarHBondContact O-N 2.93Å; N319-Y341 HydrophobicContact CB-CE2 3.99Å; N319-Y341 WeakPolarHBondContact ND2-CE2 3.31Å
320	P	87.1	Confident	88.2	Confident	110 Å²	110	67.8 Å²	67.8	71%	0.714	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-5.2	-176.5	28	-35.8	0	0	0	113.8	V316	V316-P320 WeakPolarHBondContact O-CA 3.43Å
321	T	89.5	Confident	87.7	Confident	66 Å²	66	69.7 Å²	69.7	41%	0.405	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-19.8	172.5	61.1	0	0	0	0	113.4	N319 N338	N319-T321 PolarHBondContact ND2-OG1 3.41Å; N319-T321 PolarHBondContact O-N 3.25Å; N319-T321 WeakPolarHBondContact OD1-CB 3.31Å; N319-T321 PolarHBondContact OD1-N 2.88Å; N319-T321 VanDerWaalsContact OD1-N 3.13Å; N319-T321 PolarHBondContact OD1-OG1 3.27Å; T321-N338 VanDerWaalsContact CB-ND2 3.34Å; T321-N338 WeakPolarHBondContact CB-ND2 3.37Å; T321-N338 VanDerWaalsContact OG1-CB 3.24Å; T321-N338 WeakPolarHBondContact OG1-CB 3.35Å; T321-N338 VanDerWaalsContact OG1-CG 3.28Å; T321-N338 PolarHBondContact OG1-ND2 3.47Å
322	N	93.7	Very high	87.4	Confident	2 Å²	2	67.3 Å²	67.3	1%	0.011	36%	0.355	C	S	.	.	S	Bend	trans	-69.3	147.4	166.5	-66	-21.1	0	0	0	108.8	C314 V316 N319 N338	C314-N322 WeakPolarHBondContact O-CB 3.46Å; C314-N322 PolarHBondContact O-ND2 3.48Å; C314-N322 VanDerWaalsContact O-ND2 3.16Å; V316-N322 HydrophobicContact CG2-CB 4.48Å; N319-N322 WeakPolarHBondContact O-CB 3.43Å; N319-N322 PolarHBondContact O-N 2.93Å; N322-N338 PolarHBondContact OD1-N 3.45Å
323	K	93.4	Very high	87.3	Confident	133 Å²	133	63.5 Å²	63.5	58%	0.578	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.4	140.1	178.3	-46.6	177.7	176.3	177.7	0	111.2	C335 T336	K323-C335 WeakPolarHBondContact O-CA 3.4Å; K323-T336 WeakPolarHBondContact CB-OG1 3.15Å; K323-T336 PolarHBondContact N-O 3.45Å; K323-T336 VanDerWaalsContact N-O 3.08Å; K323-T336 PolarHBondContact O-N 2.77Å
324	C	94	Very high	87.4	Confident	16 Å²	16	67 Å²	67	11%	0.108	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	130.9	167.9	-179.2	0	0	0	0	109.1	C290 G310 Y311 C314 V316	C290-C324 WeakPolarHBondContact CA-SG 3.42Å; C290-C324 HydrophobicContact CB-CB 3.84Å; C290-C324 WeakPolarHBondContact CB-SG 3.4Å; C290-C324 WeakPolarHBondContact SG-CB 3.5Å; C290-C324 CovalentContact SG-SG 2.03Å; C290-C324 PolarHBondContact SG-SG 3.46Å; G310-C324 VanDerWaalsContact C-SG 3.57Å; G310-C324 VanDerWaalsContact CA-SG 3.54Å; Y311-C324 HydrophobicContact CD1-CB 3.96Å; Y311-C324 HydrophobicContact CE1-CB 4.17Å; C314-C324 HydrophobicContact CB-CB 4.17Å; V316-C324 HydrophobicContact CG2-CB 4.28Å
325	N	92.4	Very high	87.4	Confident	67 Å²	67	67.5 Å²	67.5	36%	0.358	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	113.2	175.6	-55.3	-58.1	0	0	0	108.6	Y333 N334 T336	N325-Y333 CarbonylContact O-C 3.56Å; N325-Y333 WeakPolarHBondContact O-CA 3.24Å; N325-N334 PolarHBondContact N-O 3.45Å; N325-N334 PolarHBondContact ND2-O 2.94Å; N325-N334 PolarHBondContact O-N 3.43Å; N325-T336 WeakPolarHBondContact ND2-CG2 3.37Å
326	P	88.9	Confident	87.6	Confident	59 Å²	59	70.4 Å²	70.4	38%	0.383	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	136.7	-179.4	30.3	-32.8	0	0	0	110.6	D288 C290	D288-P326 WeakPolarHBondContact OD1-CB 3.48Å; C290-P326 VanDerWaalsContact SG-CD 3.57Å
327	M	85.8	Confident	87.8	Confident	72 Å²	72	71.4 Å²	71.4	36%	0.355	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	78.1	177.1	-57.1	-176.6	78.1	0	0	108.7	D329 M330 L331 T332 N334	M327-D329 VanDerWaalsContact C-N 3.26Å; M327-D329 PolarHBondContact O-N 2.97Å; M327-M330 HydrophobicContact CE-CE 3.18Å; M327-M330 PolarHBondContact O-N 3.39Å; M327-M330 VanDerWaalsContact O-N 3.1Å; M327-M330 HydrophobicContact SD-CE 4.07Å; M327-L331 PolarHBondContact O-N 3.3Å; M327-T332 CarbonylContact C-O 3.6Å; M327-T332 WeakPolarHBondContact CA-O 3.44Å; M327-T332 HydrophobicContact CB-CG2 3.94Å; M327-T332 WeakPolarHBondContact CB-O 3.29Å; M327-T332 HydrophobicContact CG-CG2 4.46Å; M327-T332 PolarHBondContact N-O 3.31Å; M327-T332 PolarHBondContact O-N 2.03Å; M327-T332 HydrophobicContact SD-CG2 4.04Å; M327-N334 HydrophobicContact SD-CB 4.02Å
328	N	74.8	Confident	88.1	Confident	66 Å²	66	67.4 Å²	67.4	35%	0.353	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-57.1	-36.9	-169.8	-62.4	-2.5	0	0	0	113	F287 M330 L331	F287-N328 PolarHBondContact O-OD1 3.33Å; F287-N328 VanDerWaalsContact O-OD1 3.07Å; N328-M330 VanDerWaalsContact C-N 3.32Å; N328-M330 PolarHBondContact O-N 2.85Å; N328-L331 WeakPolarHBondContact O-CD2 3.32Å; N328-L331 PolarHBondContact O-N 3.47Å
329	D	75.2	Confident	88.1	Confident	170 Å²	170	67.2 Å²	67.2	91%	0.909	37%	0.368	S	S	*	.	G	3₁₀ helix	trans	-64.7	-34.8	-179.3	-61.8	-29.1	0	0	0	113	M327	M327-D329 VanDerWaalsContact C-N 3.26Å; M327-D329 PolarHBondContact O-N 2.97Å
330	M	79.3	Confident	88	Confident	119 Å²	119	67.3 Å²	67.3	59%	0.586	38%	0.377	S	S	*	.	G	3₁₀ helix	trans	-98.3	-0.6	179.3	-73.4	-165.8	-72.2	0	0	112.9	M327 N328 T332	M327-M330 HydrophobicContact CE-CE 3.18Å; M327-M330 PolarHBondContact O-N 3.39Å; M327-M330 VanDerWaalsContact O-N 3.1Å; M327-M330 HydrophobicContact SD-CE 4.07Å; N328-M330 VanDerWaalsContact C-N 3.32Å; N328-M330 PolarHBondContact O-N 2.85Å; M330-T332 HydrophobicContact CB-CG2 3.73Å; M330-T332 PolarHBondContact O-N 3.05Å
331	L	78.3	Confident	88.2	Confident	40 Å²	40	64.6 Å²	64.6	21%	0.209	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.6	38.2	-175.1	-53.5	172.9	0	0	0	112.5	F287 T294 M327 N328	F287-L331 HydrophobicContact CB-CD2 4.11Å; F287-L331 HydrophobicContact CD1-CB 4.14Å; F287-L331 HydrophobicContact CD1-CD2 3.41Å; F287-L331 VanDerWaalsContact CD1-CD2 3.41Å; F287-L331 HydrophobicContact CD1-CG 4.39Å; F287-L331 HydrophobicContact CE1-CB 3.84Å; F287-L331 HydrophobicContact CE1-CD2 3.99Å; F287-L331 HydrophobicContact CG-CD2 3.84Å; T294-L331 WeakPolarHBondContact CG2-O 3.37Å; M327-L331 PolarHBondContact O-N 3.3Å; N328-L331 WeakPolarHBondContact O-CD2 3.32Å; N328-L331 PolarHBondContact O-N 3.47Å
332	T	85.9	Confident	88.3	Confident	48 Å²	48	63.3 Å²	63.3	29%	0.294	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	-176.9	-178.1	-168	0	0	0	0	110.2	A289 M327 M330	A289-T332 WeakPolarHBondContact CB-O 3.37Å; M327-T332 CarbonylContact C-O 3.6Å; M327-T332 WeakPolarHBondContact CA-O 3.44Å; M327-T332 HydrophobicContact CB-CG2 3.94Å; M327-T332 WeakPolarHBondContact CB-O 3.29Å; M327-T332 HydrophobicContact CG-CG2 4.46Å; M327-T332 PolarHBondContact N-O 3.31Å; M327-T332 PolarHBondContact O-N 2.03Å; M327-T332 HydrophobicContact SD-CG2 4.04Å; M330-T332 HydrophobicContact CB-CG2 3.73Å; M330-T332 PolarHBondContact O-N 3.05Å
333	Y	90	Very high	88.2	Confident	8 Å²	8	68.3 Å²	68.3	3%	0.031	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	166.2	177.7	56.2	-96.5	0	0	0	111.1	A289 I307 P308 A313 N325 D350	A289-Y333 HydrophobicContact CB-CD1 3.99Å; A289-Y333 WeakPolarHBondContact O-CD1 3.31Å; I307-Y333 HydrophobicContact CG2-CE1 4.01Å; I307-Y333 WeakPolarHBondContact CG2-OH 3.4Å; P308-Y333 WeakPolarHBondContact O-CE1 3.32Å; P308-Y333 PolarHBondContact O-OH 3.21Å; A313-Y333 HydrophobicContact CB-CE2 3.56Å; A313-Y333 VanDerWaalsContact CB-CZ 3.5Å; A313-Y333 WeakPolarHBondContact CB-OH 2.99Å; N325-Y333 CarbonylContact O-C 3.56Å; N325-Y333 WeakPolarHBondContact O-CA 3.24Å; Y333-D350 WeakPolarHBondContact CE2-O 3.38Å
334	N	93.5	Very high	88.2	Confident	74 Å²	74	64 Å²	64	40%	0.396	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	134.9	171.7	178.3	-15.4	0	0	0	109.3	N325 M327 D350	N325-N334 PolarHBondContact N-O 3.45Å; N325-N334 PolarHBondContact ND2-O 2.94Å; N325-N334 PolarHBondContact O-N 3.43Å; M327-N334 HydrophobicContact SD-CB 4.02Å; N334-D350 WeakPolarHBondContact CA-OD2 3.21Å; N334-D350 PolarHBondContact OD1-OD2 3.16Å
335	C	95.2	Very high	87.9	Confident	10 Å²	10	70.2 Å²	70.2	7%	0.068	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	130	-178.5	-58.1	0	0	0	0	111.9	C314 K323 D350 C352	C314-C335 WeakPolarHBondContact CA-SG 3.35Å; C314-C335 HydrophobicContact CB-CB 3.68Å; C314-C335 WeakPolarHBondContact CB-SG 3.11Å; C314-C335 WeakPolarHBondContact SG-CA 3.42Å; C314-C335 WeakPolarHBondContact SG-CB 3.48Å; C314-C335 CovalentContact SG-SG 2.02Å; C314-C335 PolarHBondContact SG-SG 3.08Å; K323-C335 WeakPolarHBondContact O-CA 3.4Å; C335-D350 PolarHBondContact N-OD2 2.9Å; C335-C352 VanDerWaalsContact CB-SG 3.55Å
336	T	95.6	Very high	87.6	Confident	63 Å²	63	71.5 Å²	71.5	39%	0.387	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	109.8	166.3	57.7	0	0	0	0	109.6	K323 N325	K323-T336 WeakPolarHBondContact CB-OG1 3.15Å; K323-T336 PolarHBondContact N-O 3.45Å; K323-T336 VanDerWaalsContact N-O 3.08Å; K323-T336 PolarHBondContact O-N 2.77Å; N325-T336 WeakPolarHBondContact ND2-CG2 3.37Å
337	C	93.6	Very high	87.7	Confident	49 Å²	49	71 Å²	71	33%	0.331	39%	0.386	S	S	.	.			trans	-79.4	141.2	-177.9	-46.5	0	0	0	0	111.5	Y341 C352	C337-Y341 VanDerWaalsContact CB-O 3.31Å; C337-Y341 WeakPolarHBondContact CB-O 3.26Å; C337-C352 WeakPolarHBondContact CA-SG 3.47Å; C337-C352 HydrophobicContact CB-CB 3.75Å; C337-C352 WeakPolarHBondContact CB-SG 3.34Å; C337-C352 PolarHBondContact N-SG 3.12Å; C337-C352 VanDerWaalsContact SG-CA 3.53Å; C337-C352 WeakPolarHBondContact SG-CB 3.44Å; C337-C352 CovalentContact SG-SG 2.03Å; C337-C352 PolarHBondContact SG-SG 3.49Å
338	N	91.9	Very high	87.7	Confident	57 Å²	57	72.2 Å²	72.2	31%	0.305	40%	0.4	S	S	.	.			trans	-76.2	169.2	171	-172.6	27.7	0	0	0	111.5	T321 N322 G340 Y341	T321-N338 VanDerWaalsContact CB-ND2 3.34Å; T321-N338 WeakPolarHBondContact CB-ND2 3.37Å; T321-N338 VanDerWaalsContact OG1-CB 3.24Å; T321-N338 WeakPolarHBondContact OG1-CB 3.35Å; T321-N338 VanDerWaalsContact OG1-CG 3.28Å; T321-N338 PolarHBondContact OG1-ND2 3.47Å; N322-N338 PolarHBondContact OD1-N 3.45Å; N338-G340 PolarHBondContact O-N 3.25Å; N338-Y341 PolarHBondContact O-N 2.92Å
339	I	84.1	Confident	88.4	Confident	148 Å²	148	71 Å²	71	76%	0.759	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50	-27.8	-172.9	-62.8	171.7	0	0	0	114.4	K356	I339-K356 WeakPolarHBondContact O-CD 2.98Å
340	G	86.3	Confident	89.1	Confident	36 Å²	36	64.6 Å²	64.6	37%	0.371	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	1.3	179.1	0	0	0	0	0	115.9	N338 K356	N338-G340 PolarHBondContact O-N 3.25Å; G340-K356 PolarHBondContact O-N 3.15Å
341	Y	91.3	Very high	89.8	Confident	53 Å²	53	58.9 Å²	58.9	21%	0.208	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	152.8	-175.7	-71.2	-94.9	0	0	0	110.8	N319 C337 N338 C352 K354 Q355	N319-Y341 HydrophobicContact CB-CE2 3.99Å; N319-Y341 WeakPolarHBondContact ND2-CE2 3.31Å; C337-Y341 VanDerWaalsContact CB-O 3.31Å; C337-Y341 WeakPolarHBondContact CB-O 3.26Å; N338-Y341 PolarHBondContact O-N 2.92Å; Y341-C352 WeakPolarHBondContact CD1-O 2.99Å; Y341-K354 CarbonylContact C-O 3.55Å; Y341-K354 WeakPolarHBondContact CA-O 3.34Å; Y341-Q355 HydrophobicContact CD1-CG 4.23Å; Y341-Q355 HydrophobicContact CE1-CG 3.74Å
342	T	91	Very high	90.6	Very high	39 Å²	39	57 Å²	57	24%	0.239	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	173.1	176.3	-167.6	0	0	0	0	109.7	D344 C352 K354 D360	T342-D344 PolarHBondContact O-N 3.05Å; T342-C352 CarbonylContact O-C 3.46Å; T342-C352 WeakPolarHBondContact O-CA 3.45Å; T342-K354 HydrophobicContact CG2-CB 3.89Å; T342-K354 HydrophobicContact CG2-CD 3.73Å; T342-K354 HydrophobicContact CG2-CG 3.86Å; T342-K354 PolarHBondContact N-O 3.22Å; T342-K354 PolarHBondContact O-N 3.33Å; T342-D360 WeakPolarHBondContact CG2-OD2 3.3Å
343	R	92.5	Very high	90.9	Very high	108 Å²	108	57.6 Å²	57.6	41%	0.408	32%	0.319	S	S	.	.			trans	-70.7	128	177.2	-167.9	-179.2	-156.6	-132.6	-11.1	110.3	L345 D350 N351	R343-L345 HydrophobicContact CG-CD2 4.49Å; R343-L345 PolarHBondContact O-N 2.94Å; R343-D350 WeakPolarHBondContact CD-OD1 3.42Å; R343-D350 IonicContact CZ-OD1 2.97Å; R343-D350 IonicContact NE-OD1 3.75Å; R343-D350 PolarHBondContact NE-OD1 2.66Å; R343-D350 IonicContact NH2-OD1 2.77Å; R343-N351 WeakPolarHBondContact CA-O 3.12Å
344	D	91.8	Very high	90.9	Very high	43 Å²	43	60 Å²	60	23%	0.23	33%	0.33	C	S	.	.			trans	-78.9	110.6	167.3	-167.8	-19.7	0	0	0	109.2	T342 S346 L347 N351 K354	T342-D344 PolarHBondContact O-N 3.05Å; D344-S346 PolarHBondContact O-N 3.13Å; D344-S346 VanDerWaalsContact OD1-CB 3.28Å; D344-S346 WeakPolarHBondContact OD1-CB 3.33Å; D344-S346 PolarHBondContact OD1-N 3.14Å; D344-S346 PolarHBondContact OD1-OG 2.98Å; D344-S346 PolarHBondContact OD2-OG 3.15Å; D344-L347 HydrophobicContact CB-CD1 4.29Å; D344-L347 PolarHBondContact O-N 2.77Å; D344-N351 VanDerWaalsContact CB-OD1 3.27Å; D344-N351 WeakPolarHBondContact CB-OD1 3.43Å; D344-N351 PolarHBondContact N-OD1 3.22Å; D344-N351 PolarHBondContact O-ND2 2.8Å; D344-K354 HydrophobicContact CB-CB 3.91Å
345	L	87.8	Confident	90.7	Very high	146 Å²	146	61.5 Å²	61.5	76%	0.764	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-9.9	-179.3	-62.5	177.9	0	0	0	113.2	R343 L347	R343-L345 HydrophobicContact CG-CD2 4.49Å; R343-L345 PolarHBondContact O-N 2.94Å; L345-L347 PolarHBondContact O-N 2.99Å
346	S	87.9	Confident	90.3	Very high	93 Å²	93	65.5 Å²	65.5	65%	0.65	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-18.8	174.2	71.4	0	0	0	0	112.6	D344	D344-S346 PolarHBondContact O-N 3.13Å; D344-S346 VanDerWaalsContact OD1-CB 3.28Å; D344-S346 WeakPolarHBondContact OD1-CB 3.33Å; D344-S346 PolarHBondContact OD1-N 3.14Å; D344-S346 PolarHBondContact OD1-OG 2.98Å; D344-S346 PolarHBondContact OD2-OG 3.15Å
347	L	89.8	Confident	89.8	Confident	50 Å²	50	63.6 Å²	63.6	26%	0.262	34%	0.338	S	S	.	.	S	Bend	trans	-98.9	139	-179.7	-61.4	172.9	0	0	0	111	D344 L345 Y349 L353	D344-L347 HydrophobicContact CB-CD1 4.29Å; D344-L347 PolarHBondContact O-N 2.77Å; L345-L347 PolarHBondContact O-N 2.99Å; L347-Y349 HydrophobicContact CB-CE1 4.25Å; L347-Y349 HydrophobicContact CB-CE2 4.36Å; L347-Y349 HydrophobicContact CD1-CE2 4.1Å; L347-Y349 HydrophobicContact CD2-CE1 4.47Å; L347-Y349 PolarHBondContact O-N 2.79Å; L347-L353 HydrophobicContact CD1-CD1 3.77Å
348	P	87.1	Confident	89.5	Confident	97 Å²	97	66 Å²	66	63%	0.63	34%	0.343	S	S	*	.	S	Bend	trans	-77.1	0	-174.5	31.9	-35.9	0	0	0	114.1
349	Y	87.6	Confident	89.3	Confident	39 Å²	39	64.5 Å²	64.5	15%	0.153	34%	0.337	C	S	.	.	S	Bend	trans	-122.3	158.6	-177.1	53.1	-99.1	0	0	0	111.5	P308 A313 L347 N351	P308-Y349 HydrophobicContact CG-CE1 4.43Å; P308-Y349 HydrophobicContact CG-CE2 4.03Å; A313-Y349 HydrophobicContact CB-CD2 4.02Å; A313-Y349 HydrophobicContact CB-CE2 3.95Å; L347-Y349 HydrophobicContact CB-CE1 4.25Å; L347-Y349 HydrophobicContact CB-CE2 4.36Å; L347-Y349 HydrophobicContact CD1-CE2 4.1Å; L347-Y349 HydrophobicContact CD2-CE1 4.47Å; L347-Y349 PolarHBondContact O-N 2.79Å; Y349-N351 HydrophobicContact CD2-CB 4.12Å; Y349-N351 HydrophobicContact CE2-CB 4.08Å; Y349-N351 PolarHBondContact O-ND2 3.2Å
350	D	91.8	Very high	89.2	Confident	36 Å²	36	60.3 Å²	60.3	19%	0.193	32%	0.315	C	S	.	.			trans	-66.8	136.1	176.9	-162.8	32.5	0	0	0	111.9	Y333 N334 C335 R343	Y333-D350 WeakPolarHBondContact CE2-O 3.38Å; N334-D350 WeakPolarHBondContact CA-OD2 3.21Å; N334-D350 PolarHBondContact OD1-OD2 3.16Å; C335-D350 PolarHBondContact N-OD2 2.9Å; R343-D350 WeakPolarHBondContact CD-OD1 3.42Å; R343-D350 IonicContact CZ-OD1 2.97Å; R343-D350 IonicContact NE-OD1 3.75Å; R343-D350 PolarHBondContact NE-OD1 2.66Å; R343-D350 IonicContact NH2-OD1 2.77Å
351	N	93.6	Very high	89.1	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	33%	0.326	C	S	.	.			trans	-161.1	168.9	-169.2	72.2	77	0	0	0	111.3	A313 R343 D344 Y349 L353	A313-N351 VanDerWaalsContact O-CA 3.25Å; A313-N351 WeakPolarHBondContact O-CA 3.43Å; A313-N351 WeakPolarHBondContact O-CB 3.47Å; R343-N351 WeakPolarHBondContact CA-O 3.12Å; D344-N351 VanDerWaalsContact CB-OD1 3.27Å; D344-N351 WeakPolarHBondContact CB-OD1 3.43Å; D344-N351 PolarHBondContact N-OD1 3.22Å; D344-N351 PolarHBondContact O-ND2 2.8Å; Y349-N351 HydrophobicContact CD2-CB 4.12Å; Y349-N351 HydrophobicContact CE2-CB 4.08Å; Y349-N351 PolarHBondContact O-ND2 3.2Å; N351-L353 HydrophobicContact CB-CD1 4.36Å; N351-L353 HydrophobicContact CB-CG 4.23Å; N351-L353 PolarHBondContact OD1-N 3.27Å
352	C	95.3	Very high	88.8	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	33%	0.326	C	S	.	.			trans	-132.7	41.4	172	-63.8	0	0	0	0	111.1	A313 C314 C335 C337 Y341 T342	A313-C352 PolarHBondContact O-N 3.17Å; C314-C352 WeakPolarHBondContact O-CB 3.07Å; C335-C352 VanDerWaalsContact CB-SG 3.55Å; C337-C352 WeakPolarHBondContact CA-SG 3.47Å; C337-C352 HydrophobicContact CB-CB 3.75Å; C337-C352 WeakPolarHBondContact CB-SG 3.34Å; C337-C352 PolarHBondContact N-SG 3.12Å; C337-C352 VanDerWaalsContact SG-CA 3.53Å; C337-C352 WeakPolarHBondContact SG-CB 3.44Å; C337-C352 CovalentContact SG-SG 2.03Å; C337-C352 PolarHBondContact SG-SG 3.49Å; Y341-C352 WeakPolarHBondContact CD1-O 2.99Å; T342-C352 CarbonylContact O-C 3.46Å; T342-C352 WeakPolarHBondContact O-CA 3.45Å
353	L	92.3	Very high	88.7	Confident	60 Å²	60	66 Å²	66	31%	0.314	34%	0.341	S	S	.	.			trans	-89.7	-20.6	-171.9	-63.4	174.8	0	0	0	113.2	F318 L347 N351	F318-L353 HydrophobicContact CD2-CD2 4.27Å; F318-L353 HydrophobicContact CE2-CD2 4.27Å; L347-L353 HydrophobicContact CD1-CD1 3.77Å; N351-L353 HydrophobicContact CB-CD1 4.36Å; N351-L353 HydrophobicContact CB-CG 4.23Å; N351-L353 PolarHBondContact OD1-N 3.27Å
354	K	89.5	Confident	88.6	Confident	59 Å²	59	61.9 Å²	61.9	26%	0.257	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	125.5	175.3	-175.8	-177.1	175.9	-155.5	0	109.6	Y341 T342 D344 D357 D360	Y341-K354 CarbonylContact C-O 3.55Å; Y341-K354 WeakPolarHBondContact CA-O 3.34Å; T342-K354 HydrophobicContact CG2-CB 3.89Å; T342-K354 HydrophobicContact CG2-CD 3.73Å; T342-K354 HydrophobicContact CG2-CG 3.86Å; T342-K354 PolarHBondContact N-O 3.22Å; T342-K354 PolarHBondContact O-N 3.33Å; D344-K354 HydrophobicContact CB-CB 3.91Å; K354-D357 WeakPolarHBondContact CE-OD2 3.22Å; K354-D357 IonicContact NZ-OD1 2.65Å; K354-D357 IonicContact NZ-OD2 3.31Å; K354-D357 PolarHBondContact NZ-OD2 2.79Å; K354-D360 IonicContact NZ-OD1 2.75Å; K354-D360 PolarHBondContact NZ-OD1 3.5Å; K354-D360 IonicContact NZ-OD2 3.76Å
355	Q	88.2	Confident	88.4	Confident	105 Å²	105	64.7 Å²	64.7	49%	0.491	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	134.5	168.2	-73.6	-175.5	30.6	0	0	109.5	Y341 D357 L375	Y341-Q355 HydrophobicContact CD1-CG 4.23Å; Y341-Q355 HydrophobicContact CE1-CG 3.74Å; Q355-D357 PolarHBondContact O-N 3.04Å; Q355-L375 HydrophobicContact CB-CD1 3.87Å; Q355-L375 VanDerWaalsContact OE1-CD1 3.26Å
356	K	86.6	Confident	88.4	Confident	95 Å²	95	62.9 Å²	62.9	41%	0.413	33%	0.327	S	S	.	.	P	Polyproline II helix	trans	-67.2	119.4	-178.2	-169.6	175.2	-174.6	171	0	109.5	I339 G340 D360	I339-K356 WeakPolarHBondContact O-CD 2.98Å; G340-K356 PolarHBondContact O-N 3.15Å; K356-D360 VanDerWaalsContact CA-OD2 3.26Å; K356-D360 WeakPolarHBondContact CA-OD2 3.5Å; K356-D360 HydrophobicContact CG-CB 4.14Å; K356-D360 WeakPolarHBondContact CG-OD2 3.19Å
357	D	86.7	Confident	88.5	Confident	23 Å²	23	59.2 Å²	59.2	12%	0.123	30%	0.304	C	S	.	.			trans	-107.6	179	-178.9	67.2	33.5	0	0	0	110.6	K354 Q355 C359 D360 L375	K354-D357 WeakPolarHBondContact CE-OD2 3.22Å; K354-D357 IonicContact NZ-OD1 2.65Å; K354-D357 IonicContact NZ-OD2 3.31Å; K354-D357 PolarHBondContact NZ-OD2 2.79Å; Q355-D357 PolarHBondContact O-N 3.04Å; D357-C359 VanDerWaalsContact C-N 3.3Å; D357-C359 VanDerWaalsContact OD1-CA 3.24Å; D357-C359 WeakPolarHBondContact OD1-CA 3.02Å; D357-C359 WeakPolarHBondContact OD1-CB 3.12Å; D357-C359 PolarHBondContact OD1-N 2.96Å; D357-D360 PolarHBondContact N-OD2 2.92Å; D357-D360 PolarHBondContact O-N 3.02Å; D357-D360 PolarHBondContact OD1-N 3.45Å; D357-L375 HydrophobicContact CB-CB 4.35Å; D357-L375 HydrophobicContact CB-CD2 3.87Å
358	K	86.2	Confident	88.6	Confident	100 Å²	100	64 Å²	64	44%	0.435	33%	0.325	S	S	.	.	S	Bend	trans	-70.6	-26.7	176.2	-79.1	-61.2	-174.8	-179.9	0	113.5	D360 T361 H362 T376 S378	K358-D360 PolarHBondContact O-N 2.79Å; K358-T361 CarbonylContact O-C 3.49Å; K358-T361 PolarHBondContact O-N 3.03Å; K358-T361 PolarHBondContact O-OG1 3Å; K358-T361 VanDerWaalsContact O-OG1 3.06Å; K358-H362 VanDerWaalsContact O-CB 3.24Å; K358-H362 WeakPolarHBondContact O-CB 3.38Å; K358-H362 PolarHBondContact O-N 2.84Å; K358-T376 WeakPolarHBondContact CE-O 3.16Å; K358-T376 VanDerWaalsContact CG-C 3.44Å; K358-T376 VanDerWaalsContact CG-O 3.23Å; K358-T376 WeakPolarHBondContact CG-O 3.23Å; K358-S378 WeakPolarHBondContact CB-OG 3.4Å
359	C	87.3	Confident	88.7	Confident	25 Å²	25	61.5 Å²	61.5	17%	0.169	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-26	176.7	-74.5	0	0	0	0	112.9	D357 T361 H362 C369 I370 S378	D357-C359 VanDerWaalsContact C-N 3.3Å; D357-C359 VanDerWaalsContact OD1-CA 3.24Å; D357-C359 WeakPolarHBondContact OD1-CA 3.02Å; D357-C359 WeakPolarHBondContact OD1-CB 3.12Å; D357-C359 PolarHBondContact OD1-N 2.96Å; C359-T361 PolarHBondContact O-N 2.66Å; C359-T361 VanDerWaalsContact O-N 3.1Å; C359-H362 PolarHBondContact O-N 3.03Å; C359-C369 WeakPolarHBondContact CA-SG 3.49Å; C359-C369 HydrophobicContact CB-CB 3.68Å; C359-C369 WeakPolarHBondContact CB-SG 3.22Å; C359-C369 WeakPolarHBondContact SG-CB 3.39Å; C359-C369 PolarHBondContact SG-O 3.3Å; C359-C369 CovalentContact SG-SG 2.04Å; C359-C369 PolarHBondContact SG-SG 3.29Å; C359-I370 VanDerWaalsContact SG-C 3.51Å; C359-S378 VanDerWaalsContact SG-CB 3.56Å
360	D	83.6	Confident	88.9	Confident	59 Å²	59	63.6 Å²	63.6	32%	0.316	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-13.4	172.6	-61.4	-45.3	0	0	0	113.6	T342 K354 K356 D357 K358	T342-D360 WeakPolarHBondContact CG2-OD2 3.3Å; K354-D360 IonicContact NZ-OD1 2.75Å; K354-D360 PolarHBondContact NZ-OD1 3.5Å; K354-D360 IonicContact NZ-OD2 3.76Å; K356-D360 VanDerWaalsContact CA-OD2 3.26Å; K356-D360 WeakPolarHBondContact CA-OD2 3.5Å; K356-D360 HydrophobicContact CG-CB 4.14Å; K356-D360 WeakPolarHBondContact CG-OD2 3.19Å; D357-D360 PolarHBondContact N-OD2 2.92Å; D357-D360 PolarHBondContact O-N 3.02Å; D357-D360 PolarHBondContact OD1-N 3.45Å; K358-D360 PolarHBondContact O-N 2.79Å
361	T	82.5	Confident	88.7	Confident	98 Å²	98	63.4 Å²	63.4	60%	0.601	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.3	-6.1	177.9	57.6	0	0	0	0	114	K358 C359	K358-T361 CarbonylContact O-C 3.49Å; K358-T361 PolarHBondContact O-N 3.03Å; K358-T361 PolarHBondContact O-OG1 3Å; K358-T361 VanDerWaalsContact O-OG1 3.06Å; C359-T361 PolarHBondContact O-N 2.66Å; C359-T361 VanDerWaalsContact O-N 3.1Å
362	H	85.9	Confident	88.5	Confident	43 Å²	43	63.7 Å²	63.7	20%	0.199	33%	0.326	C	S	.	.			trans	-109.1	117.2	-175.6	-164.5	83.9	0	0	0	109.3	K358 C359 S378 E389	K358-H362 VanDerWaalsContact O-CB 3.24Å; K358-H362 WeakPolarHBondContact O-CB 3.38Å; K358-H362 PolarHBondContact O-N 2.84Å; C359-H362 PolarHBondContact O-N 3.03Å; H362-S378 WeakPolarHBondContact CB-OG 3.45Å; H362-S378 VanDerWaalsContact CG-OG 3.26Å; H362-E389 IonicContact CE1-OE1 3.69Å
363	L	88.4	Confident	87.9	Confident	107 Å²	107	73.7 Å²	73.7	56%	0.56	37%	0.37	S	S	*	.			trans	-91.1	124.1	-172.9	-178.3	70	0	0	0	110.8	L365 K390	L363-L365 HydrophobicContact CD2-CD2 4.04Å; L363-L365 HydrophobicContact CD2-CG 4.42Å; L363-L365 HydrophobicContact CG-CD2 4.37Å; L363-K390 WeakPolarHBondContact O-CB 3.29Å; L363-K390 WeakPolarHBondContact O-CG 3.43Å
364	C	90.2	Very high	87.6	Confident	22 Å²	22	77.1 Å²	77.1	15%	0.149	39%	0.388	C	S	.	.			trans	-109.6	123.6	165.7	-50.9	0	0	0	0	107.8	G367 C369 C380	C364-G367 WeakPolarHBondContact CB-O 3.43Å; C364-C369 VanDerWaalsContact SG-CB 3.54Å; C364-C380 VanDerWaalsContact CA-SG 3.54Å; C364-C380 HydrophobicContact CB-CB 3.78Å; C364-C380 WeakPolarHBondContact CB-SG 3.25Å; C364-C380 WeakPolarHBondContact SG-CA 3.31Å; C364-C380 WeakPolarHBondContact SG-CB 3.04Å; C364-C380 CovalentContact SG-SG 2.03Å; C364-C380 PolarHBondContact SG-SG 2.83Å
365	L	89	Confident	87.3	Confident	101 Å²	101	77.1 Å²	77.1	53%	0.529	39%	0.391	S	S	.	.	S	Bend	trans	-84.2	-47.4	-176	-74.8	172.9	0	0	0	112.5	L363 K390 D392	L363-L365 HydrophobicContact CD2-CD2 4.04Å; L363-L365 HydrophobicContact CD2-CG 4.42Å; L363-L365 HydrophobicContact CG-CD2 4.37Å; L365-K390 PolarHBondContact N-O 2.97Å; L365-D392 HydrophobicContact CD1-CB 3.89Å
366	Y	87.3	Confident	87.1	Confident	108 Å²	108	76.5 Å²	76.5	42%	0.424	39%	0.394	S	S	.	.	S	Bend	trans	-126.4	63.3	-179.4	-57.4	-72.6	0	0	0	109.8	E383 Y386 C391	Y366-E383 PolarHBondContact O-N 3.13Å; Y366-Y386 HydrophobicContact CD1-CE1 4.38Å; Y366-Y386 HydrophobicContact CD1-CE2 4.49Å; Y366-Y386 AromaticContact CD2-CD1 3.54Å; Y366-Y386 HydrophobicContact CD2-CD1 3.54Å; Y366-Y386 AromaticContact CD2-CE1 3.37Å; Y366-Y386 HydrophobicContact CD2-CE1 3.37Å; Y366-Y386 HydrophobicContact CD2-CG 4.27Å; Y366-Y386 AromaticContact CD2-CZ 4Å; Y366-Y386 HydrophobicContact CE2-CD1 4.32Å; Y366-Y386 AromaticContact CE2-CE1 3.76Å; Y366-Y386 HydrophobicContact CE2-CE1 3.76Å; Y366-Y386 AromaticContact CG-CD1 3.87Å; Y366-Y386 HydrophobicContact CG-CD1 3.87Å; Y366-Y386 HydrophobicContact CG-CD2 4.34Å; Y366-Y386 AromaticContact CG-CE1 3.73Å; Y366-Y386 HydrophobicContact CG-CE1 3.73Å; Y366-Y386 HydrophobicContact CG-CE2 4.21Å; Y366-Y386 HydrophobicContact CG-CG 4.17Å; Y366-Y386 AromaticContact CG-CZ 3.91Å; Y366-C391 WeakPolarHBondContact CD2-O 3.41Å; Y366-C391 VanDerWaalsContact O-CB 3.32Å; Y366-C391 WeakPolarHBondContact O-CB 3.11Å
367	G	89.1	Confident	87.1	Confident	17 Å²	17	78.9 Å²	78.9	18%	0.175	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	174.1	166.9	-176.3	0	0	0	0	0	113	C364 D381	C364-G367 WeakPolarHBondContact CB-O 3.43Å; G367-D381 CarbonylContact C-O 3.58Å; G367-D381 WeakPolarHBondContact CA-O 3.38Å
368	E	91.7	Very high	87.2	Confident	150 Å²	150	79 Å²	79	70%	0.701	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.7	137	176.4	-66.8	-167.1	162.9	0	0	110.7	D381	E368-D381 PolarHBondContact N-O 3.33Å; E368-D381 PolarHBondContact O-N 2.71Å
369	C	90.9	Very high	87.4	Confident	44 Å²	44	78.2 Å²	78.2	30%	0.297	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	125.3	175.1	-169.9	0	0	0	0	110.8	C359 C364	C359-C369 WeakPolarHBondContact CA-SG 3.49Å; C359-C369 HydrophobicContact CB-CB 3.68Å; C359-C369 WeakPolarHBondContact CB-SG 3.22Å; C359-C369 WeakPolarHBondContact SG-CB 3.39Å; C359-C369 PolarHBondContact SG-O 3.3Å; C359-C369 CovalentContact SG-SG 2.04Å; C359-C369 PolarHBondContact SG-SG 3.29Å; C364-C369 VanDerWaalsContact SG-CB 3.54Å
370	I	90.3	Very high	87.6	Confident	83 Å²	83	77.8 Å²	77.8	43%	0.426	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	120.8	176.5	-54.9	-179.3	0	0	0	108.9	C359 S378 V379 D381	C359-I370 VanDerWaalsContact SG-C 3.51Å; I370-S378 CarbonylContact O-C 3.27Å; I370-S378 VanDerWaalsContact O-CA 3.23Å; I370-S378 WeakPolarHBondContact O-CA 3.42Å; I370-V379 HydrophobicContact CB-CG1 4.26Å; I370-V379 PolarHBondContact N-O 3.23Å; I370-V379 PolarHBondContact O-N 3.14Å; I370-D381 HydrophobicContact CD1-CB 3.64Å; I370-D381 HydrophobicContact CG1-CB 4.18Å
371	S	88.6	Confident	88	Confident	32 Å²	32	79.7 Å²	79.7	22%	0.224	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	155.7	174.3	-161.7	0	0	0	0	112.4	Y377	S371-Y377 WeakPolarHBondContact CA-O 3.41Å; S371-Y377 PolarHBondContact OG-O 3.34Å
372	S	88.1	Confident	88.3	Confident	7 Å²	7	76.9 Å²	76.9	5%	0.049	40%	0.399	C	S	.	.			trans	-71.9	160.6	177.1	73.9	0	0	0	0	113.9	D374 L375 T376 Y377	S372-D374 PolarHBondContact O-N 3.03Å; S372-L375 PolarHBondContact O-N 3.43Å; S372-L375 PolarHBondContact OG-N 2.85Å; S372-L375 VanDerWaalsContact OG-N 3.14Å; S372-T376 PolarHBondContact OG-N 2.85Å; S372-T376 VanDerWaalsContact OG-N 3.1Å; S372-Y377 PolarHBondContact N-O 3.2Å; S372-Y377 WeakPolarHBondContact OG-CD1 3.29Å; S372-Y377 PolarHBondContact OG-N 2.9Å
373	K	84.7	Confident	88.4	Confident	210 Å²	210	80.2 Å²	80.2	91%	0.913	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-32.5	174	-70.2	-175.2	177.2	-179	0	113.4	L375	K373-L375 VanDerWaalsContact C-N 3.32Å
374	D	85.9	Confident	88.1	Confident	131 Å²	131	84.4 Å²	84.4	70%	0.701	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	2.5	177.8	-58	-40.3	0	0	0	112.7	S372 T376	S372-D374 PolarHBondContact O-N 3.03Å; D374-T376 HydrophobicContact CB-CG2 4.38Å; D374-T376 WeakPolarHBondContact O-CG2 3.27Å; D374-T376 PolarHBondContact O-N 2.98Å; D374-T376 VanDerWaalsContact O-N 3.08Å
375	L	82.5	Confident	87.4	Confident	59 Å²	59	84.4 Å²	84.4	31%	0.309	44%	0.435	S	S	.	.	S	Bend	trans	63.2	9.9	179.4	-48.3	168.6	0	0	0	114.8	Q355 D357 S372 K373	Q355-L375 HydrophobicContact CB-CD1 3.87Å; Q355-L375 VanDerWaalsContact OE1-CD1 3.26Å; D357-L375 HydrophobicContact CB-CB 4.35Å; D357-L375 HydrophobicContact CB-CD2 3.87Å; S372-L375 PolarHBondContact O-N 3.43Å; S372-L375 PolarHBondContact OG-N 2.85Å; S372-L375 VanDerWaalsContact OG-N 3.14Å; K373-L375 VanDerWaalsContact C-N 3.32Å
376	T	83.8	Confident	87.1	Confident	92 Å²	92	83.2 Å²	83.2	56%	0.564	42%	0.424	S	S	*	.	S	Bend	trans	-91.9	-19.9	-173.2	52.6	0	0	0	0	114.8	K358 S372 D374	K358-T376 WeakPolarHBondContact CE-O 3.16Å; K358-T376 VanDerWaalsContact CG-C 3.44Å; K358-T376 VanDerWaalsContact CG-O 3.23Å; K358-T376 WeakPolarHBondContact CG-O 3.23Å; S372-T376 PolarHBondContact OG-N 2.85Å; S372-T376 VanDerWaalsContact OG-N 3.1Å; D374-T376 HydrophobicContact CB-CG2 4.38Å; D374-T376 WeakPolarHBondContact O-CG2 3.27Å; D374-T376 PolarHBondContact O-N 2.98Å; D374-T376 VanDerWaalsContact O-N 3.08Å
377	Y	85.7	Confident	86.8	Confident	146 Å²	146	78.2 Å²	78.2	57%	0.573	41%	0.405	S	S	*	.			trans	-134.5	157.3	178.3	68.4	-96	0	0	0	111	S371 S372	S371-Y377 WeakPolarHBondContact CA-O 3.41Å; S371-Y377 PolarHBondContact OG-O 3.34Å; S372-Y377 PolarHBondContact N-O 3.2Å; S372-Y377 WeakPolarHBondContact OG-CD1 3.29Å; S372-Y377 PolarHBondContact OG-N 2.9Å
378	S	90.2	Very high	86.5	Confident	24 Å²	24	79 Å²	79	17%	0.168	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	151	173.7	54.1	0	0	0	0	109.8	K358 C359 H362 I370	K358-S378 WeakPolarHBondContact CB-OG 3.4Å; C359-S378 VanDerWaalsContact SG-CB 3.56Å; H362-S378 WeakPolarHBondContact CB-OG 3.45Å; H362-S378 VanDerWaalsContact CG-OG 3.26Å; I370-S378 CarbonylContact O-C 3.27Å; I370-S378 VanDerWaalsContact O-CA 3.23Å; I370-S378 WeakPolarHBondContact O-CA 3.42Å
379	V	90.1	Very high	86.3	Confident	85 Å²	85	79 Å²	79	52%	0.515	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	146.1	173.1	66.5	0	0	0	0	108.3	I370	I370-V379 HydrophobicContact CB-CG1 4.26Å; I370-V379 PolarHBondContact N-O 3.23Å; I370-V379 PolarHBondContact O-N 3.14Å
380	C	91.3	Very high	86.3	Confident	15 Å²	15	81.4 Å²	81.4	10%	0.101	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	127.4	171.8	-60.1	0	0	0	0	110.1	C364 E389 C391	C364-C380 VanDerWaalsContact CA-SG 3.54Å; C364-C380 HydrophobicContact CB-CB 3.78Å; C364-C380 WeakPolarHBondContact CB-SG 3.25Å; C364-C380 WeakPolarHBondContact SG-CA 3.31Å; C364-C380 WeakPolarHBondContact SG-CB 3.04Å; C364-C380 CovalentContact SG-SG 2.03Å; C364-C380 PolarHBondContact SG-SG 2.83Å; C380-E389 PolarHBondContact SG-O 3.06Å; C380-E389 VanDerWaalsContact SG-O 3.38Å; C380-C391 WeakPolarHBondContact CB-SG 3.23Å
381	D	92.5	Very high	86.2	Confident	100 Å²	100	77.5 Å²	77.5	54%	0.535	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	102.8	166.3	-168	17.2	0	0	0	108.1	G367 E368 I370	G367-D381 CarbonylContact C-O 3.58Å; G367-D381 WeakPolarHBondContact CA-O 3.38Å; E368-D381 PolarHBondContact N-O 3.33Å; E368-D381 PolarHBondContact O-N 2.71Å; I370-D381 HydrophobicContact CD1-CB 3.64Å; I370-D381 HydrophobicContact CG1-CB 4.18Å
382	C	89.1	Confident	86.1	Confident	39 Å²	39	79.9 Å²	79.9	26%	0.264	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	142.5	-169.5	-57.1	0	0	0	0	112.1	Y386 C391	C382-Y386 WeakPolarHBondContact CB-O 3.21Å; C382-C391 WeakPolarHBondContact CA-SG 3.15Å; C382-C391 HydrophobicContact CB-CB 3.71Å; C382-C391 WeakPolarHBondContact CB-SG 3.38Å; C382-C391 WeakPolarHBondContact SG-CA 3.48Å; C382-C391 WeakPolarHBondContact SG-CB 3.33Å; C382-C391 CovalentContact SG-SG 2.03Å; C382-C391 PolarHBondContact SG-SG 3.42Å
383	E	87.1	Confident	85.7	Confident	113 Å²	113	84 Å²	84	53%	0.528	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-62.6	157.3	169.9	-67.7	172.7	-153.9	0	0	111.3	Y366 G385 Y386	Y366-E383 PolarHBondContact O-N 3.13Å; E383-G385 PolarHBondContact O-N 2.97Å; E383-Y386 HydrophobicContact CB-CD2 4.41Å; E383-Y386 PolarHBondContact O-N 3.13Å
384	E	82	Confident	85.2	Confident	195 Å²	195	77.1 Å²	77.1	91%	0.911	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	132	177.2	-73.5	-173.4	171.9	0	0	111.1
385	G	74.7	Confident	84.6	Confident	22 Å²	22	76.5 Å²	76.5	23%	0.227	40%	0.397	C	S	.	.	T	Hydrogen-bonded Turn	trans	84.8	6	-175.6	0	0	0	0	0	114.6	E383 P394 K395	E383-G385 PolarHBondContact O-N 2.97Å; G385-P394 CarbonylContact O-C 3.46Å; G385-K395 CarbonylContact C-O 3.56Å; G385-K395 VanDerWaalsContact CA-O 3.31Å; G385-K395 WeakPolarHBondContact CA-O 3.33Å; G385-K395 PolarHBondContact O-N 3.33Å
386	Y	82.6	Confident	84.1	Confident	76 Å²	76	74.1 Å²	74.1	30%	0.298	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	156.1	173.6	-67.1	-87.8	0	0	0	112.6	Y366 C382 E383 I393	Y366-Y386 HydrophobicContact CD1-CE1 4.38Å; Y366-Y386 HydrophobicContact CD1-CE2 4.49Å; Y366-Y386 AromaticContact CD2-CD1 3.54Å; Y366-Y386 HydrophobicContact CD2-CD1 3.54Å; Y366-Y386 AromaticContact CD2-CE1 3.37Å; Y366-Y386 HydrophobicContact CD2-CE1 3.37Å; Y366-Y386 HydrophobicContact CD2-CG 4.27Å; Y366-Y386 AromaticContact CD2-CZ 4Å; Y366-Y386 HydrophobicContact CE2-CD1 4.32Å; Y366-Y386 AromaticContact CE2-CE1 3.76Å; Y366-Y386 HydrophobicContact CE2-CE1 3.76Å; Y366-Y386 AromaticContact CG-CD1 3.87Å; Y366-Y386 HydrophobicContact CG-CD1 3.87Å; Y366-Y386 HydrophobicContact CG-CD2 4.34Å; Y366-Y386 AromaticContact CG-CE1 3.73Å; Y366-Y386 HydrophobicContact CG-CE1 3.73Å; Y366-Y386 HydrophobicContact CG-CE2 4.21Å; Y366-Y386 HydrophobicContact CG-CG 4.17Å; Y366-Y386 AromaticContact CG-CZ 3.91Å; C382-Y386 WeakPolarHBondContact CB-O 3.21Å; E383-Y386 HydrophobicContact CB-CD2 4.41Å; E383-Y386 PolarHBondContact O-N 3.13Å; Y386-I393 CarbonylContact C-O 3.56Å; Y386-I393 WeakPolarHBondContact CA-O 3.39Å
387	G	81.3	Confident	83.6	Confident	2 Å²	2	74.3 Å²	74.3	2%	0.021	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164	-169.5	178.7	0	0	0	0	0	112.8	C391 D392 I393	G387-C391 CarbonylContact O-C 3.5Å; G387-C391 VanDerWaalsContact O-C 3.27Å; G387-C391 WeakPolarHBondContact O-CA 3.47Å; G387-D392 PolarHBondContact O-N 3.1Å; G387-D392 VanDerWaalsContact O-N 3.14Å; G387-I393 PolarHBondContact N-O 3.1Å; G387-I393 WeakPolarHBondContact O-CB 3.31Å; G387-I393 PolarHBondContact O-N 3.24Å
388	G	84.2	Confident	83.4	Confident	35 Å²	35	69.9 Å²	69.9	36%	0.361	37%	0.366	S	S	.	.	S	Bend	trans	91.5	172.5	-169.6	0	0	0	0	0	111.9	K390 C391	G388-K390 PolarHBondContact O-N 3.22Å; G388-C391 PolarHBondContact O-N 3.24Å
389	E	87.2	Confident	83	Confident	150 Å²	150	70.1 Å²	70.1	70%	0.701	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-29.5	-178.5	-168.2	-174.3	161.6	0	0	111.9	H362 C380	H362-E389 IonicContact CE1-OE1 3.69Å; C380-E389 PolarHBondContact SG-O 3.06Å; C380-E389 VanDerWaalsContact SG-O 3.38Å
390	K	90.1	Very high	82.8	Confident	94 Å²	94	73.4 Å²	73.4	41%	0.409	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.8	10.5	-177.3	-60.4	-178.1	-177.2	173	0	114	L363 L365 G388 D392	L363-K390 WeakPolarHBondContact O-CB 3.29Å; L363-K390 WeakPolarHBondContact O-CG 3.43Å; L365-K390 PolarHBondContact N-O 2.97Å; G388-K390 PolarHBondContact O-N 3.22Å; K390-D392 HydrophobicContact CB-CB 4.39Å; K390-D392 PolarHBondContact O-N 2.7Å
391	C	89.5	Confident	82.6	Confident	0 Å²	0	75.9 Å²	75.9	0%	0	39%	0.39	C	S	.	.	S	Bend	trans	55.8	33.5	-170.5	-49.1	0	0	0	0	113.2	Y366 C380 C382 G387 G388	Y366-C391 WeakPolarHBondContact CD2-O 3.41Å; Y366-C391 VanDerWaalsContact O-CB 3.32Å; Y366-C391 WeakPolarHBondContact O-CB 3.11Å; C380-C391 WeakPolarHBondContact CB-SG 3.23Å; C382-C391 WeakPolarHBondContact CA-SG 3.15Å; C382-C391 HydrophobicContact CB-CB 3.71Å; C382-C391 WeakPolarHBondContact CB-SG 3.38Å; C382-C391 WeakPolarHBondContact SG-CA 3.48Å; C382-C391 WeakPolarHBondContact SG-CB 3.33Å; C382-C391 CovalentContact SG-SG 2.03Å; C382-C391 PolarHBondContact SG-SG 3.42Å; G387-C391 CarbonylContact O-C 3.5Å; G387-C391 VanDerWaalsContact O-C 3.27Å; G387-C391 WeakPolarHBondContact O-CA 3.47Å; G388-C391 PolarHBondContact O-N 3.24Å
392	D	84.5	Confident	82.3	Confident	82 Å²	82	73.4 Å²	73.4	44%	0.439	38%	0.38	S	S	.	.			trans	-97.4	-9.3	-176.6	63	-42	0	0	0	113.4	L365 G387 K390	L365-D392 HydrophobicContact CD1-CB 3.89Å; G387-D392 PolarHBondContact O-N 3.1Å; G387-D392 VanDerWaalsContact O-N 3.14Å; K390-D392 HydrophobicContact CB-CB 4.39Å; K390-D392 PolarHBondContact O-N 2.7Å
393	I	80.7	Confident	82.2	Confident	93 Å²	93	79.7 Å²	79.7	48%	0.477	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	117.2	179.3	-52.8	176	0	0	0	108.2	Y386 G387 K395	Y386-I393 CarbonylContact C-O 3.56Å; Y386-I393 WeakPolarHBondContact CA-O 3.39Å; G387-I393 PolarHBondContact N-O 3.1Å; G387-I393 WeakPolarHBondContact O-CB 3.31Å; G387-I393 PolarHBondContact O-N 3.24Å; I393-K395 PolarHBondContact O-N 3.34Å
394	P	73.3	Confident	82.1	Confident	67 Å²	67	78 Å²	78	44%	0.435	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60	120.6	168.5	-14.2	27.6	0	0	0	108.5	G385	G385-P394 CarbonylContact O-C 3.46Å
395	K	74	Confident	82	Confident	118 Å²	118	71.3 Å²	71.3	51%	0.513	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-91.2	123.3	165.2	-78.2	-174.5	171.9	172.9	0	107.4	G385 I393 I397	G385-K395 CarbonylContact C-O 3.56Å; G385-K395 VanDerWaalsContact CA-O 3.31Å; G385-K395 WeakPolarHBondContact CA-O 3.33Å; G385-K395 PolarHBondContact O-N 3.33Å; I393-K395 PolarHBondContact O-N 3.34Å; K395-I397 PolarHBondContact O-N 3.14Å
396	G	72.1	Confident	82.1	Confident	9 Å²	9	75.5 Å²	75.5	9%	0.093	38%	0.379	C	S	.	.	P	Polyproline II helix	trans	-57.2	135.3	179.7	0	0	0	0	0	110.9	W398 S425 D430 C431	G396-W398 PolarHBondContact O-N 2.54Å; G396-S425 WeakPolarHBondContact CA-OG 3.49Å; G396-D430 VanDerWaalsContact N-C 3.29Å; G396-D430 PolarHBondContact N-O 2.05Å; G396-C431 WeakPolarHBondContact CA-SG 3.2Å
397	I	74.2	Confident	81.8	Confident	96 Å²	96	75.4 Å²	75.4	49%	0.492	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-80.5	118.2	-179.7	-59.1	172.1	0	0	0	106.8	K395 L424 S425	K395-I397 PolarHBondContact O-N 3.14Å; I397-L424 HydrophobicContact CG2-CD1 4.37Å; I397-L424 WeakPolarHBondContact O-CA 3.38Å; I397-L424 VanDerWaalsContact O-CB 3.3Å; I397-L424 WeakPolarHBondContact O-CB 3.42Å; I397-L424 PolarHBondContact O-N 3.07Å; I397-S425 PolarHBondContact N-OG 3.1Å
398	W	80.3	Confident	81.1	Confident	52 Å²	52	81.8 Å²	81.8	20%	0.197	42%	0.418	C	S	.	.	B	Isolated β-bridge	trans	-80.2	145.8	173	-73.9	104.2	0	0	0	110.5	G396 R421 C423 C431 V432 L435	G396-W398 PolarHBondContact O-N 2.54Å; W398-R421 VanDerWaalsContact CD1-NH1 3.3Å; W398-R421 HydrophobicContact CD2-CG 4.22Å; W398-R421 VanDerWaalsContact CD2-CZ 3.48Å; W398-R421 VanDerWaalsContact CE2-CZ 3.44Å; W398-R421 HydrophobicContact CE3-CB 4.33Å; W398-R421 HydrophobicContact CE3-CG 3.56Å; W398-R421 VanDerWaalsContact CG-NH1 3.3Å; W398-R421 HydrophobicContact CZ3-CG 3.87Å; W398-C423 HydrophobicContact CE3-CB 4.45Å; W398-C423 HydrophobicContact CZ3-CB 4.21Å; W398-C431 HydrophobicContact CD2-CB 4.1Å; W398-C431 HydrophobicContact CE3-CB 4.4Å; W398-C431 HydrophobicContact CH2-CB 3.86Å; W398-C431 HydrophobicContact CZ2-CB 3.52Å; W398-C431 WeakPolarHBondContact CZ2-O 3.39Å; W398-C431 HydrophobicContact CZ3-CB 4.29Å; W398-V432 PolarHBondContact NE1-O 2.97Å; W398-L435 HydrophobicContact CZ3-CD1 4.24Å
399	S	82.9	Confident	80.1	Confident	29 Å²	29	85.6 Å²	85.6	20%	0.203	43%	0.427	C	S	.	.	P	Polyproline II helix	trans	-65.5	165.7	162.7	76.9	0	0	0	0	110.6	L422	S399-L422 PolarHBondContact N-O 2.6Å; S399-L422 PolarHBondContact OG-N 3.44Å; S399-L422 PolarHBondContact OG-O 3.13Å
400	D	84.4	Confident	78.7	Confident	154 Å²	154	84.6 Å²	84.6	82%	0.824	43%	0.426	S	S	*	.	P	Polyproline II helix	trans	-54.7	148.2	161	-68.5	-42.9	0	0	0	110.2
401	W	87.3	Confident	77.1	Confident	68 Å²	68	86.1 Å²	86.1	26%	0.258	45%	0.448	S	S	.	.	P	Polyproline II helix	trans	-64.5	142.3	172.3	-75.1	98.5	0	0	0	110.2	R419 R421 E434 Q437	W401-R419 HydrophobicContact CD2-CG 4.36Å; W401-R419 HydrophobicContact CE3-CB 4.41Å; W401-R419 HydrophobicContact CE3-CG 3.71Å; W401-R419 HydrophobicContact CZ3-CG 4.18Å; W401-R421 HydrophobicContact CD2-CB 4.01Å; W401-R421 HydrophobicContact CD2-CG 4.04Å; W401-R421 HydrophobicContact CE3-CB 3.81Å; W401-R421 HydrophobicContact CE3-CG 3.8Å; W401-R421 HydrophobicContact CG-CB 4.48Å; W401-R421 HydrophobicContact CH2-CG 3.75Å; W401-R421 VanDerWaalsContact CZ2-CD 3.44Å; W401-R421 HydrophobicContact CZ2-CG 4Å; W401-R421 HydrophobicContact CZ3-CB 4.15Å; W401-R421 HydrophobicContact CZ3-CG 3.65Å; W401-E434 WeakPolarHBondContact CH2-O 3.34Å; W401-Q437 HydrophobicContact CH2-CB 4.25Å; W401-Q437 HydrophobicContact CH2-CG 3.61Å; W401-Q437 HydrophobicContact CZ2-CG 4.09Å; W401-Q437 HydrophobicContact CZ3-CB 4.27Å; W401-Q437 HydrophobicContact CZ3-CG 4.13Å
402	S	87.6	Confident	75.6	Confident	48 Å²	48	90.2 Å²	90.2	34%	0.336	49%	0.491	S	S	.	.	P	Polyproline II helix	trans	-60.4	161.2	166.7	77	0	0	0	0	110.9	I420	S402-I420 VanDerWaalsContact CB-O 3.32Å; S402-I420 WeakPolarHBondContact CB-O 3.42Å; S402-I420 PolarHBondContact N-O 3.35Å; S402-I420 PolarHBondContact OG-N 3.27Å; S402-I420 PolarHBondContact OG-O 3.1Å
403	E	86.3	Confident	74.3	Confident	170 Å²	170	89.1 Å²	89.1	79%	0.794	49%	0.489	S	S	*	.	P	Polyproline II helix	trans	-56.3	148.7	163.6	-67.5	-59.5	142.3	0	0	110.4
404	W	84	Confident	73.6	Confident	77 Å²	77	88.9 Å²	88.9	29%	0.292	49%	0.492	S	S	.	.	P	Polyproline II helix	trans	-66	132.1	173.9	-75.8	101.8	0	0	0	109.9	S417 R419 Q437 R439	W404-S417 WeakPolarHBondContact CB-OG 3.47Å; W404-S417 WeakPolarHBondContact CZ3-O 3.43Å; W404-R419 HydrophobicContact CD2-CB 4.05Å; W404-R419 HydrophobicContact CD2-CG 3.95Å; W404-R419 VanDerWaalsContact CE2-CD 3.41Å; W404-R419 HydrophobicContact CE3-CB 3.91Å; W404-R419 HydrophobicContact CE3-CG 3.82Å; W404-R419 HydrophobicContact CG-CB 4.49Å; W404-R419 HydrophobicContact CH2-CG 3.78Å; W404-R419 VanDerWaalsContact CZ2-CD 3.48Å; W404-R419 HydrophobicContact CZ2-CG 3.92Å; W404-R419 HydrophobicContact CZ3-CB 4.26Å; W404-R419 HydrophobicContact CZ3-CG 3.72Å; W404-Q437 HydrophobicContact CH2-CB 4.1Å; W404-R439 HydrophobicContact CE3-CB 4.28Å; W404-R439 HydrophobicContact CH2-CB 3.59Å; W404-R439 HydrophobicContact CZ2-CB 4.32Å; W404-R439 HydrophobicContact CZ3-CB 3.56Å
405	T	79.9	Confident	73.5	Confident	55 Å²	55	85.9 Å²	85.9	34%	0.337	47%	0.474	S	S	.	.	P	Polyproline II helix	trans	-64.8	156.6	170.7	58.9	0	0	0	0	110.2	S417 T418	T405-S417 WeakPolarHBondContact O-CB 3.25Å; T405-S417 PolarHBondContact O-OG 3.45Å; T405-T418 WeakPolarHBondContact CG2-O 3.31Å; T405-T418 PolarHBondContact N-O 3.29Å; T405-T418 PolarHBondContact OG1-N 3.43Å; T405-T418 PolarHBondContact OG1-O 3.2Å; T405-T418 VanDerWaalsContact OG1-O 3.06Å; T405-T418 PolarHBondContact OG1-OG1 3.1Å
406	F	77.2	Confident	73.7	Confident	111 Å²	111	85.1 Å²	85.1	49%	0.487	47%	0.473	S	S	.	.	P	Polyproline II helix	trans	-63.3	153.7	175.2	-64.6	-38.9	0	0	0	111.7	E408 I453	F406-E408 PolarHBondContact O-N 2.75Å; F406-I453 HydrophobicContact CD1-CD1 3.87Å; F406-I453 HydrophobicContact CD2-CB 3.6Å; F406-I453 HydrophobicContact CD2-CD1 3.53Å; F406-I453 HydrophobicContact CD2-CG1 3.56Å; F406-I453 HydrophobicContact CE1-CD1 3.53Å; F406-I453 HydrophobicContact CE1-CG1 4.37Å; F406-I453 HydrophobicContact CE2-CB 3.66Å; F406-I453 HydrophobicContact CE2-CD1 3.2Å; F406-I453 HydrophobicContact CE2-CG1 3.1Å; F406-I453 HydrophobicContact CG-CB 4.42Å; F406-I453 HydrophobicContact CG-CD1 3.85Å; F406-I453 HydrophobicContact CG-CG1 4.36Å; F406-I453 HydrophobicContact CZ-CB 4.5Å; F406-I453 HydrophobicContact CZ-CD1 3.15Å; F406-I453 HydrophobicContact CZ-CG1 3.55Å
407	C	76	Confident	74.3	Confident	74 Å²	74	85.2 Å²	85.2	50%	0.5	47%	0.472	S	S	.	.			trans	-63.2	103.6	177.1	-71.2	0	0	0	0	110.9	Q409 M416 C441	C407-Q409 PolarHBondContact O-N 3.05Å; C407-M416 WeakPolarHBondContact CA-O 3.2Å; C407-C441 VanDerWaalsContact CA-SG 3.58Å; C407-C441 HydrophobicContact CB-CB 3.88Å; C407-C441 WeakPolarHBondContact CB-SG 3.35Å; C407-C441 WeakPolarHBondContact SG-CB 3.48Å; C407-C441 CovalentContact SG-SG 2.01Å; C407-C441 PolarHBondContact SG-SG 3.36Å
408	E	67.3	Low	74.7	Confident	136 Å²	136	82.4 Å²	82.4	64%	0.636	46%	0.46	S	S	*	.	B	Isolated β-bridge	trans	-80.2	110.2	173.6	-135.2	167.2	-145.2	0	0	107.7	F406 G415 M416	F406-E408 PolarHBondContact O-N 2.75Å; E408-G415 VanDerWaalsContact O-CA 3.27Å; E408-G415 WeakPolarHBondContact O-CA 3.47Å; E408-M416 PolarHBondContact N-O 3.03Å; E408-M416 PolarHBondContact O-N 3.04Å
409	Q	63.7	Low	75.1	Confident	115 Å²	115	82.9 Å²	82.9	54%	0.537	46%	0.462	S	S	.	.			trans	-112.5	102.7	-179.2	-177	161.1	42.7	0	0	109.4	C407 S413	C407-Q409 PolarHBondContact O-N 3.05Å; Q409-S413 PolarHBondContact NE2-O 3.23Å
410	D	58.4	Low	75.5	Confident	128 Å²	128	85.5 Å²	85.5	68%	0.684	47%	0.472	S	S	*	.			trans	-75.4	142.5	166	-124.9	-12.1	0	0	0	109	G412 S413	D410-G412 PolarHBondContact O-N 3.02Å; D410-S413 PolarHBondContact O-N 3.34Å; D410-S413 PolarHBondContact O-OG 3.21Å; D410-S413 VanDerWaalsContact O-OG 3.09Å
411	S	56.1	Low	75.7	Confident	126 Å²	126	80 Å²	80	88%	0.881	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	93.5	-170.2	57.3	0	0	0	0	112.3
412	G	57.4	Low	75.6	Confident	86 Å²	86	82.1 Å²	82.1	89%	0.887	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	122.2	-4.8	178.2	0	0	0	0	0	115.6	D410	D410-G412 PolarHBondContact O-N 3.02Å
413	S	57.5	Low	75.3	Confident	59 Å²	59	81 Å²	81	41%	0.413	45%	0.448	S	S	.	.	S	Bend	trans	-110	156.7	176.1	50.5	0	0	0	0	112.6	Q409 D410 G415	Q409-S413 PolarHBondContact NE2-O 3.23Å; D410-S413 PolarHBondContact O-N 3.34Å; D410-S413 PolarHBondContact O-OG 3.21Å; D410-S413 VanDerWaalsContact O-OG 3.09Å; S413-G415 PolarHBondContact O-N 2.97Å
414	T	65.1	Low	74.9	Confident	88 Å²	88	78.4 Å²	78.4	54%	0.54	44%	0.439	S	S	.	.			trans	-64.9	125.4	169.1	-43.3	0	0	0	0	108.1	L440	T414-L440 HydrophobicContact CG2-CB 4.35Å; T414-L440 HydrophobicContact CG2-CD2 3.95Å
415	G	71.7	Confident	74.4	Confident	4 Å²	4	76.3 Å²	76.3	4%	0.041	44%	0.436	C	S	.	.			trans	-59.8	146.1	179.9	0	0	0	0	0	111.7	E408 S413 C441	E408-G415 VanDerWaalsContact O-CA 3.27Å; E408-G415 WeakPolarHBondContact O-CA 3.47Å; S413-G415 PolarHBondContact O-N 2.97Å; G415-C441 WeakPolarHBondContact O-CB 3.5Å; G415-C441 PolarHBondContact O-N 2.82Å; G415-C441 PolarHBondContact O-SG 3.48Å
416	M	78.7	Confident	74.1	Confident	102 Å²	102	83.1 Å²	83.1	50%	0.502	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	142.8	175.1	-68.3	-179.1	-68.3	0	0	109.7	C407 E408 V438 R439 L440	C407-M416 WeakPolarHBondContact CA-O 3.2Å; E408-M416 PolarHBondContact N-O 3.03Å; E408-M416 PolarHBondContact O-N 3.04Å; M416-V438 HydrophobicContact CB-CG1 4Å; M416-V438 HydrophobicContact CG-CG1 4.11Å; M416-V438 HydrophobicContact SD-CG1 3.94Å; M416-R439 WeakPolarHBondContact CA-O 3.24Å; M416-L440 HydrophobicContact CG-CD2 4.17Å
417	S	84.6	Confident	73.9	Confident	11 Å²	11	82.4 Å²	82.4	8%	0.077	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	136.7	172.2	172	0	0	0	0	107.5	W404 T405 R439	W404-S417 WeakPolarHBondContact CB-OG 3.47Å; W404-S417 WeakPolarHBondContact CZ3-O 3.43Å; T405-S417 WeakPolarHBondContact O-CB 3.25Å; T405-S417 PolarHBondContact O-OG 3.45Å; S417-R439 PolarHBondContact N-O 2.02Å; S417-R439 PolarHBondContact O-N 3.11Å
418	T	81.6	Confident	73.8	Confident	38 Å²	38	86 Å²	86	23%	0.233	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	150.4	-174.9	61	0	0	0	0	111	T405 Q437 V438	T405-T418 WeakPolarHBondContact CG2-O 3.31Å; T405-T418 PolarHBondContact N-O 3.29Å; T405-T418 PolarHBondContact OG1-N 3.43Å; T405-T418 PolarHBondContact OG1-O 3.2Å; T405-T418 VanDerWaalsContact OG1-O 3.06Å; T405-T418 PolarHBondContact OG1-OG1 3.1Å; T418-Q437 CarbonylContact C-O 3.56Å; T418-Q437 VanDerWaalsContact CA-O 3.24Å; T418-Q437 WeakPolarHBondContact CA-O 3.23Å; T418-V438 HydrophobicContact CG2-CB 4.46Å; T418-V438 HydrophobicContact CG2-CG1 4.23Å; T418-V438 HydrophobicContact CG2-CG2 3.99Å
419	R	90.5	Very high	74	Confident	62 Å²	62	88.1 Å²	88.1	23%	0.234	49%	0.485	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	151.5	168.1	65	174.5	-178.2	-179.3	0.3	109.6	W401 W404 E436 Q437	W401-R419 HydrophobicContact CD2-CG 4.36Å; W401-R419 HydrophobicContact CE3-CB 4.41Å; W401-R419 HydrophobicContact CE3-CG 3.71Å; W401-R419 HydrophobicContact CZ3-CG 4.18Å; W404-R419 HydrophobicContact CD2-CB 4.05Å; W404-R419 HydrophobicContact CD2-CG 3.95Å; W404-R419 VanDerWaalsContact CE2-CD 3.41Å; W404-R419 HydrophobicContact CE3-CB 3.91Å; W404-R419 HydrophobicContact CE3-CG 3.82Å; W404-R419 HydrophobicContact CG-CB 4.49Å; W404-R419 HydrophobicContact CH2-CG 3.78Å; W404-R419 VanDerWaalsContact CZ2-CD 3.48Å; W404-R419 HydrophobicContact CZ2-CG 3.92Å; W404-R419 HydrophobicContact CZ3-CB 4.26Å; W404-R419 HydrophobicContact CZ3-CG 3.72Å; R419-E436 WeakPolarHBondContact O-CA 3.5Å; R419-Q437 HydrophobicContact CG-CB 4.08Å; R419-Q437 PolarHBondContact N-O 3.32Å; R419-Q437 PolarHBondContact O-N 3.25Å
420	I	89.4	Confident	74.3	Confident	83 Å²	83	84.9 Å²	84.9	43%	0.426	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	158.5	-177.6	59.7	170.4	0	0	0	111	S402 L435 E436	S402-I420 VanDerWaalsContact CB-O 3.32Å; S402-I420 WeakPolarHBondContact CB-O 3.42Å; S402-I420 PolarHBondContact N-O 3.35Å; S402-I420 PolarHBondContact OG-N 3.27Å; S402-I420 PolarHBondContact OG-O 3.1Å; I420-L435 VanDerWaalsContact CA-O 3.27Å; I420-L435 WeakPolarHBondContact CA-O 3.44Å; I420-E436 HydrophobicContact CG2-CB 4.02Å; I420-E436 HydrophobicContact CG2-CG 3.98Å
421	R	89.9	Confident	75.2	Confident	39 Å²	39	79.4 Å²	79.4	15%	0.147	44%	0.443	C	S	.	.			trans	-136.5	159.8	169.6	58.9	176.3	176.1	166.6	7.3	109.4	W398 W401 E434 L435	W398-R421 VanDerWaalsContact CD1-NH1 3.3Å; W398-R421 HydrophobicContact CD2-CG 4.22Å; W398-R421 VanDerWaalsContact CD2-CZ 3.48Å; W398-R421 VanDerWaalsContact CE2-CZ 3.44Å; W398-R421 HydrophobicContact CE3-CB 4.33Å; W398-R421 HydrophobicContact CE3-CG 3.56Å; W398-R421 VanDerWaalsContact CG-NH1 3.3Å; W398-R421 HydrophobicContact CZ3-CG 3.87Å; W401-R421 HydrophobicContact CD2-CB 4.01Å; W401-R421 HydrophobicContact CD2-CG 4.04Å; W401-R421 HydrophobicContact CE3-CB 3.81Å; W401-R421 HydrophobicContact CE3-CG 3.8Å; W401-R421 HydrophobicContact CG-CB 4.48Å; W401-R421 HydrophobicContact CH2-CG 3.75Å; W401-R421 VanDerWaalsContact CZ2-CD 3.44Å; W401-R421 HydrophobicContact CZ2-CG 4Å; W401-R421 HydrophobicContact CZ3-CB 4.15Å; W401-R421 HydrophobicContact CZ3-CG 3.65Å; R421-E434 PolarHBondContact NE-O 3.14Å; R421-E434 PolarHBondContact NH2-O 2.85Å; R421-L435 PolarHBondContact N-O 3.35Å; R421-L435 WeakPolarHBondContact O-CD1 3.39Å
422	L	84.5	Confident	76	Confident	113 Å²	113	79.3 Å²	79.3	59%	0.592	44%	0.436	S	S	*	.			trans	-111.1	144.5	-178.5	-63.9	169.5	0	0	0	110.4	S399	S399-L422 PolarHBondContact N-O 2.6Å; S399-L422 PolarHBondContact OG-N 3.44Å; S399-L422 PolarHBondContact OG-O 3.13Å
423	C	82.1	Confident	76.9	Confident	25 Å²	25	77.7 Å²	77.7	17%	0.169	42%	0.419	C	S	.	.	B	Isolated β-bridge	trans	-75.6	125	167.9	-174.8	0	0	0	0	109.2	W398 E428 C431	W398-C423 HydrophobicContact CE3-CB 4.45Å; W398-C423 HydrophobicContact CZ3-CB 4.21Å; C423-E428 HydrophobicContact CB-CG 4.16Å; C423-C431 WeakPolarHBondContact CA-SG 3.37Å; C423-C431 HydrophobicContact CB-CB 3.57Å; C423-C431 WeakPolarHBondContact CB-SG 3.39Å; C423-C431 WeakPolarHBondContact SG-CB 3.33Å; C423-C431 CovalentContact SG-SG 2.02Å; C423-C431 PolarHBondContact SG-SG 2.73Å
424	L	78.4	Confident	78	Confident	114 Å²	114	80.6 Å²	80.6	60%	0.597	43%	0.427	S	S	*	.			trans	-94.2	-6.8	178.7	-58.4	178.6	0	0	0	113	I397	I397-L424 HydrophobicContact CG2-CD1 4.37Å; I397-L424 WeakPolarHBondContact O-CA 3.38Å; I397-L424 VanDerWaalsContact O-CB 3.3Å; I397-L424 WeakPolarHBondContact O-CB 3.42Å; I397-L424 PolarHBondContact O-N 3.07Å
425	S	72	Confident	78.9	Confident	34 Å²	34	80.6 Å²	80.6	24%	0.238	42%	0.423	C	S	.	.	S	Bend	trans	-79.7	155.5	177.5	-70.1	0	0	0	0	112.5	G396 I397 N427	G396-S425 WeakPolarHBondContact CA-OG 3.49Å; I397-S425 PolarHBondContact N-OG 3.1Å; S425-N427 VanDerWaalsContact C-N 3.3Å; S425-N427 PolarHBondContact O-N 2.85Å
426	E	73.2	Confident	79.7	Confident	198 Å²	198	85.2 Å²	85.2	93%	0.925	44%	0.443	S	S	*	.	S	Bend	trans	-61.4	-37.1	-178.6	-71.5	-171.7	163.3	0	0	112.9
427	N	73.7	Confident	80.2	Confident	96 Å²	96	83 Å²	83	51%	0.513	43%	0.432	S	S	.	.	S	Bend	trans	-102.8	120.2	173.6	-56.7	-47	0	0	0	109.7	S425 E429 D430	S425-N427 VanDerWaalsContact C-N 3.3Å; S425-N427 PolarHBondContact O-N 2.85Å; N427-E429 PolarHBondContact O-N 3.22Å; N427-D430 PolarHBondContact O-N 3.23Å
428	E	73.6	Confident	80.2	Confident	149 Å²	149	86.6 Å²	86.6	70%	0.696	45%	0.453	S	S	*	.	G	3₁₀ helix	trans	-64.1	-24.9	179.6	-154.5	170.1	-159.8	0	0	112.3	C423 D430 C431	C423-E428 HydrophobicContact CB-CG 4.16Å; E428-D430 VanDerWaalsContact C-N 3.27Å; E428-D430 PolarHBondContact O-N 2.99Å; E428-C431 PolarHBondContact O-N 3.28Å
429	E	72.2	Confident	80.3	Confident	181 Å²	181	90.9 Å²	90.9	85%	0.846	47%	0.465	S	S	*	.	G	3₁₀ helix	trans	-66.5	-23.5	177.4	-58.2	-173.4	-167.4	0	0	113.6	N427 C431	N427-E429 PolarHBondContact O-N 3.22Å; E429-C431 VanDerWaalsContact C-N 3.28Å; E429-C431 PolarHBondContact O-N 2.67Å
430	D	70.2	Confident	79.7	Confident	47 Å²	47	93.4 Å²	93.4	25%	0.251	48%	0.482	S	S	.	.	G	3₁₀ helix	trans	-73.3	-24.8	-179	-64.2	-21.4	0	0	0	111.4	G396 N427 E428 V432	G396-D430 VanDerWaalsContact N-C 3.29Å; G396-D430 PolarHBondContact N-O 2.05Å; N427-D430 PolarHBondContact O-N 3.23Å; E428-D430 VanDerWaalsContact C-N 3.27Å; E428-D430 PolarHBondContact O-N 2.99Å; D430-V432 PolarHBondContact O-N 2.85Å; D430-V432 VanDerWaalsContact O-N 3.1Å
431	C	76.4	Confident	78.8	Confident	13 Å²	13	90.4 Å²	90.4	9%	0.088	47%	0.468	C	S	.	.			trans	-80.2	88	-179.9	-77.7	0	0	0	0	111.2	G396 W398 C423 E428 E429	G396-C431 WeakPolarHBondContact CA-SG 3.2Å; W398-C431 HydrophobicContact CD2-CB 4.1Å; W398-C431 HydrophobicContact CE3-CB 4.4Å; W398-C431 HydrophobicContact CH2-CB 3.86Å; W398-C431 HydrophobicContact CZ2-CB 3.52Å; W398-C431 WeakPolarHBondContact CZ2-O 3.39Å; W398-C431 HydrophobicContact CZ3-CB 4.29Å; C423-C431 WeakPolarHBondContact CA-SG 3.37Å; C423-C431 HydrophobicContact CB-CB 3.57Å; C423-C431 WeakPolarHBondContact CB-SG 3.39Å; C423-C431 WeakPolarHBondContact SG-CB 3.33Å; C423-C431 CovalentContact SG-SG 2.02Å; C423-C431 PolarHBondContact SG-SG 2.73Å; E428-C431 PolarHBondContact O-N 3.28Å; E429-C431 VanDerWaalsContact C-N 3.28Å; E429-C431 PolarHBondContact O-N 2.67Å
432	V	73.8	Confident	77.5	Confident	124 Å²	124	96.9 Å²	96.9	75%	0.752	50%	0.5	S	S	*	.			trans	-79.6	125.6	177.3	-175.6	0	0	0	0	111.1	W398 D430	W398-V432 PolarHBondContact NE1-O 2.97Å; D430-V432 PolarHBondContact O-N 2.85Å; D430-V432 VanDerWaalsContact O-N 3.1Å
433	G	76.4	Confident	75.7	Confident	51 Å²	51	96.8 Å²	96.8	53%	0.526	51%	0.509	S	S	.	.	S	Bend	trans	137.6	-178.3	174.2	0	0	0	0	0	113
434	E	80.5	Confident	73.8	Confident	121 Å²	121	102.3 Å²	102.3	57%	0.565	54%	0.537	S	S	*	.			trans	-73.2	132	-179.1	-62.7	-177.4	163.1	0	0	111.1	W401 R421 Q437	W401-E434 WeakPolarHBondContact CH2-O 3.34Å; R421-E434 PolarHBondContact NE-O 3.14Å; R421-E434 PolarHBondContact NH2-O 2.85Å; E434-Q437 WeakPolarHBondContact OE2-CG 3.39Å
435	L	83.4	Confident	72	Confident	87 Å²	87	103.8 Å²	103.8	46%	0.455	55%	0.545	S	S	.	.	S	Bend	trans	-72.7	-35.4	169.6	-176.2	90.5	0	0	0	110.7	W398 I420 R421	W398-L435 HydrophobicContact CZ3-CD1 4.24Å; I420-L435 VanDerWaalsContact CA-O 3.27Å; I420-L435 WeakPolarHBondContact CA-O 3.44Å; R421-L435 PolarHBondContact N-O 3.35Å; R421-L435 WeakPolarHBondContact O-CD1 3.39Å
436	E	88	Confident	70.3	Confident	101 Å²	101	108.4 Å²	108.4	47%	0.472	57%	0.572	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-130.2	135	-173.9	-178.7	178.1	-173.6	0	0	109.9	R419 I420	R419-E436 WeakPolarHBondContact O-CA 3.5Å; I420-E436 HydrophobicContact CG2-CB 4.02Å; I420-E436 HydrophobicContact CG2-CG 3.98Å
437	Q	89.5	Confident	68.6	Low	56 Å²	56	107 Å²	107	26%	0.262	56%	0.563	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-117	138.8	171.6	-81.4	-175.7	-19.2	0	0	110.8	W401 W404 T418 R419 E434	W401-Q437 HydrophobicContact CH2-CB 4.25Å; W401-Q437 HydrophobicContact CH2-CG 3.61Å; W401-Q437 HydrophobicContact CZ2-CG 4.09Å; W401-Q437 HydrophobicContact CZ3-CB 4.27Å; W401-Q437 HydrophobicContact CZ3-CG 4.13Å; W404-Q437 HydrophobicContact CH2-CB 4.1Å; T418-Q437 CarbonylContact C-O 3.56Å; T418-Q437 VanDerWaalsContact CA-O 3.24Å; T418-Q437 WeakPolarHBondContact CA-O 3.23Å; R419-Q437 HydrophobicContact CG-CB 4.08Å; R419-Q437 PolarHBondContact N-O 3.32Å; R419-Q437 PolarHBondContact O-N 3.25Å; E434-Q437 WeakPolarHBondContact OE2-CG 3.39Å
438	V	84	Confident	66.9	Low	87 Å²	87	108.2 Å²	108.2	53%	0.527	57%	0.574	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-116.5	128.6	177.2	-171.9	0	0	0	0	109.3	M416 T418	M416-V438 HydrophobicContact CB-CG1 4Å; M416-V438 HydrophobicContact CG-CG1 4.11Å; M416-V438 HydrophobicContact SD-CG1 3.94Å; T418-V438 HydrophobicContact CG2-CB 4.46Å; T418-V438 HydrophobicContact CG2-CG1 4.23Å; T418-V438 HydrophobicContact CG2-CG2 3.99Å
439	R	83.9	Confident	65.4	Low	128 Å²	128	109.3 Å²	109.3	48%	0.483	58%	0.579	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-119.5	136.9	176.1	171.8	-179.9	159	-168	-4	109.9	W404 M416 S417	W404-R439 HydrophobicContact CE3-CB 4.28Å; W404-R439 HydrophobicContact CH2-CB 3.59Å; W404-R439 HydrophobicContact CZ2-CB 4.32Å; W404-R439 HydrophobicContact CZ3-CB 3.56Å; M416-R439 WeakPolarHBondContact CA-O 3.24Å; S417-R439 PolarHBondContact N-O 2.02Å; S417-R439 PolarHBondContact O-N 3.11Å
440	L	77.9	Confident	64.1	Low	114 Å²	114	107.3 Å²	107.3	60%	0.597	57%	0.574	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-75.5	132.5	170.7	-67.2	162.6	0	0	0	110	T414 M416	T414-L440 HydrophobicContact CG2-CB 4.35Å; T414-L440 HydrophobicContact CG2-CD2 3.95Å; M416-L440 HydrophobicContact CG-CD2 4.17Å
441	C	72	Confident	63.1	Low	20 Å²	20	110.6 Å²	110.6	14%	0.135	59%	0.588	C	S	.	*	P	Polyproline II helix	trans	-74.9	129.9	177.6	-62.7	0	0	0	0	110.5	C407 G415 S443	C407-C441 VanDerWaalsContact CA-SG 3.58Å; C407-C441 HydrophobicContact CB-CB 3.88Å; C407-C441 WeakPolarHBondContact CB-SG 3.35Å; C407-C441 WeakPolarHBondContact SG-CB 3.48Å; C407-C441 CovalentContact SG-SG 2.01Å; C407-C441 PolarHBondContact SG-SG 3.36Å; G415-C441 WeakPolarHBondContact O-CB 3.5Å; G415-C441 PolarHBondContact O-N 2.82Å; G415-C441 PolarHBondContact O-SG 3.48Å; C441-S443 PolarHBondContact O-N 3.21Å
442	E	63.1	Low	62.1	Low	175 Å²	175	111.9 Å²	111.9	82%	0.818	60%	0.597	S	S	*	*	P	Polyproline II helix	trans	-72	124.1	177	-92.6	177.7	154.1	0	0	110.1	N444	E442-N444 PolarHBondContact O-N 3.14Å
443	S	46	Very low	61.4	Low	111 Å²	111	109.1 Å²	109.1	78%	0.776	58%	0.578	S	S	*	*			trans	-69.4	91.5	-179.4	57.5	0	0	0	0	110.7	C441	C441-S443 PolarHBondContact O-N 3.21Å
444	N	42.4	Very low	60.5	Low	142 Å²	142	109.2 Å²	109.2	76%	0.759	57%	0.57	S	S	*	*			trans	-153.2	110.8	158.2	-100.9	-34.9	0	0	0	112	E442	E442-N444 PolarHBondContact O-N 3.14Å
445	L	40	Very low	59.6	Low	144 Å²	144	108.6 Å²	108.6	75%	0.754	57%	0.567	S	S	*	*	S	Bend	trans	56.8	130	147.2	-88.9	85.2	0	0	0	120.5
446	T	36.4	Very low	58.6	Low	131 Å²	131	107.9 Å²	107.9	80%	0.804	56%	0.563	S	S	*	*			trans	71.1	79.4	152	52	0	0	0	0	116.7	T448	T446-T448 PolarHBondContact O-N 3.25Å
447	F	36.4	Very low	57.6	Low	168 Å²	168	106.8 Å²	106.8	74%	0.737	56%	0.563	S	S	*	*			trans	-41.7	112.6	151.6	-114.2	-103.4	0	0	0	111.7	Q449	F447-Q449 HydrophobicContact CD1-CG 3.9Å; F447-Q449 HydrophobicContact CE1-CG 4.34Å
448	T	39.8	Very low	56.6	Low	122 Å²	122	112.5 Å²	112.5	75%	0.748	58%	0.583	S	S	*	*			trans	-96.2	115	139.9	39.9	0	0	0	0	106	T446 N450	T446-T448 PolarHBondContact O-N 3.25Å; T448-N450 PolarHBondContact O-N 3.22Å
449	Q	42.4	Very low	56.2	Low	172 Å²	172	112.8 Å²	112.8	80%	0.804	58%	0.581	S	S	*	*			trans	-59.1	90.1	169.6	-71.2	178	-24.8	0	0	108.4	F447	F447-Q449 HydrophobicContact CD1-CG 3.9Å; F447-Q449 HydrophobicContact CE1-CG 4.34Å
450	N	44.8	Very low	55.8	Low	140 Å²	140	111.2 Å²	111.2	75%	0.749	58%	0.582	S	S	*	*			trans	-103.8	125.6	153.4	-83.7	-6.8	0	0	0	104.7	T448	T448-N450 PolarHBondContact O-N 3.22Å
451	E	48.4	Very low	55.8	Low	116 Å²	116	111.3 Å²	111.3	54%	0.542	58%	0.578	S	S	.	*			trans	-42.9	142.5	-178.6	-72.6	174.7	159.4	0	0	111.3	E455 I456	E451-E455 HydrophobicContact CB-CB 4.36Å; E451-I456 HydrophobicContact CB-CG1 4.29Å
452	S	55.2	Low	56.2	Low	39 Å²	39	112.4 Å²	112.4	27%	0.273	58%	0.584	S	S	.	*			trans	-58.7	145.5	-176.9	65.7	0	0	0	0	109.6	S454 E455 I456	S452-S454 WeakPolarHBondContact CB-OG 3.33Å; S452-S454 PolarHBondContact O-N 2.94Å; S452-S454 VanDerWaalsContact O-N 3.1Å; S452-S454 PolarHBondContact OG-OG 2.93Å; S452-E455 CarbonylContact O-C 3.59Å; S452-E455 WeakPolarHBondContact O-CA 2.96Å; S452-E455 WeakPolarHBondContact O-CB 3.25Å; S452-E455 PolarHBondContact O-N 2.85Å; S452-E455 WeakPolarHBondContact OG-CB 3.06Å; S452-E455 PolarHBondContact OG-N 3.25Å; S452-I456 PolarHBondContact O-N 3.08Å
453	I	59.8	Low	57.1	Low	67 Å²	67	109.6 Å²	109.6	34%	0.344	57%	0.571	S	S	.	*	H	α-helix	trans	-54.6	-31.2	171.8	-95.7	155.2	0	0	0	109	F406 I456 T457	F406-I453 HydrophobicContact CD1-CD1 3.87Å; F406-I453 HydrophobicContact CD2-CB 3.6Å; F406-I453 HydrophobicContact CD2-CD1 3.53Å; F406-I453 HydrophobicContact CD2-CG1 3.56Å; F406-I453 HydrophobicContact CE1-CD1 3.53Å; F406-I453 HydrophobicContact CE1-CG1 4.37Å; F406-I453 HydrophobicContact CE2-CB 3.66Å; F406-I453 HydrophobicContact CE2-CD1 3.2Å; F406-I453 HydrophobicContact CE2-CG1 3.1Å; F406-I453 HydrophobicContact CG-CB 4.42Å; F406-I453 HydrophobicContact CG-CD1 3.85Å; F406-I453 HydrophobicContact CG-CG1 4.36Å; F406-I453 HydrophobicContact CZ-CB 4.5Å; F406-I453 HydrophobicContact CZ-CD1 3.15Å; F406-I453 HydrophobicContact CZ-CG1 3.55Å; I453-I456 PolarHBondContact O-N 2.89Å; I453-T457 HydrophobicContact CG2-CG2 4.01Å; I453-T457 VanDerWaalsContact O-CB 3.24Å; I453-T457 WeakPolarHBondContact O-CB 3.13Å; I453-T457 WeakPolarHBondContact O-CG2 3.39Å; I453-T457 PolarHBondContact O-N 3.01Å; I453-T457 PolarHBondContact O-OG1 3.34Å
454	S	57.5	Low	58.8	Low	52 Å²	52	112.5 Å²	112.5	36%	0.364	57%	0.565	S	S	.	*	H	α-helix	trans	-61.1	-48	171.6	47.8	0	0	0	0	111.2	S452 T457 W458	S452-S454 WeakPolarHBondContact CB-OG 3.33Å; S452-S454 PolarHBondContact O-N 2.94Å; S452-S454 VanDerWaalsContact O-N 3.1Å; S452-S454 PolarHBondContact OG-OG 2.93Å; S454-T457 WeakPolarHBondContact CA-OG1 3.2Å; S454-T457 PolarHBondContact O-OG1 3.08Å; S454-T457 VanDerWaalsContact O-OG1 3.06Å; S454-W458 WeakPolarHBondContact O-CB 3.13Å; S454-W458 PolarHBondContact O-N 2.69Å
455	E	61.2	Low	60.7	Low	109 Å²	109	107.5 Å²	107.5	51%	0.509	54%	0.54	S	S	.	.	H	α-helix	trans	-64.4	-40.4	173.5	-89.1	179.5	151.4	0	0	113.1	E451 S452 W458 N459	E451-E455 HydrophobicContact CB-CB 4.36Å; S452-E455 CarbonylContact O-C 3.59Å; S452-E455 WeakPolarHBondContact O-CA 2.96Å; S452-E455 WeakPolarHBondContact O-CB 3.25Å; S452-E455 PolarHBondContact O-N 2.85Å; S452-E455 WeakPolarHBondContact OG-CB 3.06Å; S452-E455 PolarHBondContact OG-N 3.25Å; E455-W458 PolarHBondContact O-N 3.14Å; E455-N459 VanDerWaalsContact O-CB 3.31Å; E455-N459 WeakPolarHBondContact O-CB 3.22Å; E455-N459 PolarHBondContact O-N 3.26Å
456	I	62.9	Low	62.8	Low	71 Å²	71	106.9 Å²	106.9	36%	0.364	53%	0.533	S	S	.	.	H	α-helix	trans	-64.3	-48.2	177	-62.6	170.4	0	0	0	110.4	E451 S452 I453 W458 N459 D460	E451-I456 HydrophobicContact CB-CG1 4.29Å; S452-I456 PolarHBondContact O-N 3.08Å; I453-I456 PolarHBondContact O-N 2.89Å; I456-W458 VanDerWaalsContact C-N 3.33Å; I456-W458 PolarHBondContact O-N 3.48Å; I456-N459 PolarHBondContact O-N 3.31Å; I456-D460 WeakPolarHBondContact O-CB 3.07Å; I456-D460 PolarHBondContact O-N 3.21Å
457	T	67	Low	65.1	Low	78 Å²	78	104.2 Å²	104.2	48%	0.479	51%	0.514	S	S	.	.	H	α-helix	trans	-67.9	-34.1	178.9	54	0	0	0	0	111.7	I453 S454 F461	I453-T457 HydrophobicContact CG2-CG2 4.01Å; I453-T457 VanDerWaalsContact O-CB 3.24Å; I453-T457 WeakPolarHBondContact O-CB 3.13Å; I453-T457 WeakPolarHBondContact O-CG2 3.39Å; I453-T457 PolarHBondContact O-N 3.01Å; I453-T457 PolarHBondContact O-OG1 3.34Å; S454-T457 WeakPolarHBondContact CA-OG1 3.2Å; S454-T457 PolarHBondContact O-OG1 3.08Å; S454-T457 VanDerWaalsContact O-OG1 3.06Å; T457-F461 WeakPolarHBondContact O-CB 3.19Å; T457-F461 PolarHBondContact O-N 3.46Å
458	W	68.6	Low	67.5	Low	177 Å²	177	97.9 Å²	97.9	67%	0.67	49%	0.492	S	S	*	.	H	α-helix	trans	-69.9	-42.1	173.3	-134.7	93.4	0	0	0	111.3	S454 E455 I456 F461 T462	S454-W458 WeakPolarHBondContact O-CB 3.13Å; S454-W458 PolarHBondContact O-N 2.69Å; E455-W458 PolarHBondContact O-N 3.14Å; I456-W458 VanDerWaalsContact C-N 3.33Å; I456-W458 PolarHBondContact O-N 3.48Å; W458-F461 PolarHBondContact O-N 2.85Å; W458-T462 HydrophobicContact CZ3-CG2 4.39Å; W458-T462 VanDerWaalsContact CZ3-OG1 3.22Å; W458-T462 WeakPolarHBondContact CZ3-OG1 3.47Å; W458-T462 WeakPolarHBondContact O-CB 3.41Å; W458-T462 PolarHBondContact O-N 3.18Å; W458-T462 PolarHBondContact O-OG1 3Å
459	N	75	Confident	69.8	Low	92 Å²	92	97.7 Å²	97.7	49%	0.492	48%	0.484	S	S	.	.	H	α-helix	trans	-62.7	-45.3	174.2	-99.7	-19.9	0	0	0	111.5	E455 I456 F461 T462 Q463	E455-N459 VanDerWaalsContact O-CB 3.31Å; E455-N459 WeakPolarHBondContact O-CB 3.22Å; E455-N459 PolarHBondContact O-N 3.26Å; I456-N459 PolarHBondContact O-N 3.31Å; N459-F461 VanDerWaalsContact C-N 3.33Å; N459-F461 PolarHBondContact O-N 2.83Å; N459-T462 PolarHBondContact O-N 3.24Å; N459-Q463 VanDerWaalsContact O-CB 3.29Å; N459-Q463 WeakPolarHBondContact O-CB 3.14Å; N459-Q463 PolarHBondContact O-N 3.14Å
460	D	75.3	Confident	72.1	Confident	96 Å²	96	94.2 Å²	94.2	51%	0.513	47%	0.471	S	S	.	.	H	α-helix	trans	-61.3	-43.2	175.9	-80.1	-13.6	0	0	0	111.2	I456 Q463 W464	I456-D460 WeakPolarHBondContact O-CB 3.07Å; I456-D460 PolarHBondContact O-N 3.21Å; D460-Q463 PolarHBondContact O-N 3.11Å; D460-W464 VanDerWaalsContact O-CB 3.26Å; D460-W464 WeakPolarHBondContact O-CB 3.22Å; D460-W464 PolarHBondContact O-N 3.41Å
461	F	78.2	Confident	74.2	Confident	116 Å²	116	95 Å²	95	51%	0.509	47%	0.465	S	S	.	.	H	α-helix	trans	-62.4	-45.8	174.7	177.6	-101.6	0	0	0	111.2	T457 W458 N459 Q463 W464 T465	T457-F461 WeakPolarHBondContact O-CB 3.19Å; T457-F461 PolarHBondContact O-N 3.46Å; W458-F461 PolarHBondContact O-N 2.85Å; N459-F461 VanDerWaalsContact C-N 3.33Å; N459-F461 PolarHBondContact O-N 2.83Å; F461-Q463 PolarHBondContact O-N 2.85Å; F461-W464 HydrophobicContact CE2-CE3 4.45Å; F461-W464 HydrophobicContact CE2-CZ3 4.49Å; F461-W464 PolarHBondContact O-N 2.74Å; F461-T465 WeakPolarHBondContact O-CB 3.33Å; F461-T465 PolarHBondContact O-N 2.83Å; F461-T465 PolarHBondContact O-OG1 2.96Å
462	T	79.6	Confident	76.1	Confident	42 Å²	42	93.4 Å²	93.4	26%	0.258	46%	0.463	S	S	.	.	H	α-helix	trans	-62.7	-45.1	-179.9	-45.9	0	0	0	0	110.8	W458 N459 T465 E466	W458-T462 HydrophobicContact CZ3-CG2 4.39Å; W458-T462 VanDerWaalsContact CZ3-OG1 3.22Å; W458-T462 WeakPolarHBondContact CZ3-OG1 3.47Å; W458-T462 WeakPolarHBondContact O-CB 3.41Å; W458-T462 PolarHBondContact O-N 3.18Å; W458-T462 PolarHBondContact O-OG1 3Å; N459-T462 PolarHBondContact O-N 3.24Å; T462-T465 PolarHBondContact O-N 2.76Å; T462-T465 VanDerWaalsContact O-N 3.17Å; T462-E466 WeakPolarHBondContact O-CG 3.04Å; T462-E466 PolarHBondContact O-N 2.57Å
463	Q	81.8	Confident	77.8	Confident	117 Å²	117	97.5 Å²	97.5	55%	0.547	48%	0.481	S	S	.	.	H	α-helix	trans	-66.3	-38.8	177.9	-162.5	177.7	18.5	0	0	112.1	N459 D460 F461 T465 N467	N459-Q463 VanDerWaalsContact O-CB 3.29Å; N459-Q463 WeakPolarHBondContact O-CB 3.14Å; N459-Q463 PolarHBondContact O-N 3.14Å; D460-Q463 PolarHBondContact O-N 3.11Å; F461-Q463 PolarHBondContact O-N 2.85Å; Q463-T465 VanDerWaalsContact C-N 3.33Å; Q463-N467 WeakPolarHBondContact O-CB 3.38Å; Q463-N467 PolarHBondContact O-N 3.32Å; Q463-N467 PolarHBondContact O-ND2 3.37Å
464	W	82.7	Confident	79.3	Confident	172 Å²	172	99.6 Å²	99.6	65%	0.652	49%	0.492	S	S	*	.	H	α-helix	trans	-62.5	-41.6	171.5	177.9	86.3	0	0	0	111.5	D460 F461 N467 A468	D460-W464 VanDerWaalsContact O-CB 3.26Å; D460-W464 WeakPolarHBondContact O-CB 3.22Å; D460-W464 PolarHBondContact O-N 3.41Å; F461-W464 HydrophobicContact CE2-CE3 4.45Å; F461-W464 HydrophobicContact CE2-CZ3 4.49Å; F461-W464 PolarHBondContact O-N 2.74Å; W464-N467 PolarHBondContact O-N 3.01Å; W464-A468 WeakPolarHBondContact O-CB 3.09Å; W464-A468 PolarHBondContact O-N 3.34Å
465	T	81.5	Confident	80.9	Confident	37 Å²	37	104.8 Å²	104.8	23%	0.227	51%	0.505	C	S	.	.	H	α-helix	trans	-69	-41.4	-178.7	-39.4	0	0	0	0	111.1	F461 T462 Q463 A468 M469	F461-T465 WeakPolarHBondContact O-CB 3.33Å; F461-T465 PolarHBondContact O-N 2.83Å; F461-T465 PolarHBondContact O-OG1 2.96Å; T462-T465 PolarHBondContact O-N 2.76Å; T462-T465 VanDerWaalsContact O-N 3.17Å; Q463-T465 VanDerWaalsContact C-N 3.33Å; T465-A468 PolarHBondContact O-N 3.02Å; T465-M469 HydrophobicContact CG2-CE 4Å; T465-M469 WeakPolarHBondContact O-CB 3.37Å; T465-M469 WeakPolarHBondContact O-CG 3.37Å; T465-M469 PolarHBondContact O-N 3.18Å
466	E	84.4	Confident	82.3	Confident	131 Å²	131	105.7 Å²	105.7	61%	0.612	51%	0.511	S	S	*	.	H	α-helix	trans	-60.1	-46.1	172.8	-77	-170.6	161.4	0	0	111.6	T462 M469 L470	T462-E466 WeakPolarHBondContact O-CG 3.04Å; T462-E466 PolarHBondContact O-N 2.57Å; E466-M469 PolarHBondContact O-N 2.79Å; E466-L470 WeakPolarHBondContact O-CB 3.49Å; E466-L470 PolarHBondContact O-N 2.88Å
467	N	85.4	Confident	83.7	Confident	74 Å²	74	103.9 Å²	103.9	40%	0.396	51%	0.51	S	S	.	.	H	α-helix	trans	-62.9	-44.3	176.1	-78.5	-32.9	0	0	0	111.7	Q463 W464 M469 L470 Y471	Q463-N467 WeakPolarHBondContact O-CB 3.38Å; Q463-N467 PolarHBondContact O-N 3.32Å; Q463-N467 PolarHBondContact O-ND2 3.37Å; W464-N467 PolarHBondContact O-N 3.01Å; N467-M469 VanDerWaalsContact C-N 3.33Å; N467-M469 PolarHBondContact O-N 3.16Å; N467-L470 PolarHBondContact O-N 3.49Å; N467-Y471 HydrophobicContact CB-CD2 4.39Å; N467-Y471 HydrophobicContact CB-CE2 4.2Å; N467-Y471 WeakPolarHBondContact O-CB 3.35Å; N467-Y471 WeakPolarHBondContact O-CD2 3.18Å; N467-Y471 PolarHBondContact O-N 3.4Å
468	A	85.5	Confident	84.9	Confident	35 Å²	35	107 Å²	107	29%	0.289	52%	0.517	S	S	.	.	H	α-helix	trans	-61	-42.1	177.7	0	0	0	0	0	111.6	W464 T465 Y471 T472	W464-A468 WeakPolarHBondContact O-CB 3.09Å; W464-A468 PolarHBondContact O-N 3.34Å; T465-A468 PolarHBondContact O-N 3.02Å; A468-Y471 PolarHBondContact O-N 3.08Å; A468-T472 PolarHBondContact O-N 2.77Å; A468-T472 PolarHBondContact O-OG1 3.49Å
469	M	88.2	Confident	85.9	Confident	118 Å²	118	100.9 Å²	100.9	58%	0.581	50%	0.499	S	S	*	.	H	α-helix	trans	-65.1	-40.8	174.1	-73.2	-156	-128.8	0	0	112.2	T465 E466 N467 T472 L473	T465-M469 HydrophobicContact CG2-CE 4Å; T465-M469 WeakPolarHBondContact O-CB 3.37Å; T465-M469 WeakPolarHBondContact O-CG 3.37Å; T465-M469 PolarHBondContact O-N 3.18Å; E466-M469 PolarHBondContact O-N 2.79Å; N467-M469 VanDerWaalsContact C-N 3.33Å; N467-M469 PolarHBondContact O-N 3.16Å; M469-T472 VanDerWaalsContact CA-OG1 3.29Å; M469-T472 WeakPolarHBondContact CA-OG1 3.5Å; M469-T472 PolarHBondContact O-N 3.14Å; M469-T472 PolarHBondContact O-OG1 3.46Å; M469-T472 VanDerWaalsContact O-OG1 3.09Å; M469-L473 WeakPolarHBondContact O-CB 3.36Å; M469-L473 WeakPolarHBondContact O-CG 3.22Å; M469-L473 PolarHBondContact O-N 3.4Å
470	L	91	Very high	86.6	Confident	99 Å²	99	99.2 Å²	99.2	52%	0.518	50%	0.498	S	S	.	.	H	α-helix	trans	-63.6	-44.8	176.1	-162.9	85.8	0	0	0	111.4	E466 N467 L473 L474	E466-L470 WeakPolarHBondContact O-CB 3.49Å; E466-L470 PolarHBondContact O-N 2.88Å; N467-L470 PolarHBondContact O-N 3.49Å; L470-L473 PolarHBondContact O-N 2.86Å; L470-L474 WeakPolarHBondContact O-CB 3.23Å; L470-L474 WeakPolarHBondContact O-CG 3.09Å; L470-L474 PolarHBondContact O-N 3.22Å
471	Y	88.6	Confident	87.4	Confident	158 Å²	158	99.7 Å²	99.7	62%	0.62	50%	0.499	S	S	*	.	H	α-helix	trans	-64.9	-39.8	177.2	-75.6	-57.7	0	0	0	112.2	N467 A468 L474 Y475	N467-Y471 HydrophobicContact CB-CD2 4.39Å; N467-Y471 HydrophobicContact CB-CE2 4.2Å; N467-Y471 WeakPolarHBondContact O-CB 3.35Å; N467-Y471 WeakPolarHBondContact O-CD2 3.18Å; N467-Y471 PolarHBondContact O-N 3.4Å; A468-Y471 PolarHBondContact O-N 3.08Å; Y471-L474 PolarHBondContact O-N 2.8Å; Y471-Y475 VanDerWaalsContact O-CB 3.27Å; Y471-Y475 WeakPolarHBondContact O-CB 3.33Å; Y471-Y475 PolarHBondContact O-N 3.29Å
472	T	88.1	Confident	87.9	Confident	82 Å²	82	98.4 Å²	98.4	50%	0.503	50%	0.497	S	S	.	.	H	α-helix	trans	-66.9	-38.5	175	28.5	0	0	0	0	111.9	A468 M469 Y475 M476	A468-T472 PolarHBondContact O-N 2.77Å; A468-T472 PolarHBondContact O-OG1 3.49Å; M469-T472 VanDerWaalsContact CA-OG1 3.29Å; M469-T472 WeakPolarHBondContact CA-OG1 3.5Å; M469-T472 PolarHBondContact O-N 3.14Å; M469-T472 PolarHBondContact O-OG1 3.46Å; M469-T472 VanDerWaalsContact O-OG1 3.09Å; T472-Y475 PolarHBondContact O-N 3.06Å; T472-M476 WeakPolarHBondContact O-CB 3.4Å; T472-M476 WeakPolarHBondContact O-CG 2.84Å; T472-M476 PolarHBondContact O-N 3.38Å
473	L	91.6	Very high	88.2	Confident	125 Å²	125	101.4 Å²	101.4	65%	0.654	51%	0.511	S	S	*	.	H	α-helix	trans	-64.7	-43.2	173.4	-76.1	170.4	0	0	0	112.4	M469 L470 M476 G477	M469-L473 WeakPolarHBondContact O-CB 3.36Å; M469-L473 WeakPolarHBondContact O-CG 3.22Å; M469-L473 PolarHBondContact O-N 3.4Å; L470-L473 PolarHBondContact O-N 2.86Å; L473-M476 PolarHBondContact O-N 3.34Å; L473-G477 PolarHBondContact O-N 3.28Å
474	L	92	Very high	88.5	Confident	111 Å²	111	103.2 Å²	103.2	58%	0.581	52%	0.517	S	S	*	.	H	α-helix	trans	-61.8	-43.8	174.1	-78.3	170.9	0	0	0	111.4	L470 Y471 G477 F478	L470-L474 WeakPolarHBondContact O-CB 3.23Å; L470-L474 WeakPolarHBondContact O-CG 3.09Å; L470-L474 PolarHBondContact O-N 3.22Å; Y471-L474 PolarHBondContact O-N 2.8Å; L474-G477 PolarHBondContact O-N 3.45Å; L474-F478 WeakPolarHBondContact O-CB 3.11Å; L474-F478 PolarHBondContact O-N 3.26Å
475	Y	90.3	Very high	88.6	Confident	161 Å²	161	99.1 Å²	99.1	63%	0.631	51%	0.507	S	S	*	.	H	α-helix	trans	-62.5	-48.2	176.9	179.4	-99.5	0	0	0	111.7	Y471 T472 G477 F478 V479	Y471-Y475 VanDerWaalsContact O-CB 3.27Å; Y471-Y475 WeakPolarHBondContact O-CB 3.33Å; Y471-Y475 PolarHBondContact O-N 3.29Å; T472-Y475 PolarHBondContact O-N 3.06Å; Y475-G477 VanDerWaalsContact C-N 3.29Å; Y475-G477 PolarHBondContact O-N 3.31Å; Y475-F478 PolarHBondContact O-N 3.47Å; Y475-F478 VanDerWaalsContact O-N 3.14Å; Y475-V479 HydrophobicContact CD1-CG2 4.19Å; Y475-V479 HydrophobicContact CE1-CG2 3.79Å; Y475-V479 HydrophobicContact CE2-CG2 4.19Å; Y475-V479 WeakPolarHBondContact O-CG2 3.28Å; Y475-V479 PolarHBondContact O-N 3.29Å
476	M	91	Very high	88.6	Confident	128 Å²	128	102.2 Å²	102.2	63%	0.631	52%	0.522	S	S	*	.	H	α-helix	trans	-59.7	-40.3	175.5	-72.6	-72.8	-78.7	0	0	111.6	T472 L473 A480	T472-M476 WeakPolarHBondContact O-CB 3.4Å; T472-M476 WeakPolarHBondContact O-CG 2.84Å; T472-M476 PolarHBondContact O-N 3.38Å; L473-M476 PolarHBondContact O-N 3.34Å; M476-A480 WeakPolarHBondContact O-CB 3.49Å; M476-A480 PolarHBondContact O-N 3.07Å
477	G	91.9	Very high	88.3	Confident	33 Å²	33	101.3 Å²	101.3	34%	0.34	52%	0.521	S	S	.	.	H	α-helix	trans	-62.6	-43.9	173.2	0	0	0	0	0	112.7	L473 L474 Y475 A480 I481	L473-G477 PolarHBondContact O-N 3.28Å; L474-G477 PolarHBondContact O-N 3.45Å; Y475-G477 VanDerWaalsContact C-N 3.29Å; Y475-G477 PolarHBondContact O-N 3.31Å; G477-A480 PolarHBondContact O-N 3.3Å; G477-I481 WeakPolarHBondContact O-CG1 3.45Å; G477-I481 PolarHBondContact O-N 3.11Å
478	F	92.2	Very high	88	Confident	143 Å²	143	103 Å²	103	63%	0.627	53%	0.53	S	S	*	.	H	α-helix	trans	-64.9	-43.8	178.2	-153.1	-86.4	0	0	0	111.5	L474 Y475 A480 I481 L482	L474-F478 WeakPolarHBondContact O-CB 3.11Å; L474-F478 PolarHBondContact O-N 3.26Å; Y475-F478 PolarHBondContact O-N 3.47Å; Y475-F478 VanDerWaalsContact O-N 3.14Å; F478-A480 VanDerWaalsContact C-N 3.34Å; F478-A480 PolarHBondContact O-N 3.46Å; F478-I481 PolarHBondContact O-N 2.88Å; F478-L482 HydrophobicContact CE1-CD1 4.49Å; F478-L482 WeakPolarHBondContact O-CB 3.32Å; F478-L482 PolarHBondContact O-N 2.96Å
479	V	90.2	Very high	87.4	Confident	49 Å²	49	108.1 Å²	108.1	30%	0.297	55%	0.546	S	S	.	.	H	α-helix	trans	-61.3	-42.9	174.6	172.3	0	0	0	0	110.8	Y475 I481 L482 L483	Y475-V479 HydrophobicContact CD1-CG2 4.19Å; Y475-V479 HydrophobicContact CE1-CG2 3.79Å; Y475-V479 HydrophobicContact CE2-CG2 4.19Å; Y475-V479 WeakPolarHBondContact O-CG2 3.28Å; Y475-V479 PolarHBondContact O-N 3.29Å; V479-I481 PolarHBondContact O-N 3.5Å; V479-L482 PolarHBondContact O-N 3.37Å; V479-L483 HydrophobicContact CG1-CD1 3.96Å; V479-L483 HydrophobicContact CG1-CG 4.41Å; V479-L483 WeakPolarHBondContact O-CB 3.45Å; V479-L483 VanDerWaalsContact O-CG 3.3Å; V479-L483 WeakPolarHBondContact O-CG 2.98Å; V479-L483 PolarHBondContact O-N 2.83Å
480	A	89.7	Confident	86.4	Confident	57 Å²	57	110 Å²	110	47%	0.471	55%	0.551	S	S	.	*	H	α-helix	trans	-63.1	-41.5	176.6	0	0	0	0	0	112.4	M476 G477 F478 K484	M476-A480 WeakPolarHBondContact O-CB 3.49Å; M476-A480 PolarHBondContact O-N 3.07Å; G477-A480 PolarHBondContact O-N 3.3Å; F478-A480 VanDerWaalsContact C-N 3.34Å; F478-A480 PolarHBondContact O-N 3.46Å; A480-K484 WeakPolarHBondContact O-CB 3.45Å; A480-K484 PolarHBondContact O-N 3.23Å
481	I	91.2	Very high	85.1	Confident	105 Å²	105	112.4 Å²	112.4	54%	0.538	56%	0.559	S	S	.	*	H	α-helix	trans	-64.4	-45.1	174.7	-69.2	163.6	0	0	0	110.7	G477 F478 V479 L483 K484 L485	G477-I481 WeakPolarHBondContact O-CG1 3.45Å; G477-I481 PolarHBondContact O-N 3.11Å; F478-I481 PolarHBondContact O-N 2.88Å; V479-I481 PolarHBondContact O-N 3.5Å; I481-L483 VanDerWaalsContact C-N 3.35Å; I481-L483 PolarHBondContact O-N 2.85Å; I481-K484 WeakPolarHBondContact O-CB 3.42Å; I481-K484 PolarHBondContact O-N 3.12Å; I481-K484 VanDerWaalsContact O-N 3.12Å; I481-L485 HydrophobicContact CG2-CD1 4.02Å; I481-L485 PolarHBondContact O-N 2.67Å
482	L	88.6	Confident	83.8	Confident	89 Å²	89	111.8 Å²	111.8	47%	0.466	56%	0.562	S	S	.	*	H	α-helix	trans	-60.4	-44.6	178.5	-161.3	94.3	0	0	0	111.1	F478 V479 K484 L485 L486	F478-L482 HydrophobicContact CE1-CD1 4.49Å; F478-L482 WeakPolarHBondContact O-CB 3.32Å; F478-L482 PolarHBondContact O-N 2.96Å; V479-L482 PolarHBondContact O-N 3.37Å; L482-K484 VanDerWaalsContact C-N 3.31Å; L482-K484 PolarHBondContact O-N 3.22Å; L482-L485 PolarHBondContact O-N 3.3Å; L482-L486 HydrophobicContact CD2-CD1 4.29Å; L482-L486 HydrophobicContact CG-CD1 4.46Å; L482-L486 WeakPolarHBondContact O-CB 3.3Å; L482-L486 WeakPolarHBondContact O-CG 3.46Å; L482-L486 PolarHBondContact O-N 3.45Å
483	L	86.6	Confident	82.2	Confident	105 Å²	105	116.3 Å²	116.3	55%	0.55	57%	0.571	S	S	.	*	H	α-helix	trans	-61.8	-38.5	174.8	-74.1	169.2	0	0	0	111.7	V479 I481 L486 N487	V479-L483 HydrophobicContact CG1-CD1 3.96Å; V479-L483 HydrophobicContact CG1-CG 4.41Å; V479-L483 WeakPolarHBondContact O-CB 3.45Å; V479-L483 VanDerWaalsContact O-CG 3.3Å; V479-L483 WeakPolarHBondContact O-CG 2.98Å; V479-L483 PolarHBondContact O-N 2.83Å; I481-L483 VanDerWaalsContact C-N 3.35Å; I481-L483 PolarHBondContact O-N 2.85Å; L483-L486 PolarHBondContact O-N 3.44Å; L483-N487 WeakPolarHBondContact O-CB 2.85Å; L483-N487 PolarHBondContact O-N 3.44Å
484	K	88.7	Confident	80.3	Confident	156 Å²	156	114.2 Å²	114.2	68%	0.678	57%	0.566	S	S	*	*	H	α-helix	trans	-67.1	-41.2	176.4	-139.6	178.6	-173	-178.4	0	112	A480 I481 L482 N487 L488	A480-K484 WeakPolarHBondContact O-CB 3.45Å; A480-K484 PolarHBondContact O-N 3.23Å; I481-K484 WeakPolarHBondContact O-CB 3.42Å; I481-K484 PolarHBondContact O-N 3.12Å; I481-K484 VanDerWaalsContact O-N 3.12Å; L482-K484 VanDerWaalsContact C-N 3.31Å; L482-K484 PolarHBondContact O-N 3.22Å; K484-N487 PolarHBondContact O-N 3.31Å; K484-L488 PolarHBondContact O-N 3Å
485	L	84.4	Confident	78.5	Confident	85 Å²	85	114.2 Å²	114.2	45%	0.445	57%	0.567	S	S	.	*	H	α-helix	trans	-65	-44.7	174.3	-80.7	166.2	0	0	0	111.6	I481 L482 N487 L488 F489	I481-L485 HydrophobicContact CG2-CD1 4.02Å; I481-L485 PolarHBondContact O-N 2.67Å; L482-L485 PolarHBondContact O-N 3.3Å; L485-N487 VanDerWaalsContact C-N 3.25Å; L485-N487 PolarHBondContact O-N 3.49Å; L485-L488 WeakPolarHBondContact O-CB 3.1Å; L485-L488 PolarHBondContact O-N 3.15Å; L485-L488 VanDerWaalsContact O-N 3.14Å; L485-F489 WeakPolarHBondContact O-CD2 3Å; L485-F489 PolarHBondContact O-N 3.39Å
486	L	80.7	Confident	76.7	Confident	103 Å²	103	110 Å²	110	54%	0.539	56%	0.562	S	S	.	*	H	α-helix	trans	-59.1	-38.6	174	-76	167.7	0	0	0	111.4	L482 L483 F489 K490	L482-L486 HydrophobicContact CD2-CD1 4.29Å; L482-L486 HydrophobicContact CG-CD1 4.46Å; L482-L486 WeakPolarHBondContact O-CB 3.3Å; L482-L486 WeakPolarHBondContact O-CG 3.46Å; L482-L486 PolarHBondContact O-N 3.45Å; L483-L486 PolarHBondContact O-N 3.44Å; L486-F489 PolarHBondContact O-N 3.29Å; L486-K490 WeakPolarHBondContact O-CB 3.34Å; L486-K490 PolarHBondContact O-N 2.93Å
487	N	77.9	Confident	74.8	Confident	111 Å²	111	110.1 Å²	110.1	59%	0.594	56%	0.564	S	S	*	*	H	α-helix	trans	-67.5	-39.3	174.7	-118.3	-9.2	0	0	0	112.7	L483 K484 L485 K490 H491	L483-N487 WeakPolarHBondContact O-CB 2.85Å; L483-N487 PolarHBondContact O-N 3.44Å; K484-N487 PolarHBondContact O-N 3.31Å; L485-N487 VanDerWaalsContact C-N 3.25Å; L485-N487 PolarHBondContact O-N 3.49Å; N487-K490 PolarHBondContact O-N 3.4Å; N487-H491 PolarHBondContact O-N 3.06Å
488	L	79.5	Confident	72.7	Confident	109 Å²	109	116.6 Å²	116.6	57%	0.571	58%	0.583	S	S	*	*	H	α-helix	trans	-64.3	-43.9	173.8	-83.4	162.1	0	0	0	111.9	K484 L485 K490 H491 H492	K484-L488 PolarHBondContact O-N 3Å; L485-L488 WeakPolarHBondContact O-CB 3.1Å; L485-L488 PolarHBondContact O-N 3.15Å; L485-L488 VanDerWaalsContact O-N 3.14Å; L488-K490 VanDerWaalsContact C-N 3.32Å; L488-K490 PolarHBondContact O-N 3.39Å; L488-H491 PolarHBondContact O-N 2.67Å; L488-H491 VanDerWaalsContact O-N 3.16Å; L488-H492 PolarHBondContact O-N 2.79Å
489	F	72.3	Confident	70.6	Confident	143 Å²	143	119.4 Å²	119.4	63%	0.627	60%	0.595	S	S	*	*	H	α-helix	trans	-61.9	-41.2	174.4	-92.2	-77.8	0	0	0	111.5	L485 L486 H491 H492 Y493	L485-F489 WeakPolarHBondContact O-CD2 3Å; L485-F489 PolarHBondContact O-N 3.39Å; L486-F489 PolarHBondContact O-N 3.29Å; F489-H491 VanDerWaalsContact C-N 3.27Å; F489-H491 PolarHBondContact O-N 3.46Å; F489-H492 PolarHBondContact O-N 2.57Å; F489-Y493 WeakPolarHBondContact O-CB 3.33Å; F489-Y493 PolarHBondContact O-N 3.35Å
490	K	68.3	Low	68.2	Low	159 Å²	159	127.5 Å²	127.5	69%	0.691	64%	0.636	S	S	*	*	H	α-helix	trans	-61.2	-37.3	174.7	-164.3	174.9	-175.9	179.5	0	111.8	L486 N487 L488 S494	L486-K490 WeakPolarHBondContact O-CB 3.34Å; L486-K490 PolarHBondContact O-N 2.93Å; N487-K490 PolarHBondContact O-N 3.4Å; L488-K490 VanDerWaalsContact C-N 3.32Å; L488-K490 PolarHBondContact O-N 3.39Å; K490-S494 PolarHBondContact O-N 3.01Å
491	H	64.4	Low	67.1	Low	149 Å²	149	131.1 Å²	131.1	69%	0.69	64%	0.644	S	S	*	*	H	α-helix	trans	-70.6	-41.6	176.5	-127.3	-40.8	0	0	0	112.8	N487 L488 F489 S494	N487-H491 PolarHBondContact O-N 3.06Å; L488-H491 PolarHBondContact O-N 2.67Å; L488-H491 VanDerWaalsContact O-N 3.16Å; F489-H491 VanDerWaalsContact C-N 3.27Å; F489-H491 PolarHBondContact O-N 3.46Å; H491-S494 PolarHBondContact O-N 3.21Å
492	H	61.2	Low	65.8	Low	145 Å²	145	132.4 Å²	132.4	67%	0.671	65%	0.65	S	S	*	*	H	α-helix	trans	-74.7	-31.2	-179	-125	-54.7	0	0	0	113.2	L488 F489 S494 S496	L488-H492 PolarHBondContact O-N 2.79Å; F489-H492 PolarHBondContact O-N 2.57Å; H492-S494 VanDerWaalsContact C-N 3.35Å; H492-S496 PolarHBondContact O-OG 3.18Å
493	Y	53.5	Low	64.6	Low	176 Å²	176	134.8 Å²	134.8	69%	0.69	66%	0.66	S	S	*	*	H	α-helix	trans	-72	-30.4	173.2	-129.1	-90.9	0	0	0	112	F489 D495 S496	F489-Y493 WeakPolarHBondContact O-CB 3.33Å; F489-Y493 PolarHBondContact O-N 3.35Å; Y493-D495 VanDerWaalsContact C-N 3.28Å; Y493-D495 PolarHBondContact O-N 3.15Å; Y493-S496 PolarHBondContact O-N 3.43Å
494	S	52.5	Low	63.3	Low	81 Å²	81	136.6 Å²	136.6	57%	0.566	67%	0.666	S	S	*	*	H	α-helix	trans	-69.7	-23.8	177.9	-160.4	0	0	0	0	113.4	K490 H491 H492	K490-S494 PolarHBondContact O-N 3.01Å; H491-S494 PolarHBondContact O-N 3.21Å; H492-S494 VanDerWaalsContact C-N 3.35Å
495	D	54.2	Low	61.7	Low	111 Å²	111	135.4 Å²	135.4	59%	0.594	67%	0.666	S	S	*	*	H	α-helix	trans	-87.1	-21.2	177.4	-118.3	3.4	0	0	0	113.1	Y493 N497 K498	Y493-D495 VanDerWaalsContact C-N 3.28Å; Y493-D495 PolarHBondContact O-N 3.15Å; D495-N497 PolarHBondContact O-N 3.06Å; D495-K498 PolarHBondContact O-N 2.75Å; D495-K498 VanDerWaalsContact O-N 3.14Å
496	S	52.4	Low	60.2	Low	74 Å²	74	138.7 Å²	138.7	52%	0.517	68%	0.68	S	S	.	*	H	α-helix	trans	-69.9	-23	176.2	-58.3	0	0	0	0	112.4	H492 Y493 K498	H492-S496 PolarHBondContact O-OG 3.18Å; Y493-S496 PolarHBondContact O-N 3.43Å; S496-K498 VanDerWaalsContact C-N 3.29Å; S496-K498 PolarHBondContact O-N 3.37Å
497	N	49.6	Very low	58.7	Low	129 Å²	129	141.3 Å²	141.3	69%	0.69	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.6	7.4	172.6	-91.3	-2.4	0	0	0	114.5	D495	D495-N497 PolarHBondContact O-N 3.06Å
498	K	49.5	Very low	57.3	Low	170 Å²	170	143.6 Å²	143.6	74%	0.739	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.5	0.6	172	-84.9	-175.4	177.3	176	0	114.5	D495 S496	D495-K498 PolarHBondContact O-N 2.75Å; D495-K498 VanDerWaalsContact O-N 3.14Å; S496-K498 VanDerWaalsContact C-N 3.29Å; S496-K498 PolarHBondContact O-N 3.37Å
499	K	46.9	Very low	55.4	Low	201 Å²	201	146.5 Å²	146.5	87%	0.874	71%	0.709	S	S	*	*			trans	-112.9	7.8	175.6	-86.6	-172.3	176.9	179.5	0	114.9
500	L	40.1	Very low	53.9	Low	220 Å²	220	146.8 Å²	146.8	100%	1.152	72%	0.716	S	S	*	*			trans	-105.5	0	157.2	-139.1	86.4	0	0	0	107.8

Retrieved 500 of 500 residues in 88.6 ms (Link to these results)

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