A0A3Q0KPU4_SCHMA Loading...

phenylalanine--tRNA ligase

AlphaFold DB , UniProt , Accession A0A3Q0KPU4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 499 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	32.4	Very low	27.9	Very low	252 Å²	252	179.9 Å²	179.9	100%	1.241	88%	0.878	S	S	*	*				0	127.6	0	-118.9	167.5	177	0	0	107.2
2	R	32.2	Very low	27.6	Very low	231 Å²	231	178.3 Å²	178.3	87%	0.872	88%	0.875	S	S	*	*			trans	-63.9	129.6	-157.4	-66.6	174.7	176.9	177.9	-2	114.2
3	L	30.5	Very low	27.3	Very low	176 Å²	176	181.6 Å²	181.6	92%	0.921	88%	0.882	S	S	*	*			trans	-132.8	100.7	145.1	-86	166.4	0	0	0	107.1
4	N	28.5	Very low	27	Very low	149 Å²	149	185.1 Å²	185.1	80%	0.797	88%	0.882	S	S	*	*			trans	-82.6	122.7	171.2	-84.9	-24.2	0	0	0	108.2
5	L	30.1	Very low	26.8	Very low	168 Å²	168	180.5 Å²	180.5	88%	0.88	88%	0.877	S	S	*	*			trans	-113.9	114.7	162.4	-80.9	164.6	0	0	0	108.7
6	C	23.8	Very low	26.9	Very low	119 Å²	119	176.3 Å²	176.3	80%	0.804	87%	0.871	S	S	*	*			trans	9.1	125.5	157.7	-92.9	0	0	0	0	119.9
7	P	27.8	Very low	26.7	Very low	124 Å²	124	173.6 Å²	173.6	81%	0.805	87%	0.872	S	S	*	*			trans	-122.8	99	143.8	32.5	-16.8	0	0	0	110.4
8	C	24.3	Very low	26.9	Very low	107 Å²	107	171.9 Å²	171.9	72%	0.723	86%	0.864	S	S	*	*			trans	-125.1	88.5	165.7	-81.9	0	0	0	0	109
9	Y	25.4	Very low	27	Very low	243 Å²	243	171.4 Å²	171.4	95%	0.953	86%	0.859	S	S	*	*			trans	-135.9	88.5	149.2	-111.4	-87.5	0	0	0	107
10	F	27.8	Very low	26.9	Very low	188 Å²	188	169.3 Å²	169.3	83%	0.825	86%	0.857	S	S	*	*			trans	-85.9	137.3	176.7	-119.4	-93.8	0	0	0	109.5
11	R	24	Very low	27	Very low	222 Å²	222	169.8 Å²	169.8	84%	0.838	86%	0.856	S	S	*	*			trans	-26.3	141.4	157.1	-70.1	168.2	167.5	174.8	-3.9	113.9
12	L	24.9	Very low	26.7	Very low	160 Å²	160	168.3 Å²	168.3	84%	0.838	84%	0.837	S	S	*	*				-173.2	108.2	128.5	-97.9	164.9	0	0	0	108.8
13	F	23.3	Very low	26.4	Very low	222 Å²	222	165.9 Å²	165.9	97%	0.974	84%	0.84	S	S	*	*			trans	-159.8	98.7	136.9	-97	-69.6	0	0	0	107.8
14	R	23.7	Very low	26.2	Very low	231 Å²	231	164.2 Å²	164.2	87%	0.872	83%	0.832	S	S	*	*			trans	-131.4	123.7	157.6	-101.3	-169.3	178.4	-167.8	-0.2	107.7
15	S	24	Very low	26	Very low	116 Å²	116	165 Å²	165	81%	0.811	84%	0.836	S	S	*	*			trans	59.9	104.3	142.6	-53.2	0	0	0	0	118.9
16	S	28.3	Very low	25.8	Very low	112 Å²	112	162.2 Å²	162.2	78%	0.783	83%	0.826	S	S	*	*			trans	-129	110.2	144.3	54.2	0	0	0	0	109.1
17	C	22.2	Very low	25.9	Very low	131 Å²	131	166.1 Å²	166.1	89%	0.885	83%	0.829	S	S	*	*			trans	-67.9	118.2	163.6	-74.1	0	0	0	0	109.4
18	I	31.5	Very low	25.7	Very low	143 Å²	143	168.3 Å²	168.3	73%	0.733	83%	0.829	S	S	*	*			trans	-141.5	109.8	156.8	-60.3	-175.8	0	0	0	109
19	Q	28.2	Very low	25.7	Very low	163 Å²	163	167.6 Å²	167.6	76%	0.762	83%	0.825	S	S	*	*			trans	64.2	138.9	150.8	-65.2	-172.9	-11.1	0	0	122.4	H21	Q19-H21 PolarHBondContact O-N 3.16Å
20	P	24.5	Very low	25.7	Very low	128 Å²	128	163.9 Å²	163.9	83%	0.831	82%	0.82	S	S	*	*			trans	-79.6	105.1	176.4	33.2	-29.3	0	0	0	109	R22	P20-R22 PolarHBondContact O-N 2.87Å
21	H	29.2	Very low	25.6	Very low	180 Å²	180	162.6 Å²	162.6	83%	0.833	82%	0.817	S	S	*	*			trans	-70.2	121.1	166.2	-91.3	-73.1	0	0	0	109.5	Q19 L23	Q19-H21 PolarHBondContact O-N 3.16Å; H21-L23 PolarHBondContact O-N 2.84Å
22	R	27.4	Very low	25.7	Very low	221 Å²	221	159 Å²	159	83%	0.834	81%	0.814	S	S	*	*			trans	-24.1	124.5	167	-74.9	172.9	171	174	-3.8	112.8	P20 L24	P20-R22 PolarHBondContact O-N 2.87Å; R22-L24 PolarHBondContact O-N 2.72Å
23	L	25	Very low	25.9	Very low	181 Å²	181	156.9 Å²	156.9	95%	0.948	81%	0.807	S	S	*	*			trans	-54.7	85.1	153.3	-75.8	158	0	0	0	108.7	H21 N25	H21-L23 PolarHBondContact O-N 2.84Å; L23-N25 PolarHBondContact O-N 3.31Å
24	L	26.6	Very low	26.2	Very low	141 Å²	141	151.9 Å²	151.9	74%	0.738	80%	0.795	S	S	*	*			trans	-77.1	109.3	159.6	-84.4	161.1	0	0	0	106.1	R22 T26	R22-L24 PolarHBondContact O-N 2.72Å; L24-T26 PolarHBondContact O-N 3.15Å
25	N	25	Very low	27	Very low	166 Å²	166	143.9 Å²	143.9	89%	0.888	77%	0.768	S	S	*	*			trans	-55.4	77	160.3	-104.1	-23.7	0	0	0	109.2	L23 K27	L23-N25 PolarHBondContact O-N 3.31Å; N25-K27 PolarHBondContact O-N 2.9Å
26	T	24.4	Very low	27.8	Very low	108 Å²	108	143.9 Å²	143.9	66%	0.663	76%	0.758	S	S	*	*			trans	-87.9	96.3	155.2	41.4	0	0	0	0	106	L24 Q28	L24-T26 PolarHBondContact O-N 3.15Å; T26-Q28 PolarHBondContact O-N 3.21Å
27	K	26.1	Very low	28.9	Very low	201 Å²	201	144.3 Å²	144.3	87%	0.874	76%	0.758	S	S	*	*			trans	-54.9	81.6	146.7	-77.6	-177.2	174.2	-179.2	0	106.7	N25 S29	N25-K27 PolarHBondContact O-N 2.9Å; K27-S29 PolarHBondContact O-N 3.39Å
28	Q	25.1	Very low	30.5	Very low	171 Å²	171	143.8 Å²	143.8	80%	0.799	75%	0.751	S	S	*	*			trans	-66.5	93.1	152.1	-87.7	-179.4	-15.1	0	0	104	T26 L30	T26-Q28 PolarHBondContact O-N 3.21Å; Q28-L30 VanDerWaalsContact C-N 3.28Å; Q28-L30 PolarHBondContact O-N 3.35Å
29	S	24.1	Very low	32.3	Very low	91 Å²	91	139 Å²	139	64%	0.636	73%	0.73	S	S	*	*			trans	-48.4	105.2	155.6	48.5	0	0	0	0	106.2	K27 Q31	K27-S29 PolarHBondContact O-N 3.39Å; S29-Q31 PolarHBondContact O-N 2.73Å
30	L	25.2	Very low	35.1	Very low	165 Å²	165	134.4 Å²	134.4	86%	0.864	72%	0.717	S	S	*	*			trans	-52.8	88.9	145.6	-83	150.8	0	0	0	104.6	Q28 L32	Q28-L30 VanDerWaalsContact C-N 3.28Å; Q28-L30 PolarHBondContact O-N 3.35Å; L30-L32 PolarHBondContact O-N 3.29Å
31	Q	24.2	Very low	38.3	Very low	161 Å²	161	134.6 Å²	134.6	75%	0.752	70%	0.701	S	S	*	*			trans	-64.1	89.7	159.4	-85.3	-176.5	-26.8	0	0	104.1	S29 V33	S29-Q31 PolarHBondContact O-N 2.73Å; Q31-V33 PolarHBondContact O-N 3.22Å
32	L	26.9	Very low	41.3	Very low	148 Å²	148	126 Å²	126	78%	0.775	66%	0.661	S	S	*	*			trans	-50	96.3	145.4	-83.1	148.7	0	0	0	104.5	L30 T34	L30-L32 PolarHBondContact O-N 3.29Å; L32-T34 HydrophobicContact CB-CG2 4.44Å; L32-T34 PolarHBondContact O-N 3.03Å
33	V	29.4	Very low	44.5	Very low	115 Å²	115	118.2 Å²	118.2	70%	0.697	64%	0.641	S	S	*	*			trans	-66.3	81	162.4	-180	0	0	0	0	104.4	Q31 E35	Q31-V33 PolarHBondContact O-N 3.22Å; V33-E35 VanDerWaalsContact C-N 3.32Å; V33-E35 PolarHBondContact O-N 2.7Å
34	T	29.9	Very low	47.7	Very low	117 Å²	117	109.8 Å²	109.8	72%	0.718	60%	0.596	S	S	*	*			trans	-69	101.4	156.6	49.2	0	0	0	0	104.2	L32 N36	L32-T34 HydrophobicContact CB-CG2 4.44Å; L32-T34 PolarHBondContact O-N 3.03Å; T34-N36 PolarHBondContact O-N 3.44Å
35	E	39.1	Very low	50.6	Low	63 Å²	63	106.6 Å²	106.6	29%	0.294	59%	0.586	S	S	.	*			trans	-48.9	126.2	171	-88.9	-168.4	-176.7	0	0	108.2	V33 P37 V42 K51	V33-E35 VanDerWaalsContact C-N 3.32Å; V33-E35 PolarHBondContact O-N 2.7Å; E35-P37 WeakPolarHBondContact O-CD 3.41Å; E35-V42 WeakPolarHBondContact OE1-CA 3.48Å; E35-K51 IonicContact OE2-NZ 3.14Å; E35-K51 PolarHBondContact OE2-NZ 3.46Å; E35-K51 VanDerWaalsContact OE2-NZ 3.14Å
36	N	41.1	Very low	53.5	Low	116 Å²	116	102.2 Å²	102.2	62%	0.62	58%	0.58	S	S	*	*			trans	-59.1	120.8	161.3	-120.3	-18.1	0	0	0	105.6	T34 T38 S39	T34-N36 PolarHBondContact O-N 3.44Å; N36-T38 PolarHBondContact O-N 2.96Å; N36-S39 WeakPolarHBondContact O-CB 3.5Å; N36-S39 PolarHBondContact O-N 3.39Å
37	P	51.8	Low	56.7	Low	120 Å²	120	101 Å²	101	78%	0.779	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.2	-9.6	-178.8	21.3	-31.1	0	0	0	113.1	E35	E35-P37 WeakPolarHBondContact O-CD 3.41Å
38	T	56.3	Low	59.9	Low	120 Å²	120	94.8 Å²	94.8	74%	0.736	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	-4.3	174.2	54	0	0	0	0	114.8	N36 S40	N36-T38 PolarHBondContact O-N 2.96Å; T38-S40 PolarHBondContact O-N 3.04Å
39	S	69.2	Low	63	Low	42 Å²	42	87.6 Å²	87.6	29%	0.294	52%	0.516	S	S	.	.			trans	-66.6	121.6	176.1	174.5	0	0	0	0	109.9	N36 W41 K51	N36-S39 WeakPolarHBondContact O-CB 3.5Å; N36-S39 PolarHBondContact O-N 3.39Å; S39-W41 PolarHBondContact O-N 3.17Å; S39-W41 VanDerWaalsContact O-N 3.16Å; S39-W41 PolarHBondContact OG-N 2.86Å; S39-W41 PolarHBondContact OG-O 2.81Å; S39-K51 PolarHBondContact O-NZ 2.89Å; S39-K51 VanDerWaalsContact O-NZ 3.12Å
40	S	87.9	Confident	66.3	Low	68 Å²	68	86.5 Å²	86.5	48%	0.476	51%	0.505	S	S	.	.	S	Bend	trans	-66	-7.5	172	55.8	0	0	0	0	113.2	T38 V50 K51	T38-S40 PolarHBondContact O-N 3.04Å; S40-V50 CarbonylContact O-C 3.56Å; S40-V50 WeakPolarHBondContact O-CA 3.17Å; S40-K51 PolarHBondContact O-N 3.33Å
41	W	91.3	Very high	69.6	Low	131 Å²	131	80.7 Å²	80.7	50%	0.496	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	145.4	178.3	-63.9	84.5	0	0	0	111.3	S39 T49 V50 K51	S39-W41 PolarHBondContact O-N 3.17Å; S39-W41 VanDerWaalsContact O-N 3.16Å; S39-W41 PolarHBondContact OG-N 2.86Å; S39-W41 PolarHBondContact OG-O 2.81Å; W41-T49 WeakPolarHBondContact CA-O 3.27Å; W41-T49 VanDerWaalsContact CE3-C 3.42Å; W41-V50 HydrophobicContact CD2-CG2 3.94Å; W41-V50 HydrophobicContact CE3-CG2 3.81Å; W41-V50 HydrophobicContact CH2-CG2 3.35Å; W41-V50 HydrophobicContact CZ2-CG2 3.48Å; W41-V50 VanDerWaalsContact CZ2-CG2 3.48Å; W41-V50 HydrophobicContact CZ3-CG2 3.52Å; W41-K51 WeakPolarHBondContact O-CE 3.42Å; W41-K51 PolarHBondContact O-NZ 2.89Å
42	V	92.2	Very high	72.8	Confident	1 Å²	1	76 Å²	76	1%	0.006	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	141.1	164.8	58.4	0	0	0	0	108.9	E35 I44 S48 T49 K51 Y55 I62 L143	E35-V42 WeakPolarHBondContact OE1-CA 3.48Å; V42-I44 HydrophobicContact CG2-CD1 4.22Å; V42-I44 HydrophobicContact CG2-CG1 4.18Å; V42-S48 VanDerWaalsContact O-CA 3.31Å; V42-S48 WeakPolarHBondContact O-CA 3.44Å; V42-T49 VanDerWaalsContact CG1-OG1 3.29Å; V42-T49 WeakPolarHBondContact CG1-OG1 3.3Å; V42-T49 PolarHBondContact N-O 2.92Å; V42-T49 PolarHBondContact O-N 3.47Å; V42-K51 HydrophobicContact CB-CG 4.29Å; V42-K51 HydrophobicContact CG1-CG 4.24Å; V42-Y55 HydrophobicContact CB-CE2 4.04Å; V42-Y55 HydrophobicContact CG1-CD2 4.46Å; V42-Y55 HydrophobicContact CG1-CE2 4.02Å; V42-Y55 HydrophobicContact CG2-CE2 4.23Å; V42-I62 HydrophobicContact CG2-CD1 4.03Å; V42-L143 HydrophobicContact CG1-CB 4.24Å; V42-L143 HydrophobicContact CG1-CD2 4.07Å; V42-L143 HydrophobicContact CG1-CG 4.17Å
43	S	93	Very high	75.8	Confident	57 Å²	57	72 Å²	72	40%	0.399	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	122.9	177.6	-162.7	0	0	0	0	112	Q47 S48	S43-Q47 WeakPolarHBondContact CA-O 3.5Å; S43-S48 WeakPolarHBondContact CB-OG 3.25Å; S43-S48 PolarHBondContact OG-OG 3.35Å
44	I	93.9	Very high	78.8	Confident	3 Å²	3	68.4 Å²	68.4	2%	0.015	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	129.3	-179.4	-61.5	175.5	0	0	0	108.5	V42 G46 Q47 L57 I62 T65 V116 L143 L149	V42-I44 HydrophobicContact CG2-CD1 4.22Å; V42-I44 HydrophobicContact CG2-CG1 4.18Å; I44-G46 PolarHBondContact O-N 3.2Å; I44-G46 VanDerWaalsContact O-N 3.15Å; I44-Q47 PolarHBondContact N-O 3.22Å; I44-Q47 WeakPolarHBondContact O-CB 3.49Å; I44-Q47 PolarHBondContact O-N 3.1Å; I44-L57 HydrophobicContact CD1-CD2 3.51Å; I44-I62 HydrophobicContact CD1-CG1 4.36Å; I44-T65 HydrophobicContact CD1-CG2 4.47Å; I44-T65 HydrophobicContact CG2-CG2 3.99Å; I44-V116 HydrophobicContact CB-CG2 3.71Å; I44-V116 HydrophobicContact CG2-CG2 3.65Å; I44-L143 HydrophobicContact CD1-CD2 4.2Å; I44-L143 HydrophobicContact CD1-CG 4.5Å; I44-L149 HydrophobicContact CD1-CD2 4.01Å; I44-L149 HydrophobicContact CG2-CD2 4.42Å
45	S	87.4	Confident	81.8	Confident	75 Å²	75	64.8 Å²	64.8	52%	0.524	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.4	36.5	-179.9	-61.7	0	0	0	0	114.3	Q47	S45-Q47 PolarHBondContact O-N 2.86Å
46	G	86.2	Confident	84.4	Confident	73 Å²	73	62.1 Å²	62.1	75%	0.753	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.7	-0.1	-178.2	0	0	0	0	0	115.1	I44	I44-G46 PolarHBondContact O-N 3.2Å; I44-G46 VanDerWaalsContact O-N 3.15Å
47	Q	90.7	Very high	86.9	Confident	84 Å²	84	57 Å²	57	39%	0.393	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	123	173.3	-60.7	-177.4	-0.7	0	0	109.1	S43 I44 S45 V116	S43-Q47 WeakPolarHBondContact CA-O 3.5Å; I44-Q47 PolarHBondContact N-O 3.22Å; I44-Q47 WeakPolarHBondContact O-CB 3.49Å; I44-Q47 PolarHBondContact O-N 3.1Å; S45-Q47 PolarHBondContact O-N 2.86Å; Q47-V116 VanDerWaalsContact OE1-CB 3.23Å; Q47-V116 VanDerWaalsContact OE1-CG1 3.26Å; Q47-V116 PolarHBondContact OE1-O 3.45Å
48	S	92.2	Very high	88.8	Confident	69 Å²	69	52 Å²	52	48%	0.483	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	131.6	179	-62.3	0	0	0	0	110.7	V42 S43	V42-S48 VanDerWaalsContact O-CA 3.31Å; V42-S48 WeakPolarHBondContact O-CA 3.44Å; S43-S48 WeakPolarHBondContact CB-OG 3.25Å; S43-S48 PolarHBondContact OG-OG 3.35Å
49	T	92	Very high	90.4	Very high	21 Å²	21	51.5 Å²	51.5	13%	0.129	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	150.7	179.2	60.3	0	0	0	0	111.3	W41 V42 L143 T147	W41-T49 WeakPolarHBondContact CA-O 3.27Å; W41-T49 VanDerWaalsContact CE3-C 3.42Å; V42-T49 VanDerWaalsContact CG1-OG1 3.29Å; V42-T49 WeakPolarHBondContact CG1-OG1 3.3Å; V42-T49 PolarHBondContact N-O 2.92Å; V42-T49 PolarHBondContact O-N 3.47Å; T49-L143 WeakPolarHBondContact OG1-CD2 3.46Å; T49-T147 HydrophobicContact CG2-CG2 4.24Å
50	V	93.4	Very high	91.6	Very high	68 Å²	68	51.3 Å²	51.3	41%	0.412	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	134.9	172.5	-174.9	0	0	0	0	108.8	S40 W41 N144	S40-V50 CarbonylContact O-C 3.56Å; S40-V50 WeakPolarHBondContact O-CA 3.17Å; W41-V50 HydrophobicContact CD2-CG2 3.94Å; W41-V50 HydrophobicContact CE3-CG2 3.81Å; W41-V50 HydrophobicContact CH2-CG2 3.35Å; W41-V50 HydrophobicContact CZ2-CG2 3.48Å; W41-V50 VanDerWaalsContact CZ2-CG2 3.48Å; W41-V50 HydrophobicContact CZ3-CG2 3.52Å; V50-N144 WeakPolarHBondContact O-CB 3.4Å; V50-N144 PolarHBondContact O-ND2 2.63Å
51	K	93.9	Very high	91.9	Very high	42 Å²	42	48.1 Å²	48.1	18%	0.183	28%	0.283	C	S	.	.			trans	-75.8	137	171.4	-56.1	177.2	179.7	162.3	0	108.9	E35 S39 S40 W41 V42 Y55	E35-K51 IonicContact OE2-NZ 3.14Å; E35-K51 PolarHBondContact OE2-NZ 3.46Å; E35-K51 VanDerWaalsContact OE2-NZ 3.14Å; S39-K51 PolarHBondContact O-NZ 2.89Å; S39-K51 VanDerWaalsContact O-NZ 3.12Å; S40-K51 PolarHBondContact O-N 3.33Å; W41-K51 WeakPolarHBondContact O-CE 3.42Å; W41-K51 PolarHBondContact O-NZ 2.89Å; V42-K51 HydrophobicContact CB-CG 4.29Å; V42-K51 HydrophobicContact CG1-CG 4.24Å; K51-Y55 HydrophobicContact CB-CD2 4.02Å; K51-Y55 HydrophobicContact CB-CG 4.01Å; K51-Y55 HydrophobicContact CD-CD1 4.29Å; K51-Y55 HydrophobicContact CD-CD2 4.04Å; K51-Y55 HydrophobicContact CD-CE1 4.21Å; K51-Y55 HydrophobicContact CD-CE2 3.92Å; K51-Y55 HydrophobicContact CD-CG 4.22Å; K51-Y55 HydrophobicContact CG-CD2 3.59Å; K51-Y55 HydrophobicContact CG-CE2 3.82Å; K51-Y55 HydrophobicContact CG-CG 3.98Å
52	D	92.1	Very high	92.1	Very high	64 Å²	64	42.8 Å²	42.8	34%	0.342	26%	0.264	S	S	.	.			trans	-128.7	-163.7	172.3	67.3	10	0	0	0	110.7	W54 Y55 N144 E145	D52-W54 PolarHBondContact O-N 3.5Å; D52-W54 WeakPolarHBondContact OD1-CA 3Å; D52-W54 WeakPolarHBondContact OD1-CB 3.25Å; D52-W54 PolarHBondContact OD1-N 2.92Å; D52-Y55 WeakPolarHBondContact O-CB 3.41Å; D52-Y55 PolarHBondContact O-N 2.82Å; D52-N144 HydrophobicContact CB-CB 4.4Å; D52-N144 VanDerWaalsContact CG-CB 3.48Å; D52-N144 WeakPolarHBondContact OD1-CA 3.35Å; D52-N144 WeakPolarHBondContact OD2-CB 3.19Å; D52-E145 PolarHBondContact OD1-N 2.84Å; D52-E145 WeakPolarHBondContact OD2-CB 3.38Å; D52-E145 PolarHBondContact OD2-N 2.87Å
53	S	89.8	Confident	92.1	Very high	64 Å²	64	47.5 Å²	47.5	45%	0.448	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-15.7	179	54	0	0	0	0	114.5	R137	S53-R137 PolarHBondContact O-NH2 3.37Å
54	W	91.3	Very high	92.2	Very high	38 Å²	38	45.4 Å²	45.4	14%	0.144	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-22.2	176.7	-75.1	73.7	0	0	0	112.7	D52 N56 R137 Y142 E145 P417	D52-W54 PolarHBondContact O-N 3.5Å; D52-W54 WeakPolarHBondContact OD1-CA 3Å; D52-W54 WeakPolarHBondContact OD1-CB 3.25Å; D52-W54 PolarHBondContact OD1-N 2.92Å; W54-N56 PolarHBondContact O-N 2.87Å; W54-R137 HydrophobicContact CD2-CG 4.4Å; W54-R137 HydrophobicContact CE3-CG 3.53Å; W54-R137 HydrophobicContact CZ3-CG 3.61Å; W54-R137 PolarHBondContact O-NE 2.82Å; W54-R137 PolarHBondContact O-NH2 3.44Å; W54-Y142 HydrophobicContact CB-CG 4.47Å; W54-Y142 HydrophobicContact CD2-CD1 4.5Å; W54-Y142 AromaticContact CE3-CD1 3.69Å; W54-Y142 HydrophobicContact CE3-CD1 3.69Å; W54-Y142 HydrophobicContact CE3-CD2 4.08Å; W54-Y142 AromaticContact CE3-CE1 3.74Å; W54-Y142 HydrophobicContact CE3-CE1 3.74Å; W54-Y142 HydrophobicContact CE3-CE2 4.13Å; W54-Y142 AromaticContact CE3-CG 3.9Å; W54-Y142 HydrophobicContact CE3-CG 3.9Å; W54-Y142 HydrophobicContact CZ3-CD1 4.35Å; W54-Y142 AromaticContact CZ3-CE1 3.93Å; W54-Y142 HydrophobicContact CZ3-CE1 3.93Å; W54-Y142 HydrophobicContact CZ3-CE2 4.13Å; W54-Y142 AromaticContact CZ3-CZ 3.86Å; W54-E145 HydrophobicContact CD2-CB 4.44Å; W54-E145 HydrophobicContact CD2-CG 4.49Å; W54-E145 HydrophobicContact CG-CB 3.96Å; W54-E145 HydrophobicContact CG-CG 4.47Å; W54-P417 HydrophobicContact CZ2-CG 4.27Å
55	Y	93.4	Very high	92.3	Very high	42 Å²	42	45.7 Å²	45.7	17%	0.165	27%	0.273	C	S	.	.			trans	-51.7	124.4	-175.2	-179.8	-89	0	0	0	112.3	V42 K51 D52 L57 Y142 L143	V42-Y55 HydrophobicContact CB-CE2 4.04Å; V42-Y55 HydrophobicContact CG1-CD2 4.46Å; V42-Y55 HydrophobicContact CG1-CE2 4.02Å; V42-Y55 HydrophobicContact CG2-CE2 4.23Å; K51-Y55 HydrophobicContact CB-CD2 4.02Å; K51-Y55 HydrophobicContact CB-CG 4.01Å; K51-Y55 HydrophobicContact CD-CD1 4.29Å; K51-Y55 HydrophobicContact CD-CD2 4.04Å; K51-Y55 HydrophobicContact CD-CE1 4.21Å; K51-Y55 HydrophobicContact CD-CE2 3.92Å; K51-Y55 HydrophobicContact CD-CG 4.22Å; K51-Y55 HydrophobicContact CG-CD2 3.59Å; K51-Y55 HydrophobicContact CG-CE2 3.82Å; K51-Y55 HydrophobicContact CG-CG 3.98Å; D52-Y55 WeakPolarHBondContact O-CB 3.41Å; D52-Y55 PolarHBondContact O-N 2.82Å; Y55-L57 HydrophobicContact CE1-CB 4.48Å; Y55-L57 VanDerWaalsContact CE1-O 3.25Å; Y55-L57 WeakPolarHBondContact CE1-O 3.06Å; Y55-L57 HydrophobicContact CE2-CB 4Å; Y55-L57 PolarHBondContact OH-O 3.4Å; Y55-Y142 WeakPolarHBondContact CA-O 3.41Å; Y55-L143 WeakPolarHBondContact CD2-O 3.49Å
56	N	92.8	Very high	92.7	Very high	6 Å²	6	48.4 Å²	48.4	3%	0.032	28%	0.275	C	S	.	.			trans	-141.3	16.4	-178.3	66.6	0.7	0	0	0	114.2	W54 R137 T140 Y141 Y142	W54-N56 PolarHBondContact O-N 2.87Å; N56-R137 PolarHBondContact ND2-O 2.96Å; N56-T140 PolarHBondContact ND2-O 3.5Å; N56-Y141 VanDerWaalsContact OD1-CA 3.27Å; N56-Y141 WeakPolarHBondContact OD1-CA 3.4Å; N56-Y142 PolarHBondContact N-O 3.5Å; N56-Y142 VanDerWaalsContact N-O 3.14Å; N56-Y142 PolarHBondContact OD1-N 3.17Å; N56-Y142 PolarHBondContact OD1-O 3.44Å
57	L	94	Very high	93.2	Very high	8 Å²	8	47.5 Å²	47.5	4%	0.042	25%	0.249	C	C	.	.			trans	-78.3	137.1	176.6	-80.3	69.5	0	0	0	111.5	I44 Y55 I61 I62 Y141 Y142 L143 L149	I44-L57 HydrophobicContact CD1-CD2 3.51Å; Y55-L57 HydrophobicContact CE1-CB 4.48Å; Y55-L57 VanDerWaalsContact CE1-O 3.25Å; Y55-L57 WeakPolarHBondContact CE1-O 3.06Å; Y55-L57 HydrophobicContact CE2-CB 4Å; Y55-L57 PolarHBondContact OH-O 3.4Å; L57-I61 HydrophobicContact CG-CG2 4.41Å; L57-I62 HydrophobicContact CB-CG1 4.41Å; L57-I62 HydrophobicContact CD2-CG1 4.2Å; L57-Y141 HydrophobicContact CG-CD1 4.47Å; L57-Y142 VanDerWaalsContact CD1-C 3.41Å; L57-Y142 WeakPolarHBondContact CD1-O 3.49Å; L57-L143 HydrophobicContact CD1-CD1 4.07Å; L57-L143 HydrophobicContact CD1-CG 4.36Å; L57-L143 HydrophobicContact CD2-CD1 4.05Å; L57-L143 HydrophobicContact CD2-CG 4.17Å; L57-L149 HydrophobicContact CD2-CD1 3.78Å; L57-L149 HydrophobicContact CD2-CG 4.13Å; L57-L149 HydrophobicContact CG-CD1 4.26Å
58	T	91.8	Very high	93.4	Very high	17 Å²	17	45.6 Å²	45.6	10%	0.104	25%	0.245	C	C	.	.			trans	-92.1	158.2	169.3	72.8	0	0	0	0	111.6	H60 I61 I62 D432 S436	T58-H60 PolarHBondContact O-N 2.78Å; T58-H60 PolarHBondContact OG1-N 2.97Å; T58-I61 PolarHBondContact O-N 2.88Å; T58-I61 VanDerWaalsContact O-N 3.11Å; T58-I61 WeakPolarHBondContact OG1-CG1 3.39Å; T58-I61 PolarHBondContact OG1-N 2.73Å; T58-I62 PolarHBondContact O-N 2.94Å; T58-I62 VanDerWaalsContact O-N 3.12Å; T58-D432 HydrophobicContact CG2-CB 3.89Å; T58-S436 WeakPolarHBondContact CB-OG 3.32Å; T58-S436 PolarHBondContact OG1-OG 3.05Å
59	P	90.9	Very high	93.7	Very high	108 Å²	108	42.3 Å²	42.3	70%	0.701	22%	0.222	S	C	*	.	H	α-helix	trans	-54.8	-33.1	172.5	-26.7	35.6	0	0	0	113.3	I62 E63	P59-I62 PolarHBondContact O-N 3.49Å; P59-E63 PolarHBondContact O-N 3.09Å; P59-E63 VanDerWaalsContact O-N 3.08Å
60	H	92.5	Very high	94	Very high	39 Å²	39	41.5 Å²	41.5	18%	0.181	22%	0.216	C	C	.	.	H	α-helix	trans	-62.6	-48.2	175.8	179.1	70.8	0	0	0	111.6	T58 I62 E63 L64	T58-H60 PolarHBondContact O-N 2.78Å; T58-H60 PolarHBondContact OG1-N 2.97Å; H60-I62 VanDerWaalsContact C-N 3.32Å; H60-I62 PolarHBondContact O-N 2.75Å; H60-E63 WeakPolarHBondContact O-CB 3.35Å; H60-E63 PolarHBondContact O-N 2.85Å; H60-E63 VanDerWaalsContact O-N 3.13Å; H60-L64 WeakPolarHBondContact O-CG 3.26Å; H60-L64 PolarHBondContact O-N 2.75Å; H60-L64 VanDerWaalsContact O-N 3.14Å
61	I	95	Very high	94.3	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-60.6	-42.2	176.9	-62.6	-56.6	0	0	0	111.5	L57 T58 E63 L64 T65 Y141 L149 Y175 P186	L57-I61 HydrophobicContact CG-CG2 4.41Å; T58-I61 PolarHBondContact O-N 2.88Å; T58-I61 VanDerWaalsContact O-N 3.11Å; T58-I61 WeakPolarHBondContact OG1-CG1 3.39Å; T58-I61 PolarHBondContact OG1-N 2.73Å; I61-E63 VanDerWaalsContact C-N 3.27Å; I61-E63 PolarHBondContact O-N 3.3Å; I61-L64 HydrophobicContact CD1-CD1 4.15Å; I61-L64 PolarHBondContact O-N 2.85Å; I61-T65 WeakPolarHBondContact O-CG2 3.1Å; I61-T65 PolarHBondContact O-N 3.14Å; I61-Y141 HydrophobicContact CD1-CE1 4.28Å; I61-Y141 HydrophobicContact CD1-CE2 4.12Å; I61-Y141 WeakPolarHBondContact CD1-OH 3.38Å; I61-Y141 HydrophobicContact CG1-CD1 4.48Å; I61-Y141 HydrophobicContact CG1-CE1 3.77Å; I61-Y141 HydrophobicContact CG1-CE2 4.36Å; I61-Y141 HydrophobicContact CG2-CD1 4.48Å; I61-Y141 HydrophobicContact CG2-CG 4.48Å; I61-L149 HydrophobicContact CG2-CD1 3.8Å; I61-Y175 HydrophobicContact CG2-CD1 4.1Å; I61-Y175 HydrophobicContact CG2-CE1 4.42Å; I61-P186 HydrophobicContact CD1-CB 3.61Å; I61-P186 HydrophobicContact CD1-CG 3.8Å
62	I	94.6	Very high	94.4	Very high	19 Å²	19	41.1 Å²	41.1	10%	0.097	21%	0.212	C	C	.	.	H	α-helix	trans	-59.3	-39.8	176.6	-64.4	169.8	0	0	0	110.9	V42 I44 L57 T58 P59 H60 T65	V42-I62 HydrophobicContact CG2-CD1 4.03Å; I44-I62 HydrophobicContact CD1-CG1 4.36Å; L57-I62 HydrophobicContact CB-CG1 4.41Å; L57-I62 HydrophobicContact CD2-CG1 4.2Å; T58-I62 PolarHBondContact O-N 2.94Å; T58-I62 VanDerWaalsContact O-N 3.12Å; P59-I62 PolarHBondContact O-N 3.49Å; H60-I62 VanDerWaalsContact C-N 3.32Å; H60-I62 PolarHBondContact O-N 2.75Å; I62-T65 PolarHBondContact O-N 3.46Å; I62-T65 PolarHBondContact O-OG1 3.38Å
63	E	93.8	Very high	94.6	Very high	100 Å²	100	45.4 Å²	45.4	47%	0.467	23%	0.23	S	C	.	.	H	α-helix	trans	-66.4	-37.8	177.7	-172.8	58.3	-154.6	0	0	112.6	P59 H60 I61 T65 K66	P59-E63 PolarHBondContact O-N 3.09Å; P59-E63 VanDerWaalsContact O-N 3.08Å; H60-E63 WeakPolarHBondContact O-CB 3.35Å; H60-E63 PolarHBondContact O-N 2.85Å; H60-E63 VanDerWaalsContact O-N 3.13Å; I61-E63 VanDerWaalsContact C-N 3.27Å; I61-E63 PolarHBondContact O-N 3.3Å; E63-T65 PolarHBondContact O-N 2.68Å; E63-K66 WeakPolarHBondContact O-CB 3.11Å; E63-K66 PolarHBondContact O-N 3.45Å; E63-K66 VanDerWaalsContact O-N 3.14Å; E63-K66 WeakPolarHBondContact OE2-CD 3.27Å; E63-K66 WeakPolarHBondContact OE2-CE 3.37Å; E63-K66 IonicContact OE2-NZ 3.69Å; E63-K66 PolarHBondContact OE2-NZ 2.88Å
64	L	95.4	Very high	94.9	Very high	13 Å²	13	44.6 Å²	44.6	7%	0.068	22%	0.219	C	C	.	.	H	α-helix	trans	-61.3	-30.3	177.4	-62.7	176	0	0	0	112.3	H60 I61 K66 R67 Y185 P186 V187 W366	H60-L64 WeakPolarHBondContact O-CG 3.26Å; H60-L64 PolarHBondContact O-N 2.75Å; H60-L64 VanDerWaalsContact O-N 3.14Å; I61-L64 HydrophobicContact CD1-CD1 4.15Å; I61-L64 PolarHBondContact O-N 2.85Å; L64-K66 PolarHBondContact O-N 2.75Å; L64-R67 WeakPolarHBondContact O-CB 3.35Å; L64-R67 PolarHBondContact O-N 2.72Å; L64-Y185 HydrophobicContact CD1-CE1 4.02Å; L64-Y185 HydrophobicContact CD2-CE1 4.42Å; L64-P186 HydrophobicContact CD1-CG 4.3Å; L64-V187 HydrophobicContact CB-CG2 3.79Å; L64-V187 HydrophobicContact CD1-CB 4.33Å; L64-V187 HydrophobicContact CD1-CG2 3.51Å; L64-V187 HydrophobicContact CG-CG2 4.3Å; L64-W366 HydrophobicContact CB-CH2 4.28Å; L64-W366 HydrophobicContact CB-CZ3 4.07Å; L64-W366 HydrophobicContact CD2-CD2 4.31Å; L64-W366 HydrophobicContact CD2-CE3 3.54Å; L64-W366 HydrophobicContact CD2-CH2 4.3Å; L64-W366 HydrophobicContact CD2-CZ3 3.52Å; L64-W366 HydrophobicContact CG-CZ3 4.33Å
65	T	96.1	Very high	95.3	Very high	10 Å²	10	43 Å²	43	6%	0.061	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-16.4	176.7	74	0	0	0	0	115.1	I44 I61 I62 E63 L149 Y175	I44-T65 HydrophobicContact CD1-CG2 4.47Å; I44-T65 HydrophobicContact CG2-CG2 3.99Å; I61-T65 WeakPolarHBondContact O-CG2 3.1Å; I61-T65 PolarHBondContact O-N 3.14Å; I62-T65 PolarHBondContact O-N 3.46Å; I62-T65 PolarHBondContact O-OG1 3.38Å; E63-T65 PolarHBondContact O-N 2.68Å; T65-L149 HydrophobicContact CG2-CD1 4.25Å; T65-L149 HydrophobicContact CG2-CD2 4.48Å; T65-Y175 WeakPolarHBondContact CA-OH 3.19Å; T65-Y175 HydrophobicContact CG2-CE1 3.79Å
66	K	95.4	Very high	95.5	Very high	131 Å²	131	41 Å²	41	57%	0.57	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-5.6	-177	-56.1	174.5	-170.2	165.4	0	113.1	E63 L64	E63-K66 WeakPolarHBondContact O-CB 3.11Å; E63-K66 PolarHBondContact O-N 3.45Å; E63-K66 VanDerWaalsContact O-N 3.14Å; E63-K66 WeakPolarHBondContact OE2-CD 3.27Å; E63-K66 WeakPolarHBondContact OE2-CE 3.37Å; E63-K66 IonicContact OE2-NZ 3.69Å; E63-K66 PolarHBondContact OE2-NZ 2.88Å; L64-K66 PolarHBondContact O-N 2.75Å
67	R	95.5	Very high	95.7	Very high	55 Å²	55	40.7 Å²	40.7	21%	0.208	20%	0.204	C	C	.	.			trans	-87.4	-41.8	-166.5	-68.8	-84	-70	176.2	-1.8	113.5	L64 L69 Q72 W366	L64-R67 WeakPolarHBondContact O-CB 3.35Å; L64-R67 PolarHBondContact O-N 2.72Å; R67-L69 VanDerWaalsContact C-N 3.34Å; R67-L69 HydrophobicContact CB-CD2 4.03Å; R67-L69 HydrophobicContact CB-CG 4.29Å; R67-L69 PolarHBondContact O-N 2.91Å; R67-Q72 PolarHBondContact O-NE2 3.04Å; R67-W366 HydrophobicContact CB-CZ3 3.79Å; R67-W366 HydrophobicContact CG-CE3 4.4Å; R67-W366 HydrophobicContact CG-CZ3 3.87Å; R67-W366 PolarHBondContact NH2-O 3.28Å
68	S	96.2	Very high	95.9	Very high	44 Å²	44	40.7 Å²	40.7	31%	0.308	20%	0.204	S	C	.	.			trans	42.9	54.6	-178.5	-53.5	0	0	0	0	113.4	H70 N71 Q72	S68-H70 PolarHBondContact O-N 3.45Å; S68-H70 VanDerWaalsContact O-N 3.15Å; S68-N71 PolarHBondContact O-N 2.82Å; S68-Q72 PolarHBondContact O-N 3.12Å
69	L	98.3	Very high	96.2	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-59.1	-30.5	-170.8	-60.2	-177.3	0	0	0	113.2	R67 N71 Q72 H75 L77 F365 W366	R67-L69 VanDerWaalsContact C-N 3.34Å; R67-L69 HydrophobicContact CB-CD2 4.03Å; R67-L69 HydrophobicContact CB-CG 4.29Å; R67-L69 PolarHBondContact O-N 2.91Å; L69-N71 PolarHBondContact O-N 2.89Å; L69-Q72 PolarHBondContact O-N 2.85Å; L69-H75 PolarHBondContact O-ND1 3.14Å; L69-L77 HydrophobicContact CB-CD1 4.09Å; L69-L77 HydrophobicContact CD1-CD1 4.36Å; L69-F365 HydrophobicContact CD1-CB 4.4Å; L69-F365 VanDerWaalsContact CD1-O 3.29Å; L69-F365 WeakPolarHBondContact CD1-O 3.44Å; L69-W366 HydrophobicContact CD1-CD2 3.72Å; L69-W366 HydrophobicContact CD1-CE3 3.82Å; L69-W366 HydrophobicContact CD1-CG 4.32Å; L69-W366 HydrophobicContact CD1-CH2 4.07Å; L69-W366 HydrophobicContact CD1-CZ2 3.96Å; L69-W366 HydrophobicContact CD1-CZ3 4.01Å; L69-W366 HydrophobicContact CG-CE3 4.44Å; L69-W366 HydrophobicContact CG-CH2 4.38Å; L69-W366 HydrophobicContact CG-CZ3 4.26Å
70	H	98.4	Very high	96.6	Very high	3 Å²	3	34.9 Å²	34.9	1%	0.014	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	-63.8	-15.5	174	64.5	-67.8	0	0	0	113.7	S68 N78 K81 D111 A171 D173 H189 L349	S68-H70 PolarHBondContact O-N 3.45Å; S68-H70 VanDerWaalsContact O-N 3.15Å; H70-N78 WeakPolarHBondContact O-CA 3.39Å; H70-N78 WeakPolarHBondContact O-CB 3.13Å; H70-N78 PolarHBondContact O-ND2 3.27Å; H70-K81 WeakPolarHBondContact O-CE 3.46Å; H70-K81 PolarHBondContact O-NZ 3.26Å; H70-D111 PolarHBondContact NE2-O 2.83Å; H70-A171 PolarHBondContact NE2-O 3.31Å; H70-D173 IonicContact CE1-OD1 3.5Å; H70-H189 AromaticContact CG-CD2 3.81Å; H70-H189 AromaticContact ND1-CD2 3.29Å; H70-H189 PolarHBondContact ND1-CD2 2.87Å; H70-H189 VanDerWaalsContact ND1-CD2 3.29Å; H70-H189 AromaticContact ND1-NE2 3.7Å; H70-L349 HydrophobicContact CB-CD1 4.26Å
71	N	98.2	Very high	96.8	Very high	37 Å²	37	33.5 Å²	33.5	20%	0.198	16%	0.16	C	C	.	.	G	3₁₀ helix	trans	-108.6	-3.5	177	-67.8	-15.7	0	0	0	113.7	S68 L69 Q73 K81 D111 H112	S68-N71 PolarHBondContact O-N 2.82Å; L69-N71 PolarHBondContact O-N 2.89Å; N71-Q73 PolarHBondContact O-N 2.8Å; N71-K81 PolarHBondContact OD1-NZ 2.84Å; N71-D111 PolarHBondContact ND2-O 3.24Å; N71-D111 PolarHBondContact OD1-OD2 2.79Å; N71-H112 PolarHBondContact ND2-CE1 3.34Å; N71-H112 PolarHBondContact ND2-NE2 2.85Å
72	Q	97.5	Very high	97	Very high	66 Å²	66	37 Å²	37	31%	0.308	18%	0.176	S	C	.	.	S	Bend	trans	-77.4	123.5	175.8	-66.2	-172.5	8.9	0	0	110.4	R67 S68 L69 H74 H75 N78	R67-Q72 PolarHBondContact O-NE2 3.04Å; S68-Q72 PolarHBondContact O-N 3.12Å; L69-Q72 PolarHBondContact O-N 2.85Å; Q72-H74 PolarHBondContact O-N 2.79Å; Q72-H75 HydrophobicContact CB-CB 3.9Å; Q72-H75 VanDerWaalsContact O-CB 3.24Å; Q72-H75 WeakPolarHBondContact O-CB 3.21Å; Q72-H75 PolarHBondContact O-N 2.92Å; Q72-H75 VanDerWaalsContact O-N 3.15Å; Q72-N78 WeakPolarHBondContact O-CB 3.28Å; Q72-N78 VanDerWaalsContact O-CG 3.28Å
73	Q	96.2	Very high	97.1	Very high	153 Å²	153	36.9 Å²	36.9	72%	0.715	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.6	138	179.8	-166.1	-176.8	-2.3	0	0	110.9	N71 H75	N71-Q73 PolarHBondContact O-N 2.8Å; Q73-H75 PolarHBondContact O-N 2.84Å
74	H	96.3	Very high	97.3	Very high	48 Å²	48	32.1 Å²	32.1	22%	0.222	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	64	-2.9	-177.8	-49.5	-61.9	0	0	0	115.9	Q72 F376 I377 T378	Q72-H74 PolarHBondContact O-N 2.79Å; H74-F376 WeakPolarHBondContact O-CB 3.33Å; H74-I377 HydrophobicContact CB-CG1 4.27Å; H74-T378 PolarHBondContact CE1-O 2.86Å; H74-T378 PolarHBondContact ND1-O 2.99Å
75	H	98	Very high	97.3	Very high	4 Å²	4	33.4 Å²	33.4	2%	0.019	16%	0.16	C	C	.	.			trans	-63.6	138.2	173.2	-168.9	-93.3	0	0	0	109.7	L69 Q72 Q73 L77 N78 L79 F365	L69-H75 PolarHBondContact O-ND1 3.14Å; Q72-H75 HydrophobicContact CB-CB 3.9Å; Q72-H75 VanDerWaalsContact O-CB 3.24Å; Q72-H75 WeakPolarHBondContact O-CB 3.21Å; Q72-H75 PolarHBondContact O-N 2.92Å; Q72-H75 VanDerWaalsContact O-N 3.15Å; Q73-H75 PolarHBondContact O-N 2.84Å; H75-L77 PolarHBondContact ND1-N 3.36Å; H75-L77 PolarHBondContact O-N 3.2Å; H75-L77 VanDerWaalsContact O-N 3.11Å; H75-N78 HydrophobicContact CB-CB 4.2Å; H75-N78 WeakPolarHBondContact O-CA 3.12Å; H75-N78 VanDerWaalsContact O-CB 3.31Å; H75-N78 WeakPolarHBondContact O-CB 3.43Å; H75-N78 PolarHBondContact O-N 3.13Å; H75-L79 PolarHBondContact O-N 3.07Å; H75-F365 PolarHBondContact NE2-O 3.14Å
76	P	97.8	Very high	97.3	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-53.5	-37.2	-178.1	17.8	-33.3	0	0	0	113.6	L79 I80 Y357 I359 F365 F372 F376	P76-L79 PolarHBondContact O-N 3.33Å; P76-I80 WeakPolarHBondContact O-CG1 3.42Å; P76-I80 PolarHBondContact O-N 2.86Å; P76-Y357 HydrophobicContact CB-CD2 3.89Å; P76-Y357 HydrophobicContact CB-CE2 3.78Å; P76-I359 HydrophobicContact CB-CD1 4.33Å; P76-I359 HydrophobicContact CG-CD1 4.47Å; P76-F365 HydrophobicContact CB-CD1 4.43Å; P76-F365 HydrophobicContact CB-CE1 4.04Å; P76-F365 HydrophobicContact CG-CD1 3.68Å; P76-F365 HydrophobicContact CG-CE1 3.76Å; P76-F372 HydrophobicContact CG-CE1 4.19Å; P76-F372 HydrophobicContact CG-CZ 3.92Å; P76-F376 HydrophobicContact CB-CD1 3.81Å; P76-F376 HydrophobicContact CB-CD2 4.42Å; P76-F376 HydrophobicContact CB-CE1 3.82Å; P76-F376 HydrophobicContact CB-CE2 4.43Å; P76-F376 HydrophobicContact CB-CG 4.13Å; P76-F376 HydrophobicContact CB-CZ 4.14Å; P76-F376 HydrophobicContact CG-CD1 4.45Å; P76-F376 HydrophobicContact CG-CD2 4.19Å; P76-F376 HydrophobicContact CG-CE1 4.47Å; P76-F376 HydrophobicContact CG-CE2 4.21Å; P76-F376 HydrophobicContact CG-CG 4.31Å; P76-F376 HydrophobicContact CG-CZ 4.35Å
77	L	98.5	Very high	97.3	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-67.8	-36.6	175.9	-55.4	179.1	0	0	0	112.6	L69 H75 K81 H189 L349 E350 A353 F365	L69-L77 HydrophobicContact CB-CD1 4.09Å; L69-L77 HydrophobicContact CD1-CD1 4.36Å; H75-L77 PolarHBondContact ND1-N 3.36Å; H75-L77 PolarHBondContact O-N 3.2Å; H75-L77 VanDerWaalsContact O-N 3.11Å; L77-K81 WeakPolarHBondContact O-CB 3.15Å; L77-K81 PolarHBondContact O-N 3.17Å; L77-H189 HydrophobicContact CD1-CB 4.47Å; L77-H189 WeakPolarHBondContact CD1-ND1 3.49Å; L77-L349 HydrophobicContact CD2-CB 4Å; L77-E350 HydrophobicContact CD1-CG 4.31Å; L77-E350 WeakPolarHBondContact CD1-OE1 3.36Å; L77-E350 HydrophobicContact CD2-CB 4.47Å; L77-E350 HydrophobicContact CD2-CG 3.96Å; L77-A353 HydrophobicContact CD2-CB 3.97Å; L77-F365 HydrophobicContact CD1-CB 4.44Å; L77-F365 HydrophobicContact CD1-CD1 4.4Å; L77-F365 HydrophobicContact CD1-CG 4.42Å; L77-F365 HydrophobicContact CD2-CD1 3.91Å; L77-F365 HydrophobicContact CD2-CE1 3.79Å; L77-F365 HydrophobicContact CD2-CG 4.37Å; L77-F365 HydrophobicContact CD2-CZ 4.18Å; L77-F365 HydrophobicContact CG-CD1 3.93Å; L77-F365 HydrophobicContact CG-CE1 4.26Å; L77-F365 HydrophobicContact CG-CG 4.41Å
78	N	98.3	Very high	97.2	Very high	7 Å²	7	26.3 Å²	26.3	4%	0.037	13%	0.132	C	C	.	.	H	α-helix	trans	-66.1	-40.5	173.2	179.8	-101.2	0	0	0	111.2	H70 Q72 H75 K81 Q82	H70-N78 WeakPolarHBondContact O-CA 3.39Å; H70-N78 WeakPolarHBondContact O-CB 3.13Å; H70-N78 PolarHBondContact O-ND2 3.27Å; Q72-N78 WeakPolarHBondContact O-CB 3.28Å; Q72-N78 VanDerWaalsContact O-CG 3.28Å; H75-N78 HydrophobicContact CB-CB 4.2Å; H75-N78 WeakPolarHBondContact O-CA 3.12Å; H75-N78 VanDerWaalsContact O-CB 3.31Å; H75-N78 WeakPolarHBondContact O-CB 3.43Å; H75-N78 PolarHBondContact O-N 3.13Å; N78-K81 WeakPolarHBondContact O-CB 3.16Å; N78-K81 PolarHBondContact O-N 3.03Å; N78-Q82 WeakPolarHBondContact O-CB 3.36Å; N78-Q82 VanDerWaalsContact O-CG 3.31Å; N78-Q82 WeakPolarHBondContact O-CG 3.36Å; N78-Q82 PolarHBondContact O-N 3.38Å; N78-Q82 PolarHBondContact OD1-NE2 3.44Å; N78-Q82 VanDerWaalsContact OD1-NE2 3.12Å
79	L	98.2	Very high	97	Very high	3 Å²	3	29.6 Å²	29.6	2%	0.016	14%	0.141	C	C	.	.	H	α-helix	trans	-61.2	-47.5	175.4	-64.7	178.8	0	0	0	111.5	H75 P76 K81 Q82 R83 Y357 F376 T378 I381 I385	H75-L79 PolarHBondContact O-N 3.07Å; P76-L79 PolarHBondContact O-N 3.33Å; L79-K81 PolarHBondContact O-N 3.04Å; L79-Q82 PolarHBondContact O-N 2.97Å; L79-R83 VanDerWaalsContact O-CG 3.31Å; L79-R83 WeakPolarHBondContact O-CG 3.36Å; L79-R83 PolarHBondContact O-N 2.75Å; L79-Y357 WeakPolarHBondContact CB-OH 3.2Å; L79-F376 HydrophobicContact CD1-CB 4.04Å; L79-F376 HydrophobicContact CD1-CD1 4.32Å; L79-T378 HydrophobicContact CD1-CG2 4.21Å; L79-T378 HydrophobicContact CD2-CG2 4.09Å; L79-I381 HydrophobicContact CD2-CG2 4.3Å; L79-I385 HydrophobicContact CD1-CD1 4.11Å
80	I	97.6	Very high	96.6	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-59.9	-47.6	175.5	-64.6	-64.4	0	0	0	110.9	P76 Q82 R83 I84 L272 L349 W352 A353 L356 Y357	P76-I80 WeakPolarHBondContact O-CG1 3.42Å; P76-I80 PolarHBondContact O-N 2.86Å; I80-Q82 VanDerWaalsContact C-N 3.32Å; I80-Q82 PolarHBondContact O-N 2.82Å; I80-R83 PolarHBondContact O-N 3.24Å; I80-I84 HydrophobicContact CG2-CD1 3.63Å; I80-I84 HydrophobicContact CG2-CG1 4.39Å; I80-I84 WeakPolarHBondContact O-CG1 3.45Å; I80-I84 PolarHBondContact O-N 3.2Å; I80-L272 HydrophobicContact CD1-CD2 4.44Å; I80-L272 HydrophobicContact CG2-CD2 4.48Å; I80-L349 HydrophobicContact CB-CD2 4.38Å; I80-L349 HydrophobicContact CG2-CD2 3.7Å; I80-W352 HydrophobicContact CG2-CB 4.1Å; I80-A353 HydrophobicContact CG1-CB 3.89Å; I80-L356 HydrophobicContact CD1-CB 4.29Å; I80-L356 HydrophobicContact CD1-CD2 3.3Å; I80-L356 HydrophobicContact CD1-CG 4.38Å; I80-Y357 HydrophobicContact CD1-CE2 3.69Å; I80-Y357 WeakPolarHBondContact CD1-OH 3.41Å; I80-Y357 HydrophobicContact CG1-CE2 3.71Å
81	K	98.2	Very high	96.2	Very high	10 Å²	10	35.4 Å²	35.4	4%	0.043	17%	0.165	C	C	.	.	H	α-helix	trans	-53.2	-50.8	175.9	-177.5	-168.9	70.7	168.7	0	110.7	H70 N71 L77 N78 L79 R83 I84 V85 D111 A171 L191 L349	H70-K81 WeakPolarHBondContact O-CE 3.46Å; H70-K81 PolarHBondContact O-NZ 3.26Å; N71-K81 PolarHBondContact OD1-NZ 2.84Å; L77-K81 WeakPolarHBondContact O-CB 3.15Å; L77-K81 PolarHBondContact O-N 3.17Å; N78-K81 WeakPolarHBondContact O-CB 3.16Å; N78-K81 PolarHBondContact O-N 3.03Å; L79-K81 PolarHBondContact O-N 3.04Å; K81-R83 PolarHBondContact O-N 3.15Å; K81-I84 PolarHBondContact O-N 2.97Å; K81-V85 HydrophobicContact CG-CG2 4.42Å; K81-V85 WeakPolarHBondContact O-CB 3.42Å; K81-V85 VanDerWaalsContact O-CG2 3.24Å; K81-V85 WeakPolarHBondContact O-CG2 3.49Å; K81-V85 PolarHBondContact O-N 3.24Å; K81-D111 HydrophobicContact CD-CB 4.46Å; K81-D111 IonicContact NZ-OD2 2.94Å; K81-D111 PolarHBondContact NZ-OD2 3.24Å; K81-A171 HydrophobicContact CD-CB 3.64Å; K81-A171 HydrophobicContact CG-CB 3.98Å; K81-L191 HydrophobicContact CG-CD1 4.26Å; K81-L349 HydrophobicContact CB-CD1 4.46Å
82	Q	97.7	Very high	95.4	Very high	73 Å²	73	35.3 Å²	35.3	34%	0.341	16%	0.164	S	C	.	.	H	α-helix	trans	-63.1	-41.7	-179	-74.8	179	-7.9	0	0	112.3	N78 L79 I80 I84 V85 D86 I381	N78-Q82 WeakPolarHBondContact O-CB 3.36Å; N78-Q82 VanDerWaalsContact O-CG 3.31Å; N78-Q82 WeakPolarHBondContact O-CG 3.36Å; N78-Q82 PolarHBondContact O-N 3.38Å; N78-Q82 PolarHBondContact OD1-NE2 3.44Å; N78-Q82 VanDerWaalsContact OD1-NE2 3.12Å; L79-Q82 PolarHBondContact O-N 2.97Å; I80-Q82 VanDerWaalsContact C-N 3.32Å; I80-Q82 PolarHBondContact O-N 2.82Å; Q82-I84 VanDerWaalsContact C-N 3.34Å; Q82-I84 PolarHBondContact O-N 3.33Å; Q82-V85 PolarHBondContact O-N 2.85Å; Q82-D86 VanDerWaalsContact O-CB 3.23Å; Q82-D86 WeakPolarHBondContact O-CB 3.38Å; Q82-D86 PolarHBondContact O-N 3.11Å; Q82-I381 HydrophobicContact CB-CD1 4.13Å; Q82-I381 HydrophobicContact CB-CG2 4.26Å
83	R	97.7	Very high	94.5	Very high	18 Å²	18	35.6 Å²	35.6	7%	0.068	17%	0.17	C	C	.	.	H	α-helix	trans	-61.9	-41.4	175.8	-70.7	178.8	77.9	163.6	-7.1	112.3	L79 I80 K81 F87 L272 I381	L79-R83 VanDerWaalsContact O-CG 3.31Å; L79-R83 WeakPolarHBondContact O-CG 3.36Å; L79-R83 PolarHBondContact O-N 2.75Å; I80-R83 PolarHBondContact O-N 3.24Å; K81-R83 PolarHBondContact O-N 3.15Å; R83-F87 WeakPolarHBondContact O-CB 3.44Å; R83-F87 PolarHBondContact O-N 3.39Å; R83-L272 HydrophobicContact CB-CD2 4.29Å; R83-L272 HydrophobicContact CB-CG 4.42Å; R83-L272 PolarHBondContact NH2-O 2.7Å; R83-I381 WeakPolarHBondContact CD-O 3.44Å; R83-I381 HydrophobicContact CG-CB 4.21Å; R83-I381 HydrophobicContact CG-CD1 4.43Å; R83-I381 HydrophobicContact CG-CG1 4.26Å; R83-I381 WeakPolarHBondContact CG-O 3.07Å
84	I	97.1	Very high	93.8	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-66.9	-45.9	177.5	-68.3	166.5	0	0	0	110.5	I80 K81 Q82 D86 F87 M88 L191 M268 L272 L347 L349	I80-I84 HydrophobicContact CG2-CD1 3.63Å; I80-I84 HydrophobicContact CG2-CG1 4.39Å; I80-I84 WeakPolarHBondContact O-CG1 3.45Å; I80-I84 PolarHBondContact O-N 3.2Å; K81-I84 PolarHBondContact O-N 2.97Å; Q82-I84 VanDerWaalsContact C-N 3.34Å; Q82-I84 PolarHBondContact O-N 3.33Å; I84-D86 PolarHBondContact O-N 3.25Å; I84-F87 WeakPolarHBondContact O-CB 3.25Å; I84-F87 PolarHBondContact O-N 3.45Å; I84-M88 HydrophobicContact CG2-CG 4.46Å; I84-M88 WeakPolarHBondContact O-CG 3.36Å; I84-M88 PolarHBondContact O-N 3.42Å; I84-L191 HydrophobicContact CB-CD1 4.09Å; I84-L191 HydrophobicContact CD1-CD1 4.3Å; I84-L191 HydrophobicContact CG2-CD1 3.73Å; I84-L191 HydrophobicContact CG2-CD2 3.94Å; I84-M268 HydrophobicContact CB-SD 4.49Å; I84-M268 HydrophobicContact CG1-SD 4.25Å; I84-M268 HydrophobicContact CG2-SD 3.68Å; I84-L272 HydrophobicContact CG1-CD2 3.94Å; I84-L347 HydrophobicContact CD1-CD1 3.77Å; I84-L347 HydrophobicContact CD1-CD2 3.91Å; I84-L349 HydrophobicContact CD1-CD2 4.19Å
85	V	96.1	Very high	92.8	Very high	39 Å²	39	36.2 Å²	36.2	24%	0.236	17%	0.167	C	C	.	.	H	α-helix	trans	-60.4	-45.7	176.8	171.5	0	0	0	0	110.9	K81 Q82 F87 M88 F89 L109 L169	K81-V85 HydrophobicContact CG-CG2 4.42Å; K81-V85 WeakPolarHBondContact O-CB 3.42Å; K81-V85 VanDerWaalsContact O-CG2 3.24Å; K81-V85 WeakPolarHBondContact O-CG2 3.49Å; K81-V85 PolarHBondContact O-N 3.24Å; Q82-V85 PolarHBondContact O-N 2.85Å; V85-F87 PolarHBondContact O-N 3.29Å; V85-M88 PolarHBondContact O-N 3.3Å; V85-F89 WeakPolarHBondContact O-CB 3.34Å; V85-F89 PolarHBondContact O-N 3.49Å; V85-L109 HydrophobicContact CG2-CD1 4.09Å; V85-L109 HydrophobicContact CG2-CD2 4.06Å; V85-L169 HydrophobicContact CG2-CD1 3.87Å
86	D	95.6	Very high	91.7	Very high	36 Å²	36	37.2 Å²	37.2	19%	0.193	17%	0.173	C	C	.	.	H	α-helix	trans	-61.2	-42	175.8	178.8	63.7	0	0	0	111.8	Q82 I84 F89 K90 I381 H382	Q82-D86 VanDerWaalsContact O-CB 3.23Å; Q82-D86 WeakPolarHBondContact O-CB 3.38Å; Q82-D86 PolarHBondContact O-N 3.11Å; I84-D86 PolarHBondContact O-N 3.25Å; D86-F89 PolarHBondContact O-N 2.88Å; D86-K90 VanDerWaalsContact CG-NZ 3.34Å; D86-K90 WeakPolarHBondContact O-CB 3.26Å; D86-K90 WeakPolarHBondContact O-CG 3.42Å; D86-K90 PolarHBondContact O-N 3.11Å; D86-K90 WeakPolarHBondContact OD1-CE 3.38Å; D86-K90 IonicContact OD1-NZ 3.03Å; D86-K90 PolarHBondContact OD1-NZ 2.82Å; D86-K90 WeakPolarHBondContact OD2-CD 3.16Å; D86-K90 WeakPolarHBondContact OD2-CE 3.38Å; D86-K90 IonicContact OD2-NZ 2.63Å; D86-K90 PolarHBondContact OD2-NZ 3.39Å; D86-I381 HydrophobicContact CB-CD1 4.03Å; D86-H382 IonicContact OD2-CE1 2.74Å; D86-H382 PolarHBondContact OD2-CE1 2.95Å; D86-H382 VanDerWaalsContact OD2-CE1 3.24Å; D86-H382 IonicContact OD2-NE2 2.64Å; D86-H382 PolarHBondContact OD2-NE2 2.97Å
87	F	95.6	Very high	90.5	Very high	6 Å²	6	46.2 Å²	46.2	3%	0.026	21%	0.209	C	C	.	.	H	α-helix	trans	-58.7	-51	173.3	166.5	-93.8	0	0	0	111.6	R83 I84 V85 F89 K90 R91 V264 E267 M268	R83-F87 WeakPolarHBondContact O-CB 3.44Å; R83-F87 PolarHBondContact O-N 3.39Å; I84-F87 WeakPolarHBondContact O-CB 3.25Å; I84-F87 PolarHBondContact O-N 3.45Å; V85-F87 PolarHBondContact O-N 3.29Å; F87-F89 VanDerWaalsContact C-N 3.31Å; F87-F89 PolarHBondContact O-N 2.68Å; F87-K90 PolarHBondContact O-N 3.02Å; F87-R91 HydrophobicContact CZ-CB 4.36Å; F87-R91 VanDerWaalsContact O-CB 3.26Å; F87-R91 WeakPolarHBondContact O-CB 3.16Å; F87-R91 PolarHBondContact O-N 3.41Å; F87-V264 HydrophobicContact CE1-CG1 4.29Å; F87-E267 HydrophobicContact CE2-CB 3.88Å; F87-E267 HydrophobicContact CZ-CB 3.69Å; F87-M268 HydrophobicContact CD1-CB 3.78Å; F87-M268 HydrophobicContact CD1-CG 3.74Å; F87-M268 HydrophobicContact CD1-SD 4.23Å; F87-M268 HydrophobicContact CE1-CB 3.47Å; F87-M268 VanDerWaalsContact CE1-CB 3.47Å; F87-M268 HydrophobicContact CE1-CG 3.97Å; F87-M268 HydrophobicContact CE1-SD 4.48Å; F87-M268 HydrophobicContact CE2-CB 4.42Å; F87-M268 HydrophobicContact CG-CB 4.41Å; F87-M268 HydrophobicContact CG-CG 4.28Å; F87-M268 HydrophobicContact CZ-CB 3.83Å; F87-M268 VanDerWaalsContact CZ-N 3.29Å
88	M	94.3	Very high	89.4	Confident	6 Å²	6	51.9 Å²	51.9	3%	0.03	24%	0.239	C	C	.	.	H	α-helix	trans	-60.6	-43	-178.5	-68.8	-60	-76	0	0	110.9	I84 V85 H92 F107 L169 V264 F345	I84-M88 HydrophobicContact CG2-CG 4.46Å; I84-M88 WeakPolarHBondContact O-CG 3.36Å; I84-M88 PolarHBondContact O-N 3.42Å; V85-M88 PolarHBondContact O-N 3.3Å; M88-H92 VanDerWaalsContact O-CB 3.31Å; M88-H92 WeakPolarHBondContact O-CB 3.21Å; M88-H92 PolarHBondContact O-N 3.06Å; M88-H92 VanDerWaalsContact O-N 3.08Å; M88-F107 HydrophobicContact CE-CD1 4.07Å; M88-F107 HydrophobicContact CE-CD2 3.96Å; M88-F107 HydrophobicContact CE-CE1 3.59Å; M88-F107 HydrophobicContact CE-CE2 3.48Å; M88-F107 VanDerWaalsContact CE-CE2 3.48Å; M88-F107 HydrophobicContact CE-CG 4.24Å; M88-F107 HydrophobicContact CE-CZ 3.26Å; M88-L169 HydrophobicContact CB-CD1 4.31Å; M88-L169 HydrophobicContact CE-CD2 4.41Å; M88-L169 HydrophobicContact CG-CD1 4.2Å; M88-L169 HydrophobicContact CG-CD2 4.35Å; M88-V264 HydrophobicContact CE-CG1 4.25Å; M88-V264 HydrophobicContact SD-CG1 3.94Å; M88-F345 HydrophobicContact CE-CE1 4.33Å; M88-F345 HydrophobicContact CE-CZ 4.14Å; M88-F345 HydrophobicContact SD-CZ 4.49Å
89	F	91.2	Very high	88.1	Confident	112 Å²	112	54.4 Å²	54.4	49%	0.491	25%	0.252	S	S	.	.	H	α-helix	trans	-63.8	-51.3	176.2	-173.3	-96.3	0	0	0	112.2	V85 D86 F87 R91 H92 V93 L106	V85-F89 WeakPolarHBondContact O-CB 3.34Å; V85-F89 PolarHBondContact O-N 3.49Å; D86-F89 PolarHBondContact O-N 2.88Å; F87-F89 VanDerWaalsContact C-N 3.31Å; F87-F89 PolarHBondContact O-N 2.68Å; F89-R91 PolarHBondContact O-N 3.49Å; F89-H92 WeakPolarHBondContact O-CB 3.17Å; F89-H92 PolarHBondContact O-N 3.03Å; F89-V93 HydrophobicContact CD1-CG2 4.19Å; F89-V93 HydrophobicContact CE1-CG2 3.86Å; F89-V93 HydrophobicContact CZ-CG2 4.16Å; F89-V93 WeakPolarHBondContact O-CG2 3.33Å; F89-V93 PolarHBondContact O-N 2.75Å; F89-L106 HydrophobicContact CE2-CD1 4.36Å
90	K	90.5	Very high	86.5	Confident	98 Å²	98	61.9 Å²	61.9	43%	0.426	29%	0.292	S	S	.	.	H	α-helix	trans	-65.3	-36.7	-179.7	-75.8	174.5	175.3	161.9	0	113.2	D86 F87 H92 R94	D86-K90 VanDerWaalsContact CG-NZ 3.34Å; D86-K90 WeakPolarHBondContact O-CB 3.26Å; D86-K90 WeakPolarHBondContact O-CG 3.42Å; D86-K90 PolarHBondContact O-N 3.11Å; D86-K90 WeakPolarHBondContact OD1-CE 3.38Å; D86-K90 IonicContact OD1-NZ 3.03Å; D86-K90 PolarHBondContact OD1-NZ 2.82Å; D86-K90 WeakPolarHBondContact OD2-CD 3.16Å; D86-K90 WeakPolarHBondContact OD2-CE 3.38Å; D86-K90 IonicContact OD2-NZ 2.63Å; D86-K90 PolarHBondContact OD2-NZ 3.39Å; F87-K90 PolarHBondContact O-N 3.02Å; K90-H92 VanDerWaalsContact C-N 3.33Å; K90-R94 WeakPolarHBondContact O-CG 3.41Å; K90-R94 PolarHBondContact O-N 2.7Å; K90-R94 PolarHBondContact O-NE 2.88Å
91	R	89.3	Confident	84.8	Confident	28 Å²	28	65.4 Å²	65.4	11%	0.106	31%	0.309	C	S	.	.	H	α-helix	trans	-62.3	-46	174.1	174.4	170.6	171.6	77.1	-6.8	109.9	F87 F89 R94 H95 V264 E267	F87-R91 HydrophobicContact CZ-CB 4.36Å; F87-R91 VanDerWaalsContact O-CB 3.26Å; F87-R91 WeakPolarHBondContact O-CB 3.16Å; F87-R91 PolarHBondContact O-N 3.41Å; F89-R91 PolarHBondContact O-N 3.49Å; R91-R94 PolarHBondContact O-N 2.64Å; R91-H95 VanDerWaalsContact CZ-NE2 3.3Å; R91-H95 PolarHBondContact NH1-NE2 3.05Å; R91-H95 PolarHBondContact NH2-NE2 2.94Å; R91-H95 PolarHBondContact O-CD2 2.94Å; R91-H95 PolarHBondContact O-N 3.14Å; R91-H95 VanDerWaalsContact O-N 3.1Å; R91-V264 VanDerWaalsContact NE-CG2 3.29Å; R91-E267 IonicContact CZ-OE1 3.89Å; R91-E267 IonicContact CZ-OE2 2.62Å; R91-E267 IonicContact NE-OE2 3.14Å; R91-E267 IonicContact NH1-OE1 3.93Å; R91-E267 PolarHBondContact NH1-OE1 3.34Å; R91-E267 IonicContact NH1-OE2 2.85Å; R91-E267 PolarHBondContact NH1-OE2 3.33Å
92	H	81.8	Confident	82.4	Confident	35 Å²	35	71.2 Å²	71.2	16%	0.162	35%	0.351	C	S	.	.	H	α-helix	trans	-61.5	-47.9	179.1	179.4	56.7	0	0	0	112.4	M88 F89 K90 R94 H95 V96 P105	M88-H92 VanDerWaalsContact O-CB 3.31Å; M88-H92 WeakPolarHBondContact O-CB 3.21Å; M88-H92 PolarHBondContact O-N 3.06Å; M88-H92 VanDerWaalsContact O-N 3.08Å; F89-H92 WeakPolarHBondContact O-CB 3.17Å; F89-H92 PolarHBondContact O-N 3.03Å; K90-H92 VanDerWaalsContact C-N 3.33Å; H92-R94 VanDerWaalsContact C-N 3.29Å; H92-R94 PolarHBondContact O-N 2.74Å; H92-H95 WeakPolarHBondContact O-CB 3.41Å; H92-H95 PolarHBondContact O-N 3.35Å; H92-V96 WeakPolarHBondContact CE1-CG2 3.27Å; H92-V96 VanDerWaalsContact NE2-CG2 3.26Å; H92-V96 WeakPolarHBondContact NE2-CG2 3.19Å; H92-V96 PolarHBondContact O-N 3Å; H92-P105 PolarHBondContact CD2-O 3.21Å; H92-P105 WeakPolarHBondContact CE1-CB 3.26Å; H92-P105 WeakPolarHBondContact CE1-CD 3.13Å; H92-P105 WeakPolarHBondContact CE1-CG 3.48Å; H92-P105 WeakPolarHBondContact NE2-CD 3.45Å; H92-P105 PolarHBondContact NE2-O 2.9Å
93	V	79.5	Confident	80.2	Confident	72 Å²	72	69.5 Å²	69.5	44%	0.436	35%	0.352	S	S	.	.	H	α-helix	trans	-55.2	-43.5	176.3	170.6	0	0	0	0	111.8	F89 H95 V96 Y97	F89-V93 HydrophobicContact CD1-CG2 4.19Å; F89-V93 HydrophobicContact CE1-CG2 3.86Å; F89-V93 HydrophobicContact CZ-CG2 4.16Å; F89-V93 WeakPolarHBondContact O-CG2 3.33Å; F89-V93 PolarHBondContact O-N 2.75Å; V93-H95 PolarHBondContact O-N 3.02Å; V93-V96 PolarHBondContact O-N 3.19Å; V93-Y97 WeakPolarHBondContact O-CB 3.47Å; V93-Y97 PolarHBondContact O-N 2.84Å
94	R	80.5	Confident	77.8	Confident	133 Å²	133	74.7 Å²	74.7	50%	0.502	39%	0.386	S	S	.	.	H	α-helix	trans	-61.5	-42	176.2	-77.1	-179.6	-79.9	162.7	-5.6	112.4	K90 R91 H92 N98	K90-R94 WeakPolarHBondContact O-CG 3.41Å; K90-R94 PolarHBondContact O-N 2.7Å; K90-R94 PolarHBondContact O-NE 2.88Å; R91-R94 PolarHBondContact O-N 2.64Å; H92-R94 VanDerWaalsContact C-N 3.29Å; H92-R94 PolarHBondContact O-N 2.74Å; R94-N98 WeakPolarHBondContact O-CB 3.49Å; R94-N98 PolarHBondContact O-N 2.84Å; R94-N98 PolarHBondContact O-ND2 2.91Å
95	H	76.3	Confident	75.8	Confident	81 Å²	81	76.4 Å²	76.4	38%	0.375	40%	0.398	S	S	.	.	H	α-helix	trans	-65.3	-41	177.1	-89.8	-74	0	0	0	113	R91 H92 V93 N99	R91-H95 VanDerWaalsContact CZ-NE2 3.3Å; R91-H95 PolarHBondContact NH1-NE2 3.05Å; R91-H95 PolarHBondContact NH2-NE2 2.94Å; R91-H95 PolarHBondContact O-CD2 2.94Å; R91-H95 PolarHBondContact O-N 3.14Å; R91-H95 VanDerWaalsContact O-N 3.1Å; H92-H95 WeakPolarHBondContact O-CB 3.41Å; H92-H95 PolarHBondContact O-N 3.35Å; V93-H95 PolarHBondContact O-N 3.02Å; H95-N99 WeakPolarHBondContact O-CB 3.21Å; H95-N99 PolarHBondContact O-N 3.34Å; H95-N99 PolarHBondContact O-ND2 3.06Å
96	V	74.5	Confident	74.6	Confident	25 Å²	25	79.3 Å²	79.3	15%	0.152	41%	0.411	C	S	.	.	H	α-helix	trans	-66	-47	177.4	173.3	0	0	0	0	110.9	H92 V93 N99 N100 Q101	H92-V96 WeakPolarHBondContact CE1-CG2 3.27Å; H92-V96 VanDerWaalsContact NE2-CG2 3.26Å; H92-V96 WeakPolarHBondContact NE2-CG2 3.19Å; H92-V96 PolarHBondContact O-N 3Å; V93-V96 PolarHBondContact O-N 3.19Å; V96-N99 PolarHBondContact O-N 2.84Å; V96-N100 PolarHBondContact O-N 2.89Å; V96-Q101 HydrophobicContact CG1-CB 4.21Å; V96-Q101 WeakPolarHBondContact CG1-O 3.37Å; V96-Q101 PolarHBondContact O-N 3.23Å
97	Y	72.4	Confident	74.3	Confident	189 Å²	189	79.1 Å²	79.1	74%	0.741	41%	0.409	S	S	*	.	H	α-helix	trans	-59.7	-48.4	178.9	-177	-96.8	0	0	0	111.9	V93 N99 N100	V93-Y97 WeakPolarHBondContact O-CB 3.47Å; V93-Y97 PolarHBondContact O-N 2.84Å; Y97-N99 PolarHBondContact O-N 3.35Å; Y97-N100 PolarHBondContact O-N 2.89Å
98	N	75.5	Confident	74.2	Confident	118 Å²	118	80.3 Å²	80.3	63%	0.631	42%	0.418	S	S	*	.	H	α-helix	trans	-66.9	-23.3	-178	-71.3	-12.2	0	0	0	113.6	R94	R94-N98 WeakPolarHBondContact O-CB 3.49Å; R94-N98 PolarHBondContact O-N 2.84Å; R94-N98 PolarHBondContact O-ND2 2.91Å
99	N	71.3	Confident	74.3	Confident	60 Å²	60	82.8 Å²	82.8	32%	0.321	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.8	12.2	-177	-66.5	-43	0	0	0	113.5	H95 V96 Y97 Q101	H95-N99 WeakPolarHBondContact O-CB 3.21Å; H95-N99 PolarHBondContact O-N 3.34Å; H95-N99 PolarHBondContact O-ND2 3.06Å; V96-N99 PolarHBondContact O-N 2.84Å; Y97-N99 PolarHBondContact O-N 3.35Å; N99-Q101 HydrophobicContact CB-CG 3.91Å; N99-Q101 VanDerWaalsContact O-CG 3.31Å; N99-Q101 WeakPolarHBondContact O-CG 3.37Å; N99-Q101 PolarHBondContact O-N 2.91Å; N99-Q101 VanDerWaalsContact O-N 3.11Å
100	N	64.6	Low	74.6	Confident	160 Å²	160	80.8 Å²	80.8	86%	0.856	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.1	36.6	-176.8	-80.3	-17.9	0	0	0	113.5	V96 Y97	V96-N100 PolarHBondContact O-N 2.89Å; Y97-N100 PolarHBondContact O-N 2.89Å
101	Q	60.8	Low	75	Confident	74 Å²	74	77.4 Å²	77.4	35%	0.346	41%	0.407	S	S	.	.			trans	-94.1	145.1	-178.7	-62.5	-153.8	-30.2	0	0	111.8	V96 N99 R204	V96-Q101 HydrophobicContact CG1-CB 4.21Å; V96-Q101 WeakPolarHBondContact CG1-O 3.37Å; V96-Q101 PolarHBondContact O-N 3.23Å; N99-Q101 HydrophobicContact CB-CG 3.91Å; N99-Q101 VanDerWaalsContact O-CG 3.31Å; N99-Q101 WeakPolarHBondContact O-CG 3.37Å; N99-Q101 PolarHBondContact O-N 2.91Å; N99-Q101 VanDerWaalsContact O-N 3.11Å; Q101-R204 VanDerWaalsContact CD-CZ 3.48Å; Q101-R204 VanDerWaalsContact NE2-NE 3.16Å
102	S	49.1	Very low	75.4	Confident	133 Å²	133	83.2 Å²	83.2	93%	0.93	44%	0.435	S	S	*	.			trans	-96.1	111.8	158.8	-179.1	0	0	0	0	107.1
103	G	50.2	Low	76.1	Confident	36 Å²	36	84 Å²	84	37%	0.371	44%	0.44	S	S	.	.			trans	179.2	130.3	175.4	0	0	0	0	0	112.3	P105	G103-P105 WeakPolarHBondContact O-CD 3.34Å
104	T	47	Very low	76.9	Confident	127 Å²	127	81.8 Å²	81.8	78%	0.779	43%	0.428	S	S	*	.			trans	-93.6	93.7	164.6	42.7	0	0	0	0	109.4	L106	T104-L106 VanDerWaalsContact C-N 3.26Å; T104-L106 PolarHBondContact O-N 2.86Å
105	P	55.5	Low	77.7	Confident	37 Å²	37	75.7 Å²	75.7	24%	0.24	41%	0.406	C	S	.	.			trans	-76.6	86.3	147.5	-26.6	28.3	0	0	0	111	H92 G103 F107	H92-P105 PolarHBondContact CD2-O 3.21Å; H92-P105 WeakPolarHBondContact CE1-CB 3.26Å; H92-P105 WeakPolarHBondContact CE1-CD 3.13Å; H92-P105 WeakPolarHBondContact CE1-CG 3.48Å; H92-P105 WeakPolarHBondContact NE2-CD 3.45Å; H92-P105 PolarHBondContact NE2-O 2.9Å; G103-P105 WeakPolarHBondContact O-CD 3.34Å; P105-F107 PolarHBondContact O-N 3.34Å
106	L	71.1	Confident	78.8	Confident	99 Å²	99	72.2 Å²	72.2	52%	0.518	39%	0.39	S	S	.	.			trans	-72.4	112.2	167.6	-144.4	88.8	0	0	0	106.8	F89 T104 S108	F89-L106 HydrophobicContact CE2-CD1 4.36Å; T104-L106 VanDerWaalsContact C-N 3.26Å; T104-L106 PolarHBondContact O-N 2.86Å; L106-S108 PolarHBondContact O-N 3.46Å
107	F	88.9	Confident	79.9	Confident	32 Å²	32	71.4 Å²	71.4	14%	0.14	39%	0.385	C	S	.	.			trans	-62	96.5	156.1	-91.3	-90.4	0	0	0	106.3	M88 P105 L109 A167 L169 V194 R195	M88-F107 HydrophobicContact CE-CD1 4.07Å; M88-F107 HydrophobicContact CE-CD2 3.96Å; M88-F107 HydrophobicContact CE-CE1 3.59Å; M88-F107 HydrophobicContact CE-CE2 3.48Å; M88-F107 VanDerWaalsContact CE-CE2 3.48Å; M88-F107 HydrophobicContact CE-CG 4.24Å; M88-F107 HydrophobicContact CE-CZ 3.26Å; P105-F107 PolarHBondContact O-N 3.34Å; F107-L109 PolarHBondContact O-N 3.23Å; F107-A167 HydrophobicContact CD1-CB 4.02Å; F107-A167 HydrophobicContact CD2-CB 4.08Å; F107-A167 HydrophobicContact CE1-CB 4.06Å; F107-A167 HydrophobicContact CE2-CB 4.11Å; F107-A167 HydrophobicContact CG-CB 4.05Å; F107-A167 HydrophobicContact CZ-CB 4.11Å; F107-L169 HydrophobicContact CB-CD1 4.17Å; F107-L169 HydrophobicContact CB-CG 4.05Å; F107-L169 HydrophobicContact CD1-CD2 3.75Å; F107-L169 HydrophobicContact CD1-CG 3.77Å; F107-L169 HydrophobicContact CE1-CD2 4.2Å; F107-L169 HydrophobicContact CG-CG 4.26Å; F107-V194 WeakPolarHBondContact CE1-O 3.35Å; F107-R195 HydrophobicContact CZ-CB 4.08Å; F107-R195 HydrophobicContact CZ-CG 4.39Å
108	S	93.8	Very high	81.1	Confident	31 Å²	31	65.2 Å²	65.2	22%	0.217	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	124.9	175.9	-66.9	0	0	0	0	108.3	L106 A167 F168 L169	L106-S108 PolarHBondContact O-N 3.46Å; S108-A167 PolarHBondContact N-O 3.03Å; S108-F168 CarbonylContact O-C 3.38Å; S108-F168 VanDerWaalsContact O-CA 3.28Å; S108-F168 WeakPolarHBondContact O-CA 3.34Å; S108-F168 WeakPolarHBondContact O-CB 3.25Å; S108-L169 PolarHBondContact O-N 2.98Å
109	L	96.4	Very high	82.2	Confident	59 Å²	59	60.6 Å²	60.6	31%	0.309	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	125	177.6	177.2	64	0	0	0	109.7	V85 F107 D111 L169 A171	V85-L109 HydrophobicContact CG2-CD1 4.09Å; V85-L109 HydrophobicContact CG2-CD2 4.06Å; F107-L109 PolarHBondContact O-N 3.23Å; L109-D111 HydrophobicContact CD1-CB 4.27Å; L109-D111 HydrophobicContact CD2-CB 4.48Å; L109-D111 HydrophobicContact CG-CB 4.19Å; L109-L169 HydrophobicContact CD1-CB 3.98Å; L109-A171 HydrophobicContact CD1-CB 4.3Å
110	Y	98	Very high	83.4	Confident	70 Å²	70	65.2 Å²	65.2	28%	0.275	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	98.6	171.7	-67	-91.2	0	0	0	109	L113 L160 L165 F168 L169 V170 A171	Y110-L113 HydrophobicContact CD1-CD2 4.31Å; Y110-L160 HydrophobicContact CD1-CD2 4.05Å; Y110-L160 HydrophobicContact CD2-CD1 4.17Å; Y110-L160 HydrophobicContact CD2-CD2 4.11Å; Y110-L160 HydrophobicContact CE1-CD2 3.93Å; Y110-L160 HydrophobicContact CE2-CD2 4Å; Y110-L160 HydrophobicContact CG-CD1 4.36Å; Y110-L160 HydrophobicContact CG-CD2 4.14Å; Y110-L165 HydrophobicContact CE2-CD1 3.56Å; Y110-L165 VanDerWaalsContact OH-CD1 3.32Å; Y110-L165 WeakPolarHBondContact OH-CD1 3.25Å; Y110-F168 HydrophobicContact CD2-CB 4.23Å; Y110-F168 HydrophobicContact CE2-CB 4.17Å; Y110-L169 PolarHBondContact N-O 3.27Å; Y110-V170 CarbonylContact O-C 3.58Å; Y110-V170 VanDerWaalsContact O-CA 3.3Å; Y110-V170 WeakPolarHBondContact O-CA 3.43Å; Y110-A171 PolarHBondContact O-N 3.43Å
111	D	98	Very high	85	Confident	27 Å²	27	61 Å²	61	14%	0.144	33%	0.33	C	S	.	.			trans	-119.5	7.4	-176.3	61.4	-5.8	0	0	0	114.7	H70 N71 K81 L109 A171	H70-D111 PolarHBondContact NE2-O 2.83Å; N71-D111 PolarHBondContact ND2-O 3.24Å; N71-D111 PolarHBondContact OD1-OD2 2.79Å; K81-D111 HydrophobicContact CD-CB 4.46Å; K81-D111 IonicContact NZ-OD2 2.94Å; K81-D111 PolarHBondContact NZ-OD2 3.24Å; L109-D111 HydrophobicContact CD1-CB 4.27Å; L109-D111 HydrophobicContact CD2-CB 4.48Å; L109-D111 HydrophobicContact CG-CB 4.19Å; D111-A171 VanDerWaalsContact CA-O 3.23Å; D111-A171 WeakPolarHBondContact CA-O 3.19Å; D111-A171 HydrophobicContact CB-CB 4.05Å
112	H	97.2	Very high	86.8	Confident	149 Å²	149	57.5 Å²	57.5	69%	0.69	31%	0.314	S	S	*	.			trans	-123.8	16.4	180	-68	80.3	0	0	0	113.1	N71	N71-H112 PolarHBondContact ND2-CE1 3.34Å; N71-H112 PolarHBondContact ND2-NE2 2.85Å
113	L	96.9	Very high	89.1	Confident	52 Å²	52	51.2 Å²	51.2	27%	0.272	27%	0.27	S	S	.	.			trans	-66.4	139.8	176.3	-62	179.6	0	0	0	110.2	Y110 R150 H156 L160 V170	Y110-L113 HydrophobicContact CD1-CD2 4.31Å; L113-R150 PolarHBondContact O-NH1 2.94Å; L113-H156 HydrophobicContact CD1-CB 3.94Å; L113-L160 HydrophobicContact CD1-CD1 4.38Å; L113-V170 HydrophobicContact CD1-CG1 3.99Å
114	S	96.9	Very high	91.3	Very high	26 Å²	26	52.3 Å²	52.3	18%	0.182	27%	0.267	C	S	.	.			trans	-57.1	136.9	175.2	179.8	0	0	0	0	110.9	V116 R150	S114-V116 PolarHBondContact O-N 2.89Å; S114-V116 PolarHBondContact OG-N 3.13Å; S114-V116 VanDerWaalsContact OG-N 3.15Å; S114-R150 PolarHBondContact O-NH1 2.85Å
115	P	98	Very high	93.6	Very high	5 Å²	5	46.5 Å²	46.5	3%	0.032	23%	0.232	C	C	.	.	S	Bend	trans	-71.6	-17.9	171.6	30.8	-34.7	0	0	0	112.4	V117 L149 R150 Y175	P115-V117 PolarHBondContact O-N 3.11Å; P115-L149 HydrophobicContact CB-CD2 4.36Å; P115-L149 HydrophobicContact CG-CD2 4.4Å; P115-L149 WeakPolarHBondContact O-CA 3.49Å; P115-R150 HydrophobicContact CB-CG 4.39Å; P115-R150 PolarHBondContact O-N 3.15Å; P115-Y175 HydrophobicContact CB-CD2 4.14Å; P115-Y175 HydrophobicContact CB-CE2 3.53Å; P115-Y175 HydrophobicContact CG-CE2 4.21Å
116	V	98.1	Very high	95.5	Very high	8 Å²	8	44.8 Å²	44.8	5%	0.048	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	118.7	176.2	-178.9	0	0	0	0	109.5	I44 Q47 S114 L143 T147 L149	I44-V116 HydrophobicContact CB-CG2 3.71Å; I44-V116 HydrophobicContact CG2-CG2 3.65Å; Q47-V116 VanDerWaalsContact OE1-CB 3.23Å; Q47-V116 VanDerWaalsContact OE1-CG1 3.26Å; Q47-V116 PolarHBondContact OE1-O 3.45Å; S114-V116 PolarHBondContact O-N 2.89Å; S114-V116 PolarHBondContact OG-N 3.13Å; S114-V116 VanDerWaalsContact OG-N 3.15Å; V116-L143 HydrophobicContact CG1-CD2 3.91Å; V116-L143 HydrophobicContact CG2-CD2 4.09Å; V116-T147 HydrophobicContact CG1-CG2 3.51Å; V116-L149 HydrophobicContact CG2-CD2 3.94Å
117	V	98.1	Very high	96.6	Very high	8 Å²	8	41.4 Å²	41.4	5%	0.048	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	158.5	-179	-62.1	0	0	0	0	110.4	P115 K121 N122 V148 R150 A155	P115-V117 PolarHBondContact O-N 3.11Å; V117-K121 HydrophobicContact CB-CB 4.21Å; V117-N122 HydrophobicContact CG2-CB 3.88Å; V117-V148 HydrophobicContact CG2-CG2 3.77Å; V117-V148 PolarHBondContact N-O 2.95Å; V117-V148 PolarHBondContact O-N 3.1Å; V117-V148 VanDerWaalsContact O-O 3.1Å; V117-R150 HydrophobicContact CG1-CB 4.19Å; V117-R150 HydrophobicContact CG2-CB 3.67Å; V117-A155 HydrophobicContact CG2-CB 4.38Å
118	T	98	Very high	96.9	Very high	58 Å²	58	40.3 Å²	40.3	36%	0.356	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	154.6	173	62.7	0	0	0	0	110.8	R120 K121 N122 T146	T118-R120 PolarHBondContact O-N 3.21Å; T118-K121 PolarHBondContact O-N 3Å; T118-K121 WeakPolarHBondContact OG1-CG 2.93Å; T118-K121 PolarHBondContact OG1-N 3.28Å; T118-N122 PolarHBondContact O-N 3.24Å; T118-T146 CarbonylContact C-O 3.53Å; T118-T146 VanDerWaalsContact CA-O 3.28Å; T118-T146 WeakPolarHBondContact CA-O 3.32Å
119	V	97.8	Very high	96.8	Very high	21 Å²	21	40.4 Å²	40.4	13%	0.127	20%	0.197	C	C	.	.	H	α-helix	trans	-52.4	-37.1	170.2	164.7	0	0	0	0	111	K121 N122 F123 Y142 E145 T146 V148	V119-K121 PolarHBondContact O-N 3.01Å; V119-N122 PolarHBondContact O-N 2.86Å; V119-F123 HydrophobicContact CG1-CD2 4.11Å; V119-F123 PolarHBondContact O-N 3.41Å; V119-Y142 HydrophobicContact CG2-CD1 4.46Å; V119-Y142 HydrophobicContact CG2-CE1 3.8Å; V119-E145 WeakPolarHBondContact CG2-O 3.38Å; V119-T146 PolarHBondContact N-O 2.95Å; V119-V148 HydrophobicContact CG2-CG1 3.9Å
120	R	97.3	Very high	96.5	Very high	157 Å²	157	43 Å²	43	59%	0.592	22%	0.218	S	C	*	.	H	α-helix	trans	-58.5	-47.5	174.3	-178.1	-175.5	172.2	92.7	-1.5	112.7	T118 D124 S125	T118-R120 PolarHBondContact O-N 3.21Å; R120-D124 VanDerWaalsContact CA-OD2 3.26Å; R120-D124 WeakPolarHBondContact CA-OD2 3.45Å; R120-D124 HydrophobicContact CB-CB 4.47Å; R120-D124 HydrophobicContact CG-CB 4.15Å; R120-D124 PolarHBondContact O-N 3.44Å; R120-S125 WeakPolarHBondContact O-CB 3.42Å; R120-S125 PolarHBondContact O-N 2.96Å
121	K	98	Very high	96.1	Very high	73 Å²	73	46.4 Å²	46.4	32%	0.317	24%	0.24	S	C	.	.	H	α-helix	trans	-66.6	-46.9	179.4	-73.5	-176	-172.6	-161.8	0	111	V117 T118 V119 F123 S125 A155 D159	V117-K121 HydrophobicContact CB-CB 4.21Å; T118-K121 PolarHBondContact O-N 3Å; T118-K121 WeakPolarHBondContact OG1-CG 2.93Å; T118-K121 PolarHBondContact OG1-N 3.28Å; V119-K121 PolarHBondContact O-N 3.01Å; K121-F123 PolarHBondContact O-N 3.47Å; K121-S125 PolarHBondContact O-OG 3.25Å; K121-A155 WeakPolarHBondContact O-CA 3.4Å; K121-D159 WeakPolarHBondContact CD-OD2 3.47Å; K121-D159 WeakPolarHBondContact CE-OD2 3.23Å; K121-D159 IonicContact NZ-OD2 2.74Å; K121-D159 PolarHBondContact NZ-OD2 3.24Å
122	N	98.5	Very high	95.7	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-70.2	-31.2	-176.5	-157	79.9	0	0	0	113.4	V117 T118 V119 V148 R150 S151 H152 A155	V117-N122 HydrophobicContact CG2-CB 3.88Å; T118-N122 PolarHBondContact O-N 3.24Å; V119-N122 PolarHBondContact O-N 2.86Å; N122-V148 HydrophobicContact CB-CG2 3.83Å; N122-R150 VanDerWaalsContact OD1-CA 3.23Å; N122-R150 WeakPolarHBondContact OD1-CA 3.05Å; N122-S151 PolarHBondContact ND2-OG 2.98Å; N122-S151 PolarHBondContact OD1-N 3.3Å; N122-H152 PolarHBondContact O-CE1 3.23Å; N122-H152 PolarHBondContact O-NE2 3.18Å; N122-A155 HydrophobicContact CB-CB 4.32Å
123	F	97.6	Very high	95.4	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-129	-58.2	-171.7	-55.4	-70.7	0	0	0	114.3	V119 K121 S125 L126 F127 I128 S134 R135 T140	V119-F123 HydrophobicContact CG1-CD2 4.11Å; V119-F123 PolarHBondContact O-N 3.41Å; K121-F123 PolarHBondContact O-N 3.47Å; F123-S125 VanDerWaalsContact C-N 3.33Å; F123-S125 PolarHBondContact O-N 3.12Å; F123-L126 CarbonylContact O-C 3.52Å; F123-L126 PolarHBondContact O-N 2.83Å; F123-F127 PolarHBondContact O-N 3.17Å; F123-I128 HydrophobicContact CB-CB 4.05Å; F123-I128 HydrophobicContact CB-CG2 4.35Å; F123-I128 HydrophobicContact CD1-CB 4.31Å; F123-I128 HydrophobicContact CD1-CD1 3.79Å; F123-I128 HydrophobicContact CD1-CG2 3.98Å; F123-I128 PolarHBondContact O-N 2.82Å; F123-I128 VanDerWaalsContact O-N 3.16Å; F123-S134 WeakPolarHBondContact CE1-O 3.47Å; F123-S134 WeakPolarHBondContact CZ-O 3.34Å; F123-R135 HydrophobicContact CB-CG 4.34Å; F123-R135 HydrophobicContact CD1-CG 3.8Å; F123-R135 HydrophobicContact CD2-CG 4.02Å; F123-R135 HydrophobicContact CE1-CG 3.98Å; F123-R135 HydrophobicContact CE2-CG 4.17Å; F123-R135 HydrophobicContact CG-CG 3.81Å; F123-R135 HydrophobicContact CZ-CG 4.14Å; F123-T140 HydrophobicContact CE2-CG2 4.41Å; F123-T140 HydrophobicContact CZ-CG2 4.13Å
124	D	95.6	Very high	95.2	Very high	60 Å²	60	44 Å²	44	32%	0.321	24%	0.238	S	C	.	.	G	3₁₀ helix	trans	-63.8	-38.1	-170.9	-52.4	-30.3	0	0	0	112.6	R120 L126 F127 R135	R120-D124 VanDerWaalsContact CA-OD2 3.26Å; R120-D124 WeakPolarHBondContact CA-OD2 3.45Å; R120-D124 HydrophobicContact CB-CB 4.47Å; R120-D124 HydrophobicContact CG-CB 4.15Å; R120-D124 PolarHBondContact O-N 3.44Å; D124-L126 PolarHBondContact O-N 3.39Å; D124-F127 PolarHBondContact O-N 3.44Å; D124-R135 IonicContact OD1-CZ 3.75Å; D124-R135 VanDerWaalsContact OD1-CZ 3.25Å; D124-R135 IonicContact OD1-NH1 2.7Å; D124-R135 PolarHBondContact OD1-NH1 3.01Å; D124-R135 IonicContact OD1-NH2 2.7Å; D124-R135 PolarHBondContact OD1-NH2 2.97Å
125	S	95.1	Very high	95.1	Very high	5 Å²	5	44 Å²	44	4%	0.035	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-63.8	-20.7	179.1	78.5	0	0	0	0	113	R120 K121 F123	R120-S125 WeakPolarHBondContact O-CB 3.42Å; R120-S125 PolarHBondContact O-N 2.96Å; K121-S125 PolarHBondContact O-OG 3.25Å; F123-S125 VanDerWaalsContact C-N 3.33Å; F123-S125 PolarHBondContact O-N 3.12Å
126	L	96.3	Very high	94.8	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-108.2	15.1	-177.7	-60.1	-179.4	0	0	0	112.3	F123 D124 I128 H152 Q157 P287 F288 L331	F123-L126 CarbonylContact O-C 3.52Å; F123-L126 PolarHBondContact O-N 2.83Å; D124-L126 PolarHBondContact O-N 3.39Å; L126-I128 HydrophobicContact CB-CD1 4.38Å; L126-I128 HydrophobicContact CB-CG1 4.23Å; L126-I128 PolarHBondContact O-N 3.32Å; L126-I128 VanDerWaalsContact O-N 3.08Å; L126-H152 WeakPolarHBondContact CD1-CE1 3.07Å; L126-Q157 HydrophobicContact CD2-CB 4.45Å; L126-P287 CarbonylContact O-C 3.53Å; L126-P287 WeakPolarHBondContact O-CB 3.38Å; L126-F288 HydrophobicContact CB-CB 3.9Å; L126-F288 HydrophobicContact CB-CD1 3.66Å; L126-F288 HydrophobicContact CB-CE1 4.48Å; L126-F288 HydrophobicContact CB-CG 4Å; L126-F288 HydrophobicContact CD1-CD1 4.21Å; L126-F288 HydrophobicContact CD1-CE1 4.35Å; L126-F288 HydrophobicContact CD2-CB 4.01Å; L126-F288 HydrophobicContact CD2-CG 4.14Å; L126-F288 HydrophobicContact CG-CD1 4.35Å; L126-F288 HydrophobicContact CG-CG 4.46Å; L126-F288 WeakPolarHBondContact O-CB 3.46Å; L126-F288 PolarHBondContact O-N 3.45Å; L126-L331 HydrophobicContact CD2-CD1 3.89Å
127	F	94.5	Very high	94.5	Very high	28 Å²	28	44.3 Å²	44.3	12%	0.123	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.5	20	179.7	-42	-62.9	0	0	0	115	F123 D124 P129 V235 P287 R328 E330 L331	F123-F127 PolarHBondContact O-N 3.17Å; D124-F127 PolarHBondContact O-N 3.44Å; F127-P129 VanDerWaalsContact O-CD 3.26Å; F127-P129 WeakPolarHBondContact O-CD 3.2Å; F127-V235 HydrophobicContact CD1-CB 4.02Å; F127-V235 HydrophobicContact CD1-CG1 4.15Å; F127-V235 HydrophobicContact CD1-CG2 3.78Å; F127-V235 HydrophobicContact CE1-CB 4.35Å; F127-V235 HydrophobicContact CE1-CG1 4.37Å; F127-V235 HydrophobicContact CE1-CG2 3.68Å; F127-V235 HydrophobicContact CG-CG1 4.31Å; F127-P287 HydrophobicContact CB-CB 4.27Å; F127-P287 WeakPolarHBondContact O-CB 3.39Å; F127-R328 HydrophobicContact CD2-CB 4.15Å; F127-R328 HydrophobicContact CD2-CG 4.27Å; F127-R328 HydrophobicContact CE2-CB 3.66Å; F127-R328 HydrophobicContact CE2-CG 4.29Å; F127-E330 HydrophobicContact CE1-CB 4.21Å; F127-E330 HydrophobicContact CE2-CB 4.34Å; F127-E330 HydrophobicContact CZ-CB 3.68Å; F127-L331 HydrophobicContact CE2-CB 3.82Å; F127-L331 HydrophobicContact CZ-CB 3.93Å
128	I	94.7	Very high	94.1	Very high	10 Å²	10	44.2 Å²	44.2	5%	0.051	23%	0.234	C	C	.	.			trans	-66.5	123	173.9	-62.2	179.2	0	0	0	106.8	F123 L126 H132 R135 P287	F123-I128 HydrophobicContact CB-CB 4.05Å; F123-I128 HydrophobicContact CB-CG2 4.35Å; F123-I128 HydrophobicContact CD1-CB 4.31Å; F123-I128 HydrophobicContact CD1-CD1 3.79Å; F123-I128 HydrophobicContact CD1-CG2 3.98Å; F123-I128 PolarHBondContact O-N 2.82Å; F123-I128 VanDerWaalsContact O-N 3.16Å; L126-I128 HydrophobicContact CB-CD1 4.38Å; L126-I128 HydrophobicContact CB-CG1 4.23Å; L126-I128 PolarHBondContact O-N 3.32Å; L126-I128 VanDerWaalsContact O-N 3.08Å; I128-H132 HydrophobicContact CG2-CB 3.53Å; I128-R135 HydrophobicContact CG2-CG 4.38Å; I128-R135 PolarHBondContact O-NE 3.36Å; I128-R135 PolarHBondContact O-NH2 3.2Å; I128-P287 HydrophobicContact CG1-CB 4.3Å; I128-P287 HydrophobicContact CG1-CG 4.1Å
129	P	91.2	Very high	93.9	Very high	33 Å²	33	43.9 Å²	43.9	21%	0.214	23%	0.23	C	C	.	.			trans	-63.4	153	-177.7	-27.1	36.6	0	0	0	113.5	F127 D131 H132 R135	F127-P129 VanDerWaalsContact O-CD 3.26Å; F127-P129 WeakPolarHBondContact O-CD 3.2Å; P129-D131 WeakPolarHBondContact CB-OD1 3.18Å; P129-D131 PolarHBondContact O-N 2.6Å; P129-H132 HydrophobicContact CB-CB 4.39Å; P129-H132 WeakPolarHBondContact O-CB 3.25Å; P129-H132 PolarHBondContact O-N 3.15Å; P129-R135 WeakPolarHBondContact O-CD 3.42Å; P129-R135 PolarHBondContact O-NE 3.22Å
130	P	90.7	Very high	93.9	Very high	114 Å²	114	42.9 Å²	42.9	74%	0.74	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-30.2	177.2	-26.3	35.8	0	0	0	114.8	R135	P130-R135 WeakPolarHBondContact O-CD 3.26Å
131	D	89	Confident	93.9	Very high	141 Å²	141	35.5 Å²	35.5	75%	0.754	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.4	6.7	178.2	61.5	-29.8	0	0	0	113.3	P129	P129-D131 WeakPolarHBondContact CB-OD1 3.18Å; P129-D131 PolarHBondContact O-N 2.6Å
132	H	90.7	Very high	93.8	Very high	60 Å²	60	32.2 Å²	32.2	28%	0.278	18%	0.182	S	C	.	.			trans	-68.8	134.1	-179	-167.9	-93	0	0	0	111.4	I128 P129 S134 R135	I128-H132 HydrophobicContact CG2-CB 3.53Å; P129-H132 HydrophobicContact CB-CB 4.39Å; P129-H132 WeakPolarHBondContact O-CB 3.25Å; P129-H132 PolarHBondContact O-N 3.15Å; H132-S134 WeakPolarHBondContact ND1-CB 3.3Å; H132-S134 PolarHBondContact ND1-N 2.92Å; H132-S134 PolarHBondContact ND1-OG 2.78Å; H132-S134 PolarHBondContact O-N 3.26Å; H132-R135 WeakPolarHBondContact O-CB 3.38Å; H132-R135 PolarHBondContact O-N 2.97Å
133	P	90.9	Very high	93.7	Very high	87 Å²	87	32.2 Å²	32.2	57%	0.565	18%	0.182	S	C	*	.	G	3₁₀ helix	trans	-52.4	-35.6	-177.3	-29.4	35	0	0	0	114.3	R135 S136	P133-R135 PolarHBondContact O-N 3.29Å; P133-S136 WeakPolarHBondContact O-CB 3.32Å; P133-S136 PolarHBondContact O-N 3.37Å
134	S	92.6	Very high	93.6	Very high	29 Å²	29	33 Å²	33	20%	0.203	19%	0.186	C	C	.	.	G	3₁₀ helix	trans	-60.5	-18.1	178.4	73	0	0	0	0	114.6	F123 H132 S136 T140	F123-S134 WeakPolarHBondContact CE1-O 3.47Å; F123-S134 WeakPolarHBondContact CZ-O 3.34Å; H132-S134 WeakPolarHBondContact ND1-CB 3.3Å; H132-S134 PolarHBondContact ND1-N 2.92Å; H132-S134 PolarHBondContact ND1-OG 2.78Å; H132-S134 PolarHBondContact O-N 3.26Å; S134-S136 VanDerWaalsContact C-N 3.34Å; S134-T140 PolarHBondContact O-OG1 2.88Å
135	R	94.8	Very high	93.6	Very high	26 Å²	26	35.5 Å²	35.5	10%	0.098	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-85.6	-8.3	174.2	-64.9	-178.6	178.8	-111.8	4.5	112.6	F123 D124 I128 P129 P130 H132 P133 Y142	F123-R135 HydrophobicContact CB-CG 4.34Å; F123-R135 HydrophobicContact CD1-CG 3.8Å; F123-R135 HydrophobicContact CD2-CG 4.02Å; F123-R135 HydrophobicContact CE1-CG 3.98Å; F123-R135 HydrophobicContact CE2-CG 4.17Å; F123-R135 HydrophobicContact CG-CG 3.81Å; F123-R135 HydrophobicContact CZ-CG 4.14Å; D124-R135 IonicContact OD1-CZ 3.75Å; D124-R135 VanDerWaalsContact OD1-CZ 3.25Å; D124-R135 IonicContact OD1-NH1 2.7Å; D124-R135 PolarHBondContact OD1-NH1 3.01Å; D124-R135 IonicContact OD1-NH2 2.7Å; D124-R135 PolarHBondContact OD1-NH2 2.97Å; I128-R135 HydrophobicContact CG2-CG 4.38Å; I128-R135 PolarHBondContact O-NE 3.36Å; I128-R135 PolarHBondContact O-NH2 3.2Å; P129-R135 WeakPolarHBondContact O-CD 3.42Å; P129-R135 PolarHBondContact O-NE 3.22Å; P130-R135 WeakPolarHBondContact O-CD 3.26Å; H132-R135 WeakPolarHBondContact O-CB 3.38Å; H132-R135 PolarHBondContact O-N 2.97Å; P133-R135 PolarHBondContact O-N 3.29Å; R135-Y142 PolarHBondContact O-OH 3.39Å
136	S	92.4	Very high	93.6	Very high	7 Å²	7	39.2 Å²	39.2	5%	0.049	22%	0.218	C	C	.	.	S	Bend	trans	-61.7	143.8	-179.8	-176.2	0	0	0	0	110.6	P133 S134 T138 D139 T140 L420	P133-S136 WeakPolarHBondContact O-CB 3.32Å; P133-S136 PolarHBondContact O-N 3.37Å; S134-S136 VanDerWaalsContact C-N 3.34Å; S136-T138 WeakPolarHBondContact CB-OG1 3.5Å; S136-T138 PolarHBondContact O-N 2.93Å; S136-T138 PolarHBondContact OG-N 3.24Å; S136-T138 PolarHBondContact OG-OG1 3.49Å; S136-D139 PolarHBondContact O-N 2.89Å; S136-T140 PolarHBondContact O-N 3.38Å; S136-L420 WeakPolarHBondContact OG-CD1 3.45Å; S136-L420 VanDerWaalsContact OG-CD2 3.23Å; S136-L420 WeakPolarHBondContact OG-CD2 3.38Å
137	R	91.4	Very high	93.7	Very high	13 Å²	13	40 Å²	40	5%	0.049	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-14.5	170.1	-62.3	-178.8	69.5	-129.2	-3.5	112.9	S53 W54 N56 Y142 R177 L413 F415	S53-R137 PolarHBondContact O-NH2 3.37Å; W54-R137 HydrophobicContact CD2-CG 4.4Å; W54-R137 HydrophobicContact CE3-CG 3.53Å; W54-R137 HydrophobicContact CZ3-CG 3.61Å; W54-R137 PolarHBondContact O-NE 2.82Å; W54-R137 PolarHBondContact O-NH2 3.44Å; N56-R137 PolarHBondContact ND2-O 2.96Å; R137-Y142 HydrophobicContact CG-CD2 4.31Å; R137-Y142 HydrophobicContact CG-CE2 4.45Å; R137-R177 WeakPolarHBondContact O-CD 3.43Å; R137-R177 PolarHBondContact O-NH1 3Å; R137-L413 PolarHBondContact NH1-O 3.44Å; R137-L413 PolarHBondContact NH2-O 3.06Å; R137-F415 PolarHBondContact NH1-O 2.77Å
138	T	90.3	Very high	93.9	Very high	7 Å²	7	38.6 Å²	38.6	4%	0.043	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-18.9	174.5	53.8	0	0	0	0	114.4	S136 R177 L420 I425 R428	S136-T138 WeakPolarHBondContact CB-OG1 3.5Å; S136-T138 PolarHBondContact O-N 2.93Å; S136-T138 PolarHBondContact OG-N 3.24Å; S136-T138 PolarHBondContact OG-OG1 3.49Å; T138-R177 WeakPolarHBondContact O-CB 3.5Å; T138-L420 HydrophobicContact CG2-CD2 3.25Å; T138-L420 WeakPolarHBondContact OG1-CD2 3.38Å; T138-I425 HydrophobicContact CG2-CB 4.18Å; T138-I425 HydrophobicContact CG2-CG1 3.58Å; T138-R428 HydrophobicContact CG2-CG 4.36Å; T138-R428 WeakPolarHBondContact O-CD 3.36Å; T138-R428 VanDerWaalsContact O-CG 3.23Å; T138-R428 WeakPolarHBondContact O-CG 3.33Å; T138-R428 PolarHBondContact O-NE 2.91Å
139	D	93.4	Very high	94	Very high	50 Å²	50	38.1 Å²	38.1	27%	0.267	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115.5	-20.5	-176.7	-66.4	-23.7	0	0	0	112.3	S136 R176 R177	S136-D139 PolarHBondContact O-N 2.89Å; D139-R176 WeakPolarHBondContact O-CA 3.38Å; D139-R177 PolarHBondContact O-N 2.7Å
140	T	96.5	Very high	94.4	Very high	1 Å²	1	36.7 Å²	36.7	1%	0.006	21%	0.205	C	C	.	.	S	Bend	trans	-122.3	142.2	-175.1	-69.6	0	0	0	0	113.1	N56 F123 S134 S136 Y142 V148	N56-T140 PolarHBondContact ND2-O 3.5Å; F123-T140 HydrophobicContact CE2-CG2 4.41Å; F123-T140 HydrophobicContact CZ-CG2 4.13Å; S134-T140 PolarHBondContact O-OG1 2.88Å; S136-T140 PolarHBondContact O-N 3.38Å; T140-Y142 HydrophobicContact CG2-CD2 3.9Å; T140-Y142 HydrophobicContact CG2-CE2 3.52Å; T140-Y142 WeakPolarHBondContact O-CD2 3.27Å; T140-V148 HydrophobicContact CG2-CB 4Å; T140-V148 HydrophobicContact CG2-CG1 3.76Å
141	Y	97.4	Very high	94.8	Very high	1 Å²	1	31.5 Å²	31.5	0%	0.004	17%	0.171	C	C	.	.			trans	-87.2	110.7	171.6	-70.6	-72.5	0	0	0	111.6	N56 L57 I61 V148 L149 R176 R177 P186 D432	N56-Y141 VanDerWaalsContact OD1-CA 3.27Å; N56-Y141 WeakPolarHBondContact OD1-CA 3.4Å; L57-Y141 HydrophobicContact CG-CD1 4.47Å; I61-Y141 HydrophobicContact CD1-CE1 4.28Å; I61-Y141 HydrophobicContact CD1-CE2 4.12Å; I61-Y141 WeakPolarHBondContact CD1-OH 3.38Å; I61-Y141 HydrophobicContact CG1-CD1 4.48Å; I61-Y141 HydrophobicContact CG1-CE1 3.77Å; I61-Y141 HydrophobicContact CG1-CE2 4.36Å; I61-Y141 HydrophobicContact CG2-CD1 4.48Å; I61-Y141 HydrophobicContact CG2-CG 4.48Å; Y141-V148 VanDerWaalsContact O-CA 3.32Å; Y141-V148 WeakPolarHBondContact O-CA 3.33Å; Y141-V148 WeakPolarHBondContact O-CB 3.38Å; Y141-L149 PolarHBondContact O-N 2.73Å; Y141-R176 VanDerWaalsContact CE2-C 3.49Å; Y141-R176 WeakPolarHBondContact CE2-O 3.38Å; Y141-R177 HydrophobicContact CD1-CG 3.76Å; Y141-R177 HydrophobicContact CD2-CG 3.96Å; Y141-R177 HydrophobicContact CE1-CG 3.49Å; Y141-R177 VanDerWaalsContact CE1-CG 3.49Å; Y141-R177 HydrophobicContact CE2-CG 3.76Å; Y141-R177 HydrophobicContact CG-CG 3.99Å; Y141-R177 VanDerWaalsContact CZ-CG 3.5Å; Y141-P186 HydrophobicContact CE2-CB 4.14Å; Y141-P186 WeakPolarHBondContact OH-CB 3.41Å; Y141-D432 WeakPolarHBondContact CE1-OD1 3.37Å; Y141-D432 PolarHBondContact OH-OD1 2.82Å
142	Y	96.5	Very high	95.2	Very high	5 Å²	5	25.7 Å²	25.7	2%	0.02	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	127.6	178.2	-74.8	-95	0	0	0	111	W54 Y55 N56 L57 V119 R135 R137 T140 N144 V148	W54-Y142 HydrophobicContact CB-CG 4.47Å; W54-Y142 HydrophobicContact CD2-CD1 4.5Å; W54-Y142 AromaticContact CE3-CD1 3.69Å; W54-Y142 HydrophobicContact CE3-CD1 3.69Å; W54-Y142 HydrophobicContact CE3-CD2 4.08Å; W54-Y142 AromaticContact CE3-CE1 3.74Å; W54-Y142 HydrophobicContact CE3-CE1 3.74Å; W54-Y142 HydrophobicContact CE3-CE2 4.13Å; W54-Y142 AromaticContact CE3-CG 3.9Å; W54-Y142 HydrophobicContact CE3-CG 3.9Å; W54-Y142 HydrophobicContact CZ3-CD1 4.35Å; W54-Y142 AromaticContact CZ3-CE1 3.93Å; W54-Y142 HydrophobicContact CZ3-CE1 3.93Å; W54-Y142 HydrophobicContact CZ3-CE2 4.13Å; W54-Y142 AromaticContact CZ3-CZ 3.86Å; Y55-Y142 WeakPolarHBondContact CA-O 3.41Å; N56-Y142 PolarHBondContact N-O 3.5Å; N56-Y142 VanDerWaalsContact N-O 3.14Å; N56-Y142 PolarHBondContact OD1-N 3.17Å; N56-Y142 PolarHBondContact OD1-O 3.44Å; L57-Y142 VanDerWaalsContact CD1-C 3.41Å; L57-Y142 WeakPolarHBondContact CD1-O 3.49Å; V119-Y142 HydrophobicContact CG2-CD1 4.46Å; V119-Y142 HydrophobicContact CG2-CE1 3.8Å; R135-Y142 PolarHBondContact O-OH 3.39Å; R137-Y142 HydrophobicContact CG-CD2 4.31Å; R137-Y142 HydrophobicContact CG-CE2 4.45Å; T140-Y142 HydrophobicContact CG2-CD2 3.9Å; T140-Y142 HydrophobicContact CG2-CE2 3.52Å; T140-Y142 WeakPolarHBondContact O-CD2 3.27Å; Y142-N144 WeakPolarHBondContact CD1-O 3.35Å; Y142-V148 HydrophobicContact CD1-CG1 3.34Å; Y142-V148 HydrophobicContact CD2-CG1 4.32Å; Y142-V148 HydrophobicContact CE1-CG1 3.35Å; Y142-V148 HydrophobicContact CE2-CG1 4.33Å; Y142-V148 HydrophobicContact CG-CG1 3.83Å
143	L	96.1	Very high	95.6	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	-32.2	166.5	-74.4	74.1	0	0	0	110.5	V42 I44 T49 Y55 L57 V116 T147 L149	V42-L143 HydrophobicContact CG1-CB 4.24Å; V42-L143 HydrophobicContact CG1-CD2 4.07Å; V42-L143 HydrophobicContact CG1-CG 4.17Å; I44-L143 HydrophobicContact CD1-CD2 4.2Å; I44-L143 HydrophobicContact CD1-CG 4.5Å; T49-L143 WeakPolarHBondContact OG1-CD2 3.46Å; Y55-L143 WeakPolarHBondContact CD2-O 3.49Å; L57-L143 HydrophobicContact CD1-CD1 4.07Å; L57-L143 HydrophobicContact CD1-CG 4.36Å; L57-L143 HydrophobicContact CD2-CD1 4.05Å; L57-L143 HydrophobicContact CD2-CG 4.17Å; V116-L143 HydrophobicContact CG1-CD2 3.91Å; V116-L143 HydrophobicContact CG2-CD2 4.09Å; L143-T147 HydrophobicContact CB-CG2 4.27Å; L143-T147 HydrophobicContact CD2-CG2 4.26Å; L143-T147 PolarHBondContact N-O 2.92Å; L143-L149 HydrophobicContact CD1-CD2 4Å; L143-L149 HydrophobicContact CD1-CG 3.84Å
144	N	95.4	Very high	96	Very high	15 Å²	15	19 Å²	19	8%	0.08	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.8	-178.8	168.5	56.2	48.3	0	0	0	109.5	V50 D52 Y142 T146 T147	V50-N144 WeakPolarHBondContact O-CB 3.4Å; V50-N144 PolarHBondContact O-ND2 2.63Å; D52-N144 HydrophobicContact CB-CB 4.4Å; D52-N144 VanDerWaalsContact CG-CB 3.48Å; D52-N144 WeakPolarHBondContact OD1-CA 3.35Å; D52-N144 WeakPolarHBondContact OD2-CB 3.19Å; Y142-N144 WeakPolarHBondContact CD1-O 3.35Å; N144-T146 PolarHBondContact O-N 3.26Å; N144-T146 PolarHBondContact OD1-N 3.38Å; N144-T146 PolarHBondContact OD1-OG1 2.63Å; N144-T147 PolarHBondContact N-O 2.76Å; N144-T147 PolarHBondContact O-N 3.1Å; N144-T147 VanDerWaalsContact OD1-CB 3.26Å; N144-T147 WeakPolarHBondContact OD1-CB 3.38Å; N144-T147 PolarHBondContact OD1-N 2.92Å; N144-T147 PolarHBondContact OD1-OG1 3.09Å; N144-T147 VanDerWaalsContact OD1-OG1 3.07Å
145	E	95	Very high	96.3	Very high	113 Å²	113	17.7 Å²	17.7	53%	0.528	9%	0.093	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.9	-28.7	-178.3	-177.1	175.2	-137.2	0	0	113.7	D52 W54 V119	D52-E145 PolarHBondContact OD1-N 2.84Å; D52-E145 WeakPolarHBondContact OD2-CB 3.38Å; D52-E145 PolarHBondContact OD2-N 2.87Å; W54-E145 HydrophobicContact CD2-CB 4.44Å; W54-E145 HydrophobicContact CD2-CG 4.49Å; W54-E145 HydrophobicContact CG-CB 3.96Å; W54-E145 HydrophobicContact CG-CG 4.47Å; V119-E145 WeakPolarHBondContact CG2-O 3.38Å
146	T	96.5	Very high	96.4	Very high	83 Å²	83	17.1 Å²	17.1	51%	0.509	9%	0.091	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.9	-6.4	-172.8	64.9	0	0	0	0	114.2	T118 V119 N144	T118-T146 CarbonylContact C-O 3.53Å; T118-T146 VanDerWaalsContact CA-O 3.28Å; T118-T146 WeakPolarHBondContact CA-O 3.32Å; V119-T146 PolarHBondContact N-O 2.95Å; N144-T146 PolarHBondContact O-N 3.26Å; N144-T146 PolarHBondContact OD1-N 3.38Å; N144-T146 PolarHBondContact OD1-OG1 2.63Å
147	T	97.6	Very high	96.7	Very high	16 Å²	16	16.8 Å²	16.8	10%	0.098	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	131.7	-171	-50.2	0	0	0	0	111.3	T49 V116 L143 N144	T49-T147 HydrophobicContact CG2-CG2 4.24Å; V116-T147 HydrophobicContact CG1-CG2 3.51Å; L143-T147 HydrophobicContact CB-CG2 4.27Å; L143-T147 HydrophobicContact CD2-CG2 4.26Å; L143-T147 PolarHBondContact N-O 2.92Å; N144-T147 PolarHBondContact N-O 2.76Å; N144-T147 PolarHBondContact O-N 3.1Å; N144-T147 VanDerWaalsContact OD1-CB 3.26Å; N144-T147 WeakPolarHBondContact OD1-CB 3.38Å; N144-T147 PolarHBondContact OD1-N 2.92Å; N144-T147 PolarHBondContact OD1-OG1 3.09Å; N144-T147 VanDerWaalsContact OD1-OG1 3.07Å
148	V	98.2	Very high	97	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	161.6	-177.6	-61.7	0	0	0	0	111	V117 V119 N122 T140 Y141 Y142	V117-V148 HydrophobicContact CG2-CG2 3.77Å; V117-V148 PolarHBondContact N-O 2.95Å; V117-V148 PolarHBondContact O-N 3.1Å; V117-V148 VanDerWaalsContact O-O 3.1Å; V119-V148 HydrophobicContact CG2-CG1 3.9Å; N122-V148 HydrophobicContact CB-CG2 3.83Å; T140-V148 HydrophobicContact CG2-CB 4Å; T140-V148 HydrophobicContact CG2-CG1 3.76Å; Y141-V148 VanDerWaalsContact O-CA 3.32Å; Y141-V148 WeakPolarHBondContact O-CA 3.33Å; Y141-V148 WeakPolarHBondContact O-CB 3.38Å; Y142-V148 HydrophobicContact CD1-CG1 3.34Å; Y142-V148 HydrophobicContact CD2-CG1 4.32Å; Y142-V148 HydrophobicContact CE1-CG1 3.35Å; Y142-V148 HydrophobicContact CE2-CG1 4.33Å; Y142-V148 HydrophobicContact CG-CG1 3.83Å
149	L	98.5	Very high	97.3	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	130.4	152.5	-63.8	179.9	0	0	0	107.8	I44 L57 I61 T65 P115 V116 Y141 L143 S151 Y175	I44-L149 HydrophobicContact CD1-CD2 4.01Å; I44-L149 HydrophobicContact CG2-CD2 4.42Å; L57-L149 HydrophobicContact CD2-CD1 3.78Å; L57-L149 HydrophobicContact CD2-CG 4.13Å; L57-L149 HydrophobicContact CG-CD1 4.26Å; I61-L149 HydrophobicContact CG2-CD1 3.8Å; T65-L149 HydrophobicContact CG2-CD1 4.25Å; T65-L149 HydrophobicContact CG2-CD2 4.48Å; P115-L149 HydrophobicContact CB-CD2 4.36Å; P115-L149 HydrophobicContact CG-CD2 4.4Å; P115-L149 WeakPolarHBondContact O-CA 3.49Å; V116-L149 HydrophobicContact CG2-CD2 3.94Å; Y141-L149 PolarHBondContact O-N 2.73Å; L143-L149 HydrophobicContact CD1-CD2 4Å; L143-L149 HydrophobicContact CD1-CG 3.84Å; L149-S151 PolarHBondContact O-N 2.79Å; L149-Y175 HydrophobicContact CB-CD1 4.34Å; L149-Y175 HydrophobicContact CB-CD2 3.75Å; L149-Y175 HydrophobicContact CB-CG 3.64Å; L149-Y175 HydrophobicContact CD1-CD1 3.47Å; L149-Y175 VanDerWaalsContact CD1-CD1 3.47Å; L149-Y175 HydrophobicContact CD1-CD2 4.21Å; L149-Y175 HydrophobicContact CD1-CE1 3.9Å; L149-Y175 HydrophobicContact CD1-CG 3.67Å; L149-Y175 HydrophobicContact CG-CD1 4.48Å; L149-Y175 HydrophobicContact CG-CD2 4.43Å; L149-Y175 HydrophobicContact CG-CG 4.24Å
150	R	98.6	Very high	97.5	Very high	3 Å²	3	18 Å²	18	1%	0.011	10%	0.096	C	C	.	.			trans	-56.2	131.2	-176.1	67.3	-173.8	178.4	-133.4	-4.9	110.9	L113 S114 P115 V117 N122 A155 H156 D173 V174 Y175	L113-R150 PolarHBondContact O-NH1 2.94Å; S114-R150 PolarHBondContact O-NH1 2.85Å; P115-R150 HydrophobicContact CB-CG 4.39Å; P115-R150 PolarHBondContact O-N 3.15Å; V117-R150 HydrophobicContact CG1-CB 4.19Å; V117-R150 HydrophobicContact CG2-CB 3.67Å; N122-R150 VanDerWaalsContact OD1-CA 3.23Å; N122-R150 WeakPolarHBondContact OD1-CA 3.05Å; R150-A155 HydrophobicContact CB-CB 4.24Å; R150-H156 WeakPolarHBondContact CD-NE2 3.43Å; R150-H156 PolarHBondContact NH1-NE2 2.87Å; R150-D173 PolarHBondContact NE-O 3.47Å; R150-D173 PolarHBondContact NH2-O 2.94Å; R150-D173 IonicContact NH2-OD1 3.82Å; R150-D173 PolarHBondContact NH2-OD1 3.37Å; R150-V174 HydrophobicContact CG-CG1 4.27Å; R150-V174 WeakPolarHBondContact O-CA 3.21Å; R150-Y175 PolarHBondContact O-N 2.91Å
151	S	98.5	Very high	97.6	Very high	5 Å²	5	18 Å²	18	4%	0.035	10%	0.096	C	C	.	.	S	Bend	trans	-90.2	-8.8	177.8	64.6	0	0	0	0	113.1	N122 L149 Y175 R176	N122-S151 PolarHBondContact ND2-OG 2.98Å; N122-S151 PolarHBondContact OD1-N 3.3Å; L149-S151 PolarHBondContact O-N 2.79Å; S151-Y175 WeakPolarHBondContact CA-O 2.83Å; S151-R176 PolarHBondContact O-NE 3.42Å; S151-R176 PolarHBondContact O-NH2 2.82Å
152	H	98.7	Very high	97.5	Very high	19 Å²	19	20.9 Å²	20.9	9%	0.088	12%	0.116	C	C	.	.	S	Bend	trans	-159.1	155.6	173.1	46.4	69.6	0	0	0	111.9	N122 L126 S154 A155 Q190	N122-H152 PolarHBondContact O-CE1 3.23Å; N122-H152 PolarHBondContact O-NE2 3.18Å; L126-H152 WeakPolarHBondContact CD1-CE1 3.07Å; H152-S154 PolarHBondContact O-N 2.69Å; H152-A155 PolarHBondContact ND1-N 3.48Å; H152-A155 WeakPolarHBondContact O-CB 3.15Å; H152-A155 PolarHBondContact O-N 2.78Å; H152-Q190 VanDerWaalsContact CB-OE1 3.23Å
153	T	98.8	Very high	97.5	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	14%	0.141	C	C	.	.	G	3₁₀ helix	trans	-66.7	-19.3	177	39.3	0	0	0	0	113.4	A155 H156 V170 V174 Q190 E192	T153-A155 PolarHBondContact O-N 3.22Å; T153-H156 PolarHBondContact O-N 3.48Å; T153-V170 HydrophobicContact CG2-CG1 4.05Å; T153-V174 HydrophobicContact CG2-CG1 4.09Å; T153-Q190 HydrophobicContact CG2-CB 3.81Å; T153-Q190 WeakPolarHBondContact OG1-CB 3.35Å; T153-Q190 PolarHBondContact OG1-OE1 3.37Å; T153-E192 WeakPolarHBondContact CB-OE2 3.31Å; T153-E192 PolarHBondContact OG1-OE2 3.03Å
154	S	98.7	Very high	97.5	Very high	7 Å²	7	26.7 Å²	26.7	5%	0.049	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-59.3	-18.2	175.6	-39.4	0	0	0	0	113.7	H152 H156 Q157 E192	H152-S154 PolarHBondContact O-N 2.69Å; S154-H156 PolarHBondContact O-N 3.12Å; S154-Q157 WeakPolarHBondContact O-CB 3.31Å; S154-Q157 WeakPolarHBondContact O-CG 3.24Å; S154-Q157 PolarHBondContact O-N 3.24Å; S154-E192 WeakPolarHBondContact CA-OE1 3.06Å; S154-E192 VanDerWaalsContact CB-OE1 3.22Å; S154-E192 WeakPolarHBondContact CB-OE1 3.32Å; S154-E192 PolarHBondContact N-OE2 3.47Å; S154-E192 VanDerWaalsContact N-OE2 3.15Å; S154-E192 VanDerWaalsContact OG-CD 3.24Å; S154-E192 PolarHBondContact OG-OE1 2.83Å; S154-E192 PolarHBondContact OG-OE2 2.67Å
155	A	98.6	Very high	97.5	Very high	1 Å²	1	27.5 Å²	27.5	1%	0.008	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	-57.8	-16.5	175.7	0	0	0	0	0	113.8	V117 K121 N122 R150 H152 T153	V117-A155 HydrophobicContact CG2-CB 4.38Å; K121-A155 WeakPolarHBondContact O-CA 3.4Å; N122-A155 HydrophobicContact CB-CB 4.32Å; R150-A155 HydrophobicContact CB-CB 4.24Å; H152-A155 PolarHBondContact ND1-N 3.48Å; H152-A155 WeakPolarHBondContact O-CB 3.15Å; H152-A155 PolarHBondContact O-N 2.78Å; T153-A155 PolarHBondContact O-N 3.22Å
156	H	98.5	Very high	97.4	Very high	14 Å²	14	24.5 Å²	24.5	7%	0.065	16%	0.157	C	C	.	.	G	3₁₀ helix	trans	-101.3	-1.7	178.9	-57.2	-70.7	0	0	0	113.8	L113 R150 T153 S154 L160	L113-H156 HydrophobicContact CD1-CB 3.94Å; R150-H156 WeakPolarHBondContact CD-NE2 3.43Å; R150-H156 PolarHBondContact NH1-NE2 2.87Å; T153-H156 PolarHBondContact O-N 3.48Å; S154-H156 PolarHBondContact O-N 3.12Å; H156-L160 HydrophobicContact CB-CD1 4.06Å; H156-L160 HydrophobicContact CB-CG 4.43Å; H156-L160 WeakPolarHBondContact O-CB 3.29Å; H156-L160 VanDerWaalsContact O-CG 3.31Å; H156-L160 WeakPolarHBondContact O-CG 3.43Å; H156-L160 PolarHBondContact O-N 2.92Å; H156-L160 VanDerWaalsContact O-N 3.09Å
157	Q	98.3	Very high	97.4	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-59.7	-56.1	-176.3	-73.7	-173.3	12.2	0	0	111.9	L126 S154 D159 L160 I161 E192 V194 M327	L126-Q157 HydrophobicContact CD2-CB 4.45Å; S154-Q157 WeakPolarHBondContact O-CB 3.31Å; S154-Q157 WeakPolarHBondContact O-CG 3.24Å; S154-Q157 PolarHBondContact O-N 3.24Å; Q157-D159 VanDerWaalsContact C-N 3.31Å; Q157-D159 PolarHBondContact O-N 3.49Å; Q157-L160 PolarHBondContact O-N 2.84Å; Q157-I161 HydrophobicContact CB-CD1 4.34Å; Q157-I161 WeakPolarHBondContact O-CB 3.44Å; Q157-I161 WeakPolarHBondContact O-CD1 3.41Å; Q157-I161 WeakPolarHBondContact O-CG1 3.29Å; Q157-I161 PolarHBondContact O-N 3.47Å; Q157-E192 PolarHBondContact NE2-OE1 3.28Å; Q157-V194 HydrophobicContact CG-CG2 3.97Å; Q157-M327 VanDerWaalsContact OE1-CE 3.26Å
158	L	97.1	Very high	97.3	Very high	21 Å²	21	20.1 Å²	20.1	11%	0.11	13%	0.13	C	C	.	.	H	α-helix	trans	-56.2	-46.7	-175.8	-172.8	82.1	0	0	0	111.3	S162 L331 R334 S335	L158-S162 VanDerWaalsContact O-CB 3.25Å; L158-S162 WeakPolarHBondContact O-CB 3.37Å; L158-S162 PolarHBondContact O-N 3.29Å; L158-S162 PolarHBondContact O-OG 3.38Å; L158-L331 HydrophobicContact CD1-CD2 4.4Å; L158-L331 HydrophobicContact CD1-CG 4.29Å; L158-R334 HydrophobicContact CD1-CB 4.11Å; L158-S335 WeakPolarHBondContact CD1-OG 3.3Å; L158-S335 PolarHBondContact O-OG 2.9Å
159	D	96.9	Very high	97.3	Very high	61 Å²	61	20.1 Å²	20.1	33%	0.326	13%	0.13	S	C	.	.	H	α-helix	trans	-66.1	-46.6	-177.3	-71.5	-8.1	0	0	0	112.2	K121 Q157 I161 S162 S163	K121-D159 WeakPolarHBondContact CD-OD2 3.47Å; K121-D159 WeakPolarHBondContact CE-OD2 3.23Å; K121-D159 IonicContact NZ-OD2 2.74Å; K121-D159 PolarHBondContact NZ-OD2 3.24Å; Q157-D159 VanDerWaalsContact C-N 3.31Å; Q157-D159 PolarHBondContact O-N 3.49Å; D159-I161 VanDerWaalsContact C-N 3.35Å; D159-S162 PolarHBondContact O-N 2.86Å; D159-S163 PolarHBondContact O-N 3.34Å
160	L	97.7	Very high	97.4	Very high	14 Å²	14	20.2 Å²	20.2	7%	0.073	13%	0.131	C	C	.	.	H	α-helix	trans	-66	-39.7	-179.8	-71.6	176.5	0	0	0	111.3	Y110 L113 H156 Q157 S163 L165 F168 V170	Y110-L160 HydrophobicContact CD1-CD2 4.05Å; Y110-L160 HydrophobicContact CD2-CD1 4.17Å; Y110-L160 HydrophobicContact CD2-CD2 4.11Å; Y110-L160 HydrophobicContact CE1-CD2 3.93Å; Y110-L160 HydrophobicContact CE2-CD2 4Å; Y110-L160 HydrophobicContact CG-CD1 4.36Å; Y110-L160 HydrophobicContact CG-CD2 4.14Å; L113-L160 HydrophobicContact CD1-CD1 4.38Å; H156-L160 HydrophobicContact CB-CD1 4.06Å; H156-L160 HydrophobicContact CB-CG 4.43Å; H156-L160 WeakPolarHBondContact O-CB 3.29Å; H156-L160 VanDerWaalsContact O-CG 3.31Å; H156-L160 WeakPolarHBondContact O-CG 3.43Å; H156-L160 PolarHBondContact O-N 2.92Å; H156-L160 VanDerWaalsContact O-N 3.09Å; Q157-L160 PolarHBondContact O-N 2.84Å; L160-S163 PolarHBondContact O-N 3.38Å; L160-S163 PolarHBondContact O-OG 2.83Å; L160-L165 HydrophobicContact CB-CD1 3.96Å; L160-L165 HydrophobicContact CD2-CD1 3.81Å; L160-L165 HydrophobicContact CG-CD1 4.43Å; L160-L165 WeakPolarHBondContact O-CB 3.27Å; L160-L165 PolarHBondContact O-N 2.76Å; L160-F168 HydrophobicContact CB-CD1 4.28Å; L160-F168 HydrophobicContact CB-CD2 4.22Å; L160-F168 HydrophobicContact CB-CE1 3.93Å; L160-F168 HydrophobicContact CB-CE2 3.86Å; L160-F168 HydrophobicContact CB-CG 4.4Å; L160-F168 HydrophobicContact CB-CZ 3.69Å; L160-F168 HydrophobicContact CD1-CD2 3.57Å; L160-F168 HydrophobicContact CD1-CE2 3.59Å; L160-F168 HydrophobicContact CD1-CG 4.27Å; L160-F168 HydrophobicContact CD1-CZ 4.31Å; L160-F168 HydrophobicContact CG-CE2 4.39Å; L160-V170 HydrophobicContact CD1-CG2 3.37Å
161	I	97.5	Very high	97.4	Very high	1 Å²	1	20.2 Å²	20.2	1%	0.005	13%	0.131	C	C	.	.	H	α-helix	trans	-64.9	-46.2	174.2	-66.1	167.5	0	0	0	110.7	Q157 D159 S163 G164 F168 V194 L196 M327 L331 L332 S335 I337	Q157-I161 HydrophobicContact CB-CD1 4.34Å; Q157-I161 WeakPolarHBondContact O-CB 3.44Å; Q157-I161 WeakPolarHBondContact O-CD1 3.41Å; Q157-I161 WeakPolarHBondContact O-CG1 3.29Å; Q157-I161 PolarHBondContact O-N 3.47Å; D159-I161 VanDerWaalsContact C-N 3.35Å; I161-S163 PolarHBondContact O-N 3.32Å; I161-S163 VanDerWaalsContact O-N 3.17Å; I161-G164 PolarHBondContact O-N 3.45Å; I161-F168 HydrophobicContact CD1-CZ 4.43Å; I161-F168 HydrophobicContact CG1-CE1 3.68Å; I161-F168 HydrophobicContact CG1-CZ 3.83Å; I161-V194 HydrophobicContact CD1-CG1 4.26Å; I161-V194 HydrophobicContact CG1-CG1 4.41Å; I161-L196 HydrophobicContact CG1-CD1 4.3Å; I161-L196 HydrophobicContact CG2-CD1 3.91Å; I161-M327 HydrophobicContact CD1-CE 3.39Å; I161-M327 HydrophobicContact CD1-SD 4.38Å; I161-L331 HydrophobicContact CD1-CD2 3.66Å; I161-L332 HydrophobicContact CD1-CD2 4.24Å; I161-L332 HydrophobicContact CG2-CD2 4.34Å; I161-S335 VanDerWaalsContact CG2-CB 3.5Å; I161-I337 HydrophobicContact CG2-CD1 3.23Å; I161-I337 HydrophobicContact CG2-CG1 3.85Å
162	S	97	Very high	97.4	Very high	61 Å²	61	20 Å²	20	43%	0.427	13%	0.13	S	C	.	.	H	α-helix	trans	-63	-22.8	178.5	-53.5	0	0	0	0	112.5	L158 D159 G164 S335	L158-S162 VanDerWaalsContact O-CB 3.25Å; L158-S162 WeakPolarHBondContact O-CB 3.37Å; L158-S162 PolarHBondContact O-N 3.29Å; L158-S162 PolarHBondContact O-OG 3.38Å; D159-S162 PolarHBondContact O-N 2.86Å; S162-G164 PolarHBondContact O-N 3.21Å; S162-S335 WeakPolarHBondContact OG-CA 3.42Å; S162-S335 WeakPolarHBondContact OG-CB 3.41Å; S162-S335 PolarHBondContact OG-OG 3.48Å
163	S	96.4	Very high	97.4	Very high	79 Å²	79	19.3 Å²	19.3	55%	0.552	13%	0.127	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-2.3	172.7	80.6	0	0	0	0	114.3	D159 L160 I161	D159-S163 PolarHBondContact O-N 3.34Å; L160-S163 PolarHBondContact O-N 3.38Å; L160-S163 PolarHBondContact O-OG 2.83Å; I161-S163 PolarHBondContact O-N 3.32Å; I161-S163 VanDerWaalsContact O-N 3.17Å
164	G	94.8	Very high	97.4	Very high	48 Å²	48	19.3 Å²	19.3	50%	0.495	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	96.2	10.2	177.1	0	0	0	0	0	114.9	I161 S162	I161-G164 PolarHBondContact O-N 3.45Å; S162-G164 PolarHBondContact O-N 3.21Å
165	L	95.1	Very high	97.3	Very high	31 Å²	31	19 Å²	19	16%	0.162	13%	0.125	C	C	.	.			trans	-80	133.7	-179.5	-60.7	168.9	0	0	0	111.8	Y110 L160 F168	Y110-L165 HydrophobicContact CE2-CD1 3.56Å; Y110-L165 VanDerWaalsContact OH-CD1 3.32Å; Y110-L165 WeakPolarHBondContact OH-CD1 3.25Å; L160-L165 HydrophobicContact CB-CD1 3.96Å; L160-L165 HydrophobicContact CD2-CD1 3.81Å; L160-L165 HydrophobicContact CG-CD1 4.43Å; L160-L165 WeakPolarHBondContact O-CB 3.27Å; L160-L165 PolarHBondContact O-N 2.76Å; L165-F168 HydrophobicContact CB-CD1 3.69Å; L165-F168 HydrophobicContact CB-CE1 4.27Å; L165-F168 HydrophobicContact CD1-CB 4.37Å; L165-F168 HydrophobicContact CD1-CD1 4.27Å; L165-F168 HydrophobicContact CD1-CG 4.46Å
166	N	94.5	Very high	97.3	Very high	51 Å²	51	22.9 Å²	22.9	27%	0.273	14%	0.139	S	C	.	.	S	Bend	trans	-108.7	-12.9	177.6	-57.8	-50.7	0	0	0	113.6	R195 L196 K340	N166-R195 WeakPolarHBondContact O-CA 3.35Å; N166-L196 HydrophobicContact CB-CB 4.29Å; N166-L196 PolarHBondContact O-N 3.46Å; N166-K340 PolarHBondContact ND2-NZ 2.61Å; N166-K340 VanDerWaalsContact ND2-NZ 3.11Å; N166-K340 PolarHBondContact OD1-NZ 3.29Å
167	A	95.1	Very high	97.2	Very high	7 Å²	7	22.6 Å²	22.6	6%	0.058	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	121.9	173.2	0	0	0	0	0	109	F107 S108 V194 R195	F107-A167 HydrophobicContact CD1-CB 4.02Å; F107-A167 HydrophobicContact CD2-CB 4.08Å; F107-A167 HydrophobicContact CE1-CB 4.06Å; F107-A167 HydrophobicContact CE2-CB 4.11Å; F107-A167 HydrophobicContact CG-CB 4.05Å; F107-A167 HydrophobicContact CZ-CB 4.11Å; S108-A167 PolarHBondContact N-O 3.03Å; A167-V194 WeakPolarHBondContact CA-O 3.15Å; A167-R195 VanDerWaalsContact CB-NH1 3.34Å
168	F	97	Very high	96.8	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	153.5	177.1	57.9	-92.5	0	0	0	111.2	S108 Y110 L160 I161 L165 V170 V194	S108-F168 CarbonylContact O-C 3.38Å; S108-F168 VanDerWaalsContact O-CA 3.28Å; S108-F168 WeakPolarHBondContact O-CA 3.34Å; S108-F168 WeakPolarHBondContact O-CB 3.25Å; Y110-F168 HydrophobicContact CD2-CB 4.23Å; Y110-F168 HydrophobicContact CE2-CB 4.17Å; L160-F168 HydrophobicContact CB-CD1 4.28Å; L160-F168 HydrophobicContact CB-CD2 4.22Å; L160-F168 HydrophobicContact CB-CE1 3.93Å; L160-F168 HydrophobicContact CB-CE2 3.86Å; L160-F168 HydrophobicContact CB-CG 4.4Å; L160-F168 HydrophobicContact CB-CZ 3.69Å; L160-F168 HydrophobicContact CD1-CD2 3.57Å; L160-F168 HydrophobicContact CD1-CE2 3.59Å; L160-F168 HydrophobicContact CD1-CG 4.27Å; L160-F168 HydrophobicContact CD1-CZ 4.31Å; L160-F168 HydrophobicContact CG-CE2 4.39Å; I161-F168 HydrophobicContact CD1-CZ 4.43Å; I161-F168 HydrophobicContact CG1-CE1 3.68Å; I161-F168 HydrophobicContact CG1-CZ 3.83Å; L165-F168 HydrophobicContact CB-CD1 3.69Å; L165-F168 HydrophobicContact CB-CE1 4.27Å; L165-F168 HydrophobicContact CD1-CB 4.37Å; L165-F168 HydrophobicContact CD1-CD1 4.27Å; L165-F168 HydrophobicContact CD1-CG 4.46Å; F168-V170 HydrophobicContact CD2-CG2 3.86Å; F168-V170 HydrophobicContact CE2-CG2 4.09Å; F168-V194 HydrophobicContact CD1-CB 4.15Å; F168-V194 HydrophobicContact CD1-CG1 4.37Å; F168-V194 HydrophobicContact CD2-CB 4.21Å; F168-V194 HydrophobicContact CD2-CG2 4.45Å; F168-V194 HydrophobicContact CE1-CB 3.65Å; F168-V194 HydrophobicContact CE1-CG1 3.62Å; F168-V194 HydrophobicContact CE1-CG2 4.25Å; F168-V194 HydrophobicContact CE2-CB 3.71Å; F168-V194 HydrophobicContact CE2-CG1 4.48Å; F168-V194 HydrophobicContact CE2-CG2 3.6Å; F168-V194 HydrophobicContact CG-CB 4.43Å; F168-V194 HydrophobicContact CZ-CB 3.41Å; F168-V194 VanDerWaalsContact CZ-CB 3.41Å; F168-V194 HydrophobicContact CZ-CG1 3.7Å; F168-V194 HydrophobicContact CZ-CG2 3.49Å; F168-V194 VanDerWaalsContact CZ-CG2 3.49Å; F168-V194 PolarHBondContact N-O 2.98Å; F168-V194 VanDerWaalsContact N-O 3.17Å; F168-V194 PolarHBondContact O-N 2.92Å
169	L	98.2	Very high	96.5	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	139.3	168.6	-58	168.8	0	0	0	108.1	V85 M88 F107 S108 L109 Y110 L191 E192 F345	V85-L169 HydrophobicContact CG2-CD1 3.87Å; M88-L169 HydrophobicContact CB-CD1 4.31Å; M88-L169 HydrophobicContact CE-CD2 4.41Å; M88-L169 HydrophobicContact CG-CD1 4.2Å; M88-L169 HydrophobicContact CG-CD2 4.35Å; F107-L169 HydrophobicContact CB-CD1 4.17Å; F107-L169 HydrophobicContact CB-CG 4.05Å; F107-L169 HydrophobicContact CD1-CD2 3.75Å; F107-L169 HydrophobicContact CD1-CG 3.77Å; F107-L169 HydrophobicContact CE1-CD2 4.2Å; F107-L169 HydrophobicContact CG-CG 4.26Å; S108-L169 PolarHBondContact O-N 2.98Å; L109-L169 HydrophobicContact CD1-CB 3.98Å; Y110-L169 PolarHBondContact N-O 3.27Å; L169-L191 HydrophobicContact CD2-CD2 3.99Å; L169-E192 CarbonylContact C-O 3.58Å; L169-E192 WeakPolarHBondContact CA-O 3.34Å; L169-F345 HydrophobicContact CD2-CZ 4.25Å
170	V	98.7	Very high	96.3	Very high	2 Å²	2	23.5 Å²	23.5	1%	0.012	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	121.4	170.8	-174.6	0	0	0	0	107.7	Y110 L113 T153 L160 F168 L191 E192	Y110-V170 CarbonylContact O-C 3.58Å; Y110-V170 VanDerWaalsContact O-CA 3.3Å; Y110-V170 WeakPolarHBondContact O-CA 3.43Å; L113-V170 HydrophobicContact CD1-CG1 3.99Å; T153-V170 HydrophobicContact CG2-CG1 4.05Å; L160-V170 HydrophobicContact CD1-CG2 3.37Å; F168-V170 HydrophobicContact CD2-CG2 3.86Å; F168-V170 HydrophobicContact CE2-CG2 4.09Å; V170-L191 CarbonylContact O-C 3.52Å; V170-L191 VanDerWaalsContact O-CA 3.26Å; V170-L191 WeakPolarHBondContact O-CA 3.46Å; V170-E192 HydrophobicContact CB-CB 3.84Å; V170-E192 HydrophobicContact CG2-CB 4.33Å; V170-E192 PolarHBondContact N-O 2.98Å; V170-E192 PolarHBondContact O-N 3.38Å
171	A	98.7	Very high	96	Very high	2 Å²	2	24.4 Å²	24.4	2%	0.017	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	132.3	174.4	0	0	0	0	0	109.7	H70 K81 L109 Y110 D111 Q190	H70-A171 PolarHBondContact NE2-O 3.31Å; K81-A171 HydrophobicContact CD-CB 3.64Å; K81-A171 HydrophobicContact CG-CB 3.98Å; L109-A171 HydrophobicContact CD1-CB 4.3Å; Y110-A171 PolarHBondContact O-N 3.43Å; D111-A171 VanDerWaalsContact CA-O 3.23Å; D111-A171 WeakPolarHBondContact CA-O 3.19Å; D111-A171 HydrophobicContact CB-CB 4.05Å; A171-Q190 WeakPolarHBondContact CA-O 3.44Å
172	G	98.5	Very high	95.6	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-176	159	-178.5	0	0	0	0	0	114.4	H189 Q190	G172-H189 CarbonylContact O-C 3.5Å; G172-H189 VanDerWaalsContact O-CA 3.3Å; G172-H189 WeakPolarHBondContact O-CA 3.42Å; G172-Q190 PolarHBondContact N-O 3.34Å; G172-Q190 PolarHBondContact O-N 2.98Å
173	D	98.7	Very high	95.4	Very high	6 Å²	6	26.2 Å²	26.2	3%	0.032	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.7	134.9	164.5	52	-46.8	0	0	0	111.1	H70 R150 Y175 V187 F188	H70-D173 IonicContact CE1-OD1 3.5Å; R150-D173 PolarHBondContact NE-O 3.47Å; R150-D173 PolarHBondContact NH2-O 2.94Å; R150-D173 IonicContact NH2-OD1 3.82Å; R150-D173 PolarHBondContact NH2-OD1 3.37Å; D173-Y175 HydrophobicContact CB-CE2 4.01Å; D173-Y175 VanDerWaalsContact OD2-CE2 3.22Å; D173-Y175 WeakPolarHBondContact OD2-CE2 3.37Å; D173-Y175 VanDerWaalsContact OD2-CZ 3.28Å; D173-Y175 PolarHBondContact OD2-OH 2.78Å; D173-V187 HydrophobicContact CB-CG1 4.02Å; D173-F188 CarbonylContact C-O 3.13Å; D173-F188 WeakPolarHBondContact CA-O 3.24Å
174	V	98.7	Very high	95.3	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	152.2	177.1	-59.4	0	0	0	0	108.4	R150 T153 V187 F188 Q190	R150-V174 HydrophobicContact CG-CG1 4.27Å; R150-V174 WeakPolarHBondContact O-CA 3.21Å; T153-V174 HydrophobicContact CG2-CG1 4.09Å; V174-V187 WeakPolarHBondContact O-CA 3.45Å; V174-F188 HydrophobicContact CG2-CD1 4.1Å; V174-F188 HydrophobicContact CG2-CD2 3.65Å; V174-F188 HydrophobicContact CG2-CE1 3.78Å; V174-F188 HydrophobicContact CG2-CE2 3.31Å; V174-F188 HydrophobicContact CG2-CG 4.02Å; V174-F188 HydrophobicContact CG2-CZ 3.37Å; V174-F188 WeakPolarHBondContact CG2-O 3.38Å; V174-F188 PolarHBondContact N-O 3.07Å; V174-F188 PolarHBondContact O-N 2.9Å; V174-F188 VanDerWaalsContact O-N 3.13Å; V174-Q190 HydrophobicContact CG1-CB 4.29Å; V174-Q190 HydrophobicContact CG1-CG 4.32Å; V174-Q190 HydrophobicContact CG2-CG 3.91Å
175	Y	98.6	Very high	95.4	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	126	-163.9	-63.4	-100.5	0	0	0	110.2	I61 T65 P115 L149 R150 S151 D173 P186 V187	I61-Y175 HydrophobicContact CG2-CD1 4.1Å; I61-Y175 HydrophobicContact CG2-CE1 4.42Å; T65-Y175 WeakPolarHBondContact CA-OH 3.19Å; T65-Y175 HydrophobicContact CG2-CE1 3.79Å; P115-Y175 HydrophobicContact CB-CD2 4.14Å; P115-Y175 HydrophobicContact CB-CE2 3.53Å; P115-Y175 HydrophobicContact CG-CE2 4.21Å; L149-Y175 HydrophobicContact CB-CD1 4.34Å; L149-Y175 HydrophobicContact CB-CD2 3.75Å; L149-Y175 HydrophobicContact CB-CG 3.64Å; L149-Y175 HydrophobicContact CD1-CD1 3.47Å; L149-Y175 VanDerWaalsContact CD1-CD1 3.47Å; L149-Y175 HydrophobicContact CD1-CD2 4.21Å; L149-Y175 HydrophobicContact CD1-CE1 3.9Å; L149-Y175 HydrophobicContact CD1-CG 3.67Å; L149-Y175 HydrophobicContact CG-CD1 4.48Å; L149-Y175 HydrophobicContact CG-CD2 4.43Å; L149-Y175 HydrophobicContact CG-CG 4.24Å; R150-Y175 PolarHBondContact O-N 2.91Å; S151-Y175 WeakPolarHBondContact CA-O 2.83Å; D173-Y175 HydrophobicContact CB-CE2 4.01Å; D173-Y175 VanDerWaalsContact OD2-CE2 3.22Å; D173-Y175 WeakPolarHBondContact OD2-CE2 3.37Å; D173-Y175 VanDerWaalsContact OD2-CZ 3.28Å; D173-Y175 PolarHBondContact OD2-OH 2.78Å; Y175-P186 WeakPolarHBondContact CA-O 3.32Å; Y175-V187 HydrophobicContact CD1-CB 4.3Å; Y175-V187 HydrophobicContact CD1-CG1 4.14Å; Y175-V187 HydrophobicContact CD1-CG2 3.4Å; Y175-V187 HydrophobicContact CE1-CB 4.11Å; Y175-V187 HydrophobicContact CE1-CG1 3.68Å; Y175-V187 HydrophobicContact CE1-CG2 3.28Å; Y175-V187 HydrophobicContact CE2-CG1 4.3Å; Y175-V187 HydrophobicContact CG-CG2 4.41Å
176	R	97.8	Very high	95.4	Very high	82 Å²	82	21.5 Å²	21.5	31%	0.309	11%	0.11	S	C	.	.			trans	-140.4	140.9	177	-62.6	-174.6	-171.7	170.1	0.3	109.6	D139 Y141 S151 D178 P186 F188	D139-R176 WeakPolarHBondContact O-CA 3.38Å; Y141-R176 VanDerWaalsContact CE2-C 3.49Å; Y141-R176 WeakPolarHBondContact CE2-O 3.38Å; S151-R176 PolarHBondContact O-NE 3.42Å; S151-R176 PolarHBondContact O-NH2 2.82Å; R176-D178 PolarHBondContact O-N 3.13Å; R176-P186 PolarHBondContact N-O 2.94Å; R176-P186 VanDerWaalsContact O-CA 3.26Å; R176-P186 WeakPolarHBondContact O-CA 3.29Å; R176-F188 HydrophobicContact CB-CE1 4.35Å; R176-F188 HydrophobicContact CG-CE1 3.93Å; R176-F188 HydrophobicContact CG-CZ 4.41Å
177	R	95.1	Very high	95.6	Very high	8 Å²	8	19 Å²	19	3%	0.03	10%	0.097	C	C	.	.			trans	-80.3	109.3	168	-65	-174.4	81.2	-159.9	1.3	106.5	R137 T138 D139 Y141 R428 D429 D432	R137-R177 WeakPolarHBondContact O-CD 3.43Å; R137-R177 PolarHBondContact O-NH1 3Å; T138-R177 WeakPolarHBondContact O-CB 3.5Å; D139-R177 PolarHBondContact O-N 2.7Å; Y141-R177 HydrophobicContact CD1-CG 3.76Å; Y141-R177 HydrophobicContact CD2-CG 3.96Å; Y141-R177 HydrophobicContact CE1-CG 3.49Å; Y141-R177 VanDerWaalsContact CE1-CG 3.49Å; Y141-R177 HydrophobicContact CE2-CG 3.76Å; Y141-R177 HydrophobicContact CG-CG 3.99Å; Y141-R177 VanDerWaalsContact CZ-CG 3.5Å; R177-R428 PolarHBondContact NH2-O 3.33Å; R177-R428 PolarHBondContact O-NE 3.27Å; R177-D429 IonicContact CZ-OD1 2.7Å; R177-D429 IonicContact NH1-OD1 2.98Å; R177-D429 PolarHBondContact NH1-OD1 3.04Å; R177-D429 IonicContact NH2-OD1 3.58Å; R177-D429 PolarHBondContact NH2-OD1 2.85Å; R177-D432 IonicContact CZ-OD2 2.87Å; R177-D432 IonicContact NE-OD2 3.55Å; R177-D432 PolarHBondContact NE-OD2 3.46Å; R177-D432 IonicContact NH2-OD2 3.18Å; R177-D432 PolarHBondContact NH2-OD2 3.01Å
178	D	90.7	Very high	95.7	Very high	40 Å²	40	20 Å²	20	21%	0.214	10%	0.1	C	C	.	.			trans	-137.9	177.1	-166.6	-145.1	-22.2	0	0	0	111.3	R176 H184 R428 F431	R176-D178 PolarHBondContact O-N 3.13Å; D178-H184 HydrophobicContact CB-CB 4.43Å; D178-H184 IonicContact OD1-CD2 2.84Å; D178-H184 IonicContact OD2-CD2 3.6Å; D178-H184 PolarHBondContact OD2-CD2 3.02Å; D178-R428 PolarHBondContact O-NH1 3.02Å; D178-F431 WeakPolarHBondContact O-CD2 3.35Å
179	D	91.9	Very high	95.8	Very high	60 Å²	60	20 Å²	20	32%	0.321	10%	0.1	S	C	.	.			trans	-62.6	161	178.2	-67.3	-24.9	0	0	0	112.1	H184 R428	D179-H184 HydrophobicContact CB-CB 4.31Å; D179-H184 WeakPolarHBondContact O-CB 3.42Å; D179-R428 IonicContact OD1-CZ 3.18Å; D179-R428 IonicContact OD1-NH1 2.61Å; D179-R428 PolarHBondContact OD1-NH1 3.3Å; D179-R428 IonicContact OD1-NH2 2.69Å; D179-R428 PolarHBondContact OD1-NH2 3.21Å
180	I	91.8	Very high	95.8	Very high	2 Å²	2	21.2 Å²	21.2	1%	0.01	11%	0.105	C	C	.	.			trans	-107.2	100.7	171.2	-60.1	-177.6	0	0	0	107.8	F431 R435 I442 Q444 I445	I180-F431 HydrophobicContact CD1-CB 3.68Å; I180-F431 HydrophobicContact CD1-CD1 4.2Å; I180-F431 HydrophobicContact CD1-CG 4Å; I180-F431 HydrophobicContact CG1-CB 3.97Å; I180-F431 HydrophobicContact CG1-CD1 4.44Å; I180-F431 HydrophobicContact CG1-CD2 4.35Å; I180-F431 HydrophobicContact CG1-CG 4.01Å; I180-R435 HydrophobicContact CD1-CG 3.78Å; I180-R435 HydrophobicContact CG1-CG 4.48Å; I180-I442 HydrophobicContact CD1-CG2 4.47Å; I180-I442 HydrophobicContact CG2-CG1 4.17Å; I180-I442 HydrophobicContact CG2-CG2 4.06Å; I180-Q444 VanDerWaalsContact O-CA 3.26Å; I180-Q444 WeakPolarHBondContact O-CA 3.38Å; I180-Q444 WeakPolarHBondContact O-CG 3.29Å; I180-I445 HydrophobicContact CB-CB 4.39Å; I180-I445 HydrophobicContact CB-CG1 4.25Å; I180-I445 HydrophobicContact CD1-CD1 3.67Å; I180-I445 HydrophobicContact CD1-CG1 4.21Å; I180-I445 HydrophobicContact CG2-CG1 4.24Å; I180-I445 PolarHBondContact O-N 3.32Å
181	D	92.1	Very high	95.8	Very high	32 Å²	32	21.1 Å²	21.1	17%	0.171	11%	0.105	C	C	.	.	S	Bend	trans	-151.8	-169.1	170.3	63.8	37.4	0	0	0	110.5	L183 H184 E443 Q444	D181-L183 VanDerWaalsContact C-N 3.26Å; D181-L183 PolarHBondContact O-N 3.34Å; D181-L183 WeakPolarHBondContact OD1-CA 3.22Å; D181-L183 PolarHBondContact OD1-N 2.77Å; D181-H184 IonicContact OD1-CG 3.83Å; D181-H184 PolarHBondContact OD1-N 3.06Å; D181-H184 IonicContact OD1-ND1 3.47Å; D181-H184 PolarHBondContact OD1-ND1 2.98Å; D181-H184 IonicContact OD2-CE1 3.94Å; D181-H184 IonicContact OD2-CG 2.79Å; D181-H184 IonicContact OD2-ND1 2.93Å; D181-H184 PolarHBondContact OD2-ND1 3.38Å; D181-E443 WeakPolarHBondContact CA-O 3.31Å; D181-Q444 HydrophobicContact CB-CG 4.23Å
182	S	89	Confident	95.8	Very high	31 Å²	31	21.1 Å²	21.1	22%	0.217	11%	0.105	C	C	.	.	S	Bend	trans	-73.9	-10.6	-178.1	57.4	0	0	0	0	114.7	M354 I362	S182-M354 WeakPolarHBondContact O-CE 3.45Å; S182-I362 WeakPolarHBondContact O-CB 3.31Å; S182-I362 WeakPolarHBondContact O-CG2 3.1Å; S182-I362 PolarHBondContact O-N 3.33Å
183	L	91.7	Very high	95.8	Very high	69 Å²	69	21.1 Å²	21.1	36%	0.361	11%	0.105	S	C	.	.	S	Bend	trans	-111.2	-21.9	-177.1	-57.8	-175.6	0	0	0	113	D181 Y303 M354 I362	D181-L183 VanDerWaalsContact C-N 3.26Å; D181-L183 PolarHBondContact O-N 3.34Å; D181-L183 WeakPolarHBondContact OD1-CA 3.22Å; D181-L183 PolarHBondContact OD1-N 2.77Å; L183-Y303 HydrophobicContact CD1-CD2 4.32Å; L183-Y303 HydrophobicContact CD2-CD1 3.84Å; L183-Y303 HydrophobicContact CD2-CD2 3.53Å; L183-Y303 HydrophobicContact CD2-CE1 4.25Å; L183-Y303 HydrophobicContact CD2-CE2 3.83Å; L183-Y303 HydrophobicContact CD2-CG 3.51Å; L183-M354 HydrophobicContact CD2-CE 3.77Å; L183-I362 WeakPolarHBondContact O-CD1 3.44Å
184	H	94.2	Very high	95.8	Very high	50 Å²	50	20.8 Å²	20.8	23%	0.231	10%	0.103	C	C	.	.			trans	-110.1	129.4	-176.9	-59.1	99	0	0	0	111.4	D178 D179 D181 R435	D178-H184 HydrophobicContact CB-CB 4.43Å; D178-H184 IonicContact OD1-CD2 2.84Å; D178-H184 IonicContact OD2-CD2 3.6Å; D178-H184 PolarHBondContact OD2-CD2 3.02Å; D179-H184 HydrophobicContact CB-CB 4.31Å; D179-H184 WeakPolarHBondContact O-CB 3.42Å; D181-H184 IonicContact OD1-CG 3.83Å; D181-H184 PolarHBondContact OD1-N 3.06Å; D181-H184 IonicContact OD1-ND1 3.47Å; D181-H184 PolarHBondContact OD1-ND1 2.98Å; D181-H184 IonicContact OD2-CE1 3.94Å; D181-H184 IonicContact OD2-CG 2.79Å; D181-H184 IonicContact OD2-ND1 2.93Å; D181-H184 PolarHBondContact OD2-ND1 3.38Å; H184-R435 PolarHBondContact O-NH2 3.07Å
185	Y	96.3	Very high	95.7	Very high	2 Å²	2	22.2 Å²	22.2	1%	0.008	11%	0.108	C	C	.	.			trans	-139.1	141.7	174.1	-153.5	-96.6	0	0	0	107.5	L64 V187 I362 R363 W366 D440	L64-Y185 HydrophobicContact CD1-CE1 4.02Å; L64-Y185 HydrophobicContact CD2-CE1 4.42Å; Y185-V187 WeakPolarHBondContact CD1-O 3.18Å; Y185-V187 PolarHBondContact O-N 2.93Å; Y185-I362 HydrophobicContact CD2-CG2 4.2Å; Y185-I362 HydrophobicContact CG-CG2 4.48Å; Y185-R363 HydrophobicContact CD2-CG 4.01Å; Y185-R363 HydrophobicContact CE2-CB 4.44Å; Y185-R363 HydrophobicContact CE2-CG 3.88Å; Y185-W366 AromaticContact CD1-CD1 3.6Å; Y185-W366 HydrophobicContact CD1-CD2 4.27Å; Y185-W366 AromaticContact CD1-CE2 3.7Å; Y185-W366 HydrophobicContact CD1-CG 4.22Å; Y185-W366 HydrophobicContact CD1-CZ2 4.28Å; Y185-W366 AromaticContact CD1-NE1 3.22Å; Y185-W366 HydrophobicContact CE1-CB 4.45Å; Y185-W366 AromaticContact CE1-CD1 3.41Å; Y185-W366 VanDerWaalsContact CE1-CD1 3.41Å; Y185-W366 AromaticContact CE1-CD2 3.66Å; Y185-W366 HydrophobicContact CE1-CD2 3.66Å; Y185-W366 AromaticContact CE1-CE2 3.56Å; Y185-W366 HydrophobicContact CE1-CE3 4.45Å; Y185-W366 AromaticContact CE1-CG 3.6Å; Y185-W366 HydrophobicContact CE1-CG 3.6Å; Y185-W366 HydrophobicContact CE1-CZ2 4.29Å; Y185-W366 AromaticContact CE1-NE1 3.38Å; Y185-W366 HydrophobicContact CE2-CG 4.41Å; Y185-W366 AromaticContact CG-CD1 4Å; Y185-W366 AromaticContact CG-NE1 3.85Å; Y185-W366 AromaticContact CZ-CD1 3.64Å; Y185-W366 AromaticContact CZ-CG 3.7Å; Y185-D440 WeakPolarHBondContact CE2-OD1 3.42Å; Y185-D440 PolarHBondContact OH-OD1 2.85Å
186	P	96.6	Very high	95.6	Very high	7 Å²	7	22.2 Å²	22.2	5%	0.045	11%	0.108	C	C	.	.	S	Bend	trans	-62.7	-16.4	-174.4	24.7	-36.3	0	0	0	113.7	I61 L64 Y141 Y175 R176	I61-P186 HydrophobicContact CD1-CB 3.61Å; I61-P186 HydrophobicContact CD1-CG 3.8Å; L64-P186 HydrophobicContact CD1-CG 4.3Å; Y141-P186 HydrophobicContact CE2-CB 4.14Å; Y141-P186 WeakPolarHBondContact OH-CB 3.41Å; Y175-P186 WeakPolarHBondContact CA-O 3.32Å; R176-P186 PolarHBondContact N-O 2.94Å; R176-P186 VanDerWaalsContact O-CA 3.26Å; R176-P186 WeakPolarHBondContact O-CA 3.29Å
187	V	97.9	Very high	95.5	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	125.9	172.8	-168.3	0	0	0	0	109	L64 D173 V174 Y175 Y185 W366	L64-V187 HydrophobicContact CB-CG2 3.79Å; L64-V187 HydrophobicContact CD1-CB 4.33Å; L64-V187 HydrophobicContact CD1-CG2 3.51Å; L64-V187 HydrophobicContact CG-CG2 4.3Å; D173-V187 HydrophobicContact CB-CG1 4.02Å; V174-V187 WeakPolarHBondContact O-CA 3.45Å; Y175-V187 HydrophobicContact CD1-CB 4.3Å; Y175-V187 HydrophobicContact CD1-CG1 4.14Å; Y175-V187 HydrophobicContact CD1-CG2 3.4Å; Y175-V187 HydrophobicContact CE1-CB 4.11Å; Y175-V187 HydrophobicContact CE1-CG1 3.68Å; Y175-V187 HydrophobicContact CE1-CG2 3.28Å; Y175-V187 HydrophobicContact CE2-CG1 4.3Å; Y175-V187 HydrophobicContact CG-CG2 4.41Å; Y185-V187 WeakPolarHBondContact CD1-O 3.18Å; Y185-V187 PolarHBondContact O-N 2.93Å; V187-W366 HydrophobicContact CB-CH2 3.81Å; V187-W366 HydrophobicContact CB-CZ2 3.61Å; V187-W366 HydrophobicContact CG1-CH2 3.68Å; V187-W366 HydrophobicContact CG1-CZ2 3.74Å; V187-W366 WeakPolarHBondContact O-CZ2 3.46Å
188	F	98.1	Very high	95.5	Very high	28 Å²	28	20 Å²	20	12%	0.123	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	177.8	171.2	64.5	-83.2	0	0	0	108.3	D173 V174 R176 Q190 E350 I362	D173-F188 CarbonylContact C-O 3.13Å; D173-F188 WeakPolarHBondContact CA-O 3.24Å; V174-F188 HydrophobicContact CG2-CD1 4.1Å; V174-F188 HydrophobicContact CG2-CD2 3.65Å; V174-F188 HydrophobicContact CG2-CE1 3.78Å; V174-F188 HydrophobicContact CG2-CE2 3.31Å; V174-F188 HydrophobicContact CG2-CG 4.02Å; V174-F188 HydrophobicContact CG2-CZ 3.37Å; V174-F188 WeakPolarHBondContact CG2-O 3.38Å; V174-F188 PolarHBondContact N-O 3.07Å; V174-F188 PolarHBondContact O-N 2.9Å; V174-F188 VanDerWaalsContact O-N 3.13Å; R176-F188 HydrophobicContact CB-CE1 4.35Å; R176-F188 HydrophobicContact CG-CE1 3.93Å; R176-F188 HydrophobicContact CG-CZ 4.41Å; F188-Q190 HydrophobicContact CD2-CG 4.37Å; F188-Q190 HydrophobicContact CE2-CG 3.86Å; F188-E350 VanDerWaalsContact CA-OE1 3.25Å; F188-E350 WeakPolarHBondContact CA-OE1 3.26Å; F188-E350 HydrophobicContact CB-CG 4.39Å; F188-I362 HydrophobicContact CB-CD1 4.49Å
189	H	98.8	Very high	95.6	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	138.8	-172.3	-57.2	72.7	0	0	0	110.9	H70 L77 G172 L349 E350 W366	H70-H189 AromaticContact CG-CD2 3.81Å; H70-H189 AromaticContact ND1-CD2 3.29Å; H70-H189 PolarHBondContact ND1-CD2 2.87Å; H70-H189 VanDerWaalsContact ND1-CD2 3.29Å; H70-H189 AromaticContact ND1-NE2 3.7Å; L77-H189 HydrophobicContact CD1-CB 4.47Å; L77-H189 WeakPolarHBondContact CD1-ND1 3.49Å; G172-H189 CarbonylContact O-C 3.5Å; G172-H189 VanDerWaalsContact O-CA 3.3Å; G172-H189 WeakPolarHBondContact O-CA 3.42Å; H189-L349 HydrophobicContact CB-CB 4.15Å; H189-L349 HydrophobicContact CB-CD1 3.83Å; H189-L349 HydrophobicContact CB-CG 4.33Å; H189-L349 PolarHBondContact O-N 3.02Å; H189-E350 IonicContact CE1-OE1 2.61Å; H189-E350 IonicContact CG-OE1 2.64Å; H189-E350 PolarHBondContact N-OE1 2.86Å; H189-E350 PolarHBondContact N-OE2 2.91Å; H189-E350 IonicContact ND1-OE1 3.63Å; H189-E350 PolarHBondContact ND1-OE1 2.77Å; H189-W366 AromaticContact CE1-CZ2 3.84Å
190	Q	98.7	Very high	95.5	Very high	24 Å²	24	23.2 Å²	23.2	11%	0.112	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	156.1	173.7	-72.1	-173.3	-35	0	0	111.6	H152 T153 A171 G172 V174 F188 L347	H152-Q190 VanDerWaalsContact CB-OE1 3.23Å; T153-Q190 HydrophobicContact CG2-CB 3.81Å; T153-Q190 WeakPolarHBondContact OG1-CB 3.35Å; T153-Q190 PolarHBondContact OG1-OE1 3.37Å; A171-Q190 WeakPolarHBondContact CA-O 3.44Å; G172-Q190 PolarHBondContact N-O 3.34Å; G172-Q190 PolarHBondContact O-N 2.98Å; V174-Q190 HydrophobicContact CG1-CB 4.29Å; V174-Q190 HydrophobicContact CG1-CG 4.32Å; V174-Q190 HydrophobicContact CG2-CG 3.91Å; F188-Q190 HydrophobicContact CD2-CG 4.37Å; F188-Q190 HydrophobicContact CE2-CG 3.86Å; Q190-L347 CarbonylContact C-O 3.53Å; Q190-L347 WeakPolarHBondContact CA-O 3.44Å
191	L	98.8	Very high	95.5	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	117.1	161.6	-173.7	155.7	0	0	0	109	K81 I84 L169 V170 F345 G346 L347 L349	K81-L191 HydrophobicContact CG-CD1 4.26Å; I84-L191 HydrophobicContact CB-CD1 4.09Å; I84-L191 HydrophobicContact CD1-CD1 4.3Å; I84-L191 HydrophobicContact CG2-CD1 3.73Å; I84-L191 HydrophobicContact CG2-CD2 3.94Å; L169-L191 HydrophobicContact CD2-CD2 3.99Å; V170-L191 CarbonylContact O-C 3.52Å; V170-L191 VanDerWaalsContact O-CA 3.26Å; V170-L191 WeakPolarHBondContact O-CA 3.46Å; L191-F345 HydrophobicContact CD2-CE2 4.05Å; L191-G346 WeakPolarHBondContact O-CA 3.41Å; L191-L347 HydrophobicContact CB-CD1 3.91Å; L191-L347 HydrophobicContact CB-CG 4Å; L191-L347 HydrophobicContact CD2-CD2 4.22Å; L191-L347 PolarHBondContact N-O 3.03Å; L191-L347 PolarHBondContact O-N 3.4Å; L191-L349 HydrophobicContact CB-CD2 4.04Å; L191-L349 HydrophobicContact CB-CG 4.43Å
192	E	98.7	Very high	95.5	Very high	2 Å²	2	25 Å²	25	1%	0.009	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	143.3	170.8	-154.3	82.2	179	0	0	109.8	T153 S154 Q157 L169 V170 F345	T153-E192 WeakPolarHBondContact CB-OE2 3.31Å; T153-E192 PolarHBondContact OG1-OE2 3.03Å; S154-E192 WeakPolarHBondContact CA-OE1 3.06Å; S154-E192 VanDerWaalsContact CB-OE1 3.22Å; S154-E192 WeakPolarHBondContact CB-OE1 3.32Å; S154-E192 PolarHBondContact N-OE2 3.47Å; S154-E192 VanDerWaalsContact N-OE2 3.15Å; S154-E192 VanDerWaalsContact OG-CD 3.24Å; S154-E192 PolarHBondContact OG-OE1 2.83Å; S154-E192 PolarHBondContact OG-OE2 2.67Å; Q157-E192 PolarHBondContact NE2-OE1 3.28Å; L169-E192 CarbonylContact C-O 3.58Å; L169-E192 WeakPolarHBondContact CA-O 3.34Å; V170-E192 HydrophobicContact CB-CB 3.84Å; V170-E192 HydrophobicContact CG2-CB 4.33Å; V170-E192 PolarHBondContact N-O 2.98Å; V170-E192 PolarHBondContact O-N 3.38Å; E192-F345 CarbonylContact C-O 3.56Å; E192-F345 VanDerWaalsContact CA-O 3.3Å; E192-F345 WeakPolarHBondContact CA-O 3.22Å
193	G	98.1	Very high	95.7	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	134.1	161.9	0	0	0	0	0	111.3	A344 F345	G193-A344 CarbonylContact O-C 3.5Å; G193-A344 VanDerWaalsContact O-CA 3.25Å; G193-A344 WeakPolarHBondContact O-CA 3.49Å; G193-F345 PolarHBondContact N-O 3.43Å; G193-F345 PolarHBondContact O-N 3.3Å
194	V	98.1	Very high	95.5	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	136.2	175.1	171.4	0	0	0	0	109.1	F107 Q157 I161 A167 F168 L196 M327 A344	F107-V194 WeakPolarHBondContact CE1-O 3.35Å; Q157-V194 HydrophobicContact CG-CG2 3.97Å; I161-V194 HydrophobicContact CD1-CG1 4.26Å; I161-V194 HydrophobicContact CG1-CG1 4.41Å; A167-V194 WeakPolarHBondContact CA-O 3.15Å; F168-V194 HydrophobicContact CD1-CB 4.15Å; F168-V194 HydrophobicContact CD1-CG1 4.37Å; F168-V194 HydrophobicContact CD2-CB 4.21Å; F168-V194 HydrophobicContact CD2-CG2 4.45Å; F168-V194 HydrophobicContact CE1-CB 3.65Å; F168-V194 HydrophobicContact CE1-CG1 3.62Å; F168-V194 HydrophobicContact CE1-CG2 4.25Å; F168-V194 HydrophobicContact CE2-CB 3.71Å; F168-V194 HydrophobicContact CE2-CG1 4.48Å; F168-V194 HydrophobicContact CE2-CG2 3.6Å; F168-V194 HydrophobicContact CG-CB 4.43Å; F168-V194 HydrophobicContact CZ-CB 3.41Å; F168-V194 VanDerWaalsContact CZ-CB 3.41Å; F168-V194 HydrophobicContact CZ-CG1 3.7Å; F168-V194 HydrophobicContact CZ-CG2 3.49Å; F168-V194 VanDerWaalsContact CZ-CG2 3.49Å; F168-V194 PolarHBondContact N-O 2.98Å; F168-V194 VanDerWaalsContact N-O 3.17Å; F168-V194 PolarHBondContact O-N 2.92Å; V194-L196 HydrophobicContact CG1-CD2 3.93Å; V194-L196 HydrophobicContact CG1-CG 4.25Å; V194-M327 HydrophobicContact CG1-CE 4.37Å; V194-M327 HydrophobicContact CG1-SD 3.74Å; V194-A344 HydrophobicContact CG2-CB 4.05Å
195	R	96.8	Very high	95.1	Very high	29 Å²	29	30.1 Å²	30.1	11%	0.109	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	125.7	172.9	-175.6	64.8	-174.7	155.6	7.2	110.6	F107 N166 A167 F197 E201 G342 Y343	F107-R195 HydrophobicContact CZ-CB 4.08Å; F107-R195 HydrophobicContact CZ-CG 4.39Å; N166-R195 WeakPolarHBondContact O-CA 3.35Å; A167-R195 VanDerWaalsContact CB-NH1 3.34Å; R195-F197 HydrophobicContact CB-CE2 4.14Å; R195-F197 HydrophobicContact CB-CZ 4.27Å; R195-F197 HydrophobicContact CG-CD2 4.45Å; R195-F197 HydrophobicContact CG-CE1 4.08Å; R195-F197 HydrophobicContact CG-CE2 3.5Å; R195-F197 VanDerWaalsContact CG-CE2 3.5Å; R195-F197 HydrophobicContact CG-CZ 3.26Å; R195-E201 IonicContact NH2-OE1 3.34Å; R195-G342 CarbonylContact O-C 3.54Å; R195-G342 WeakPolarHBondContact O-CA 3.33Å; R195-Y343 HydrophobicContact CB-CD2 4.07Å; R195-Y343 HydrophobicContact CB-CE1 4.13Å; R195-Y343 HydrophobicContact CB-CE2 3.49Å; R195-Y343 VanDerWaalsContact CB-CE2 3.49Å; R195-Y343 HydrophobicContact CG-CE1 4.3Å; R195-Y343 HydrophobicContact CG-CE2 4.36Å; R195-Y343 PolarHBondContact N-O 2.92Å; R195-Y343 PolarHBondContact O-N 3.21Å
196	L	96.7	Very high	94.7	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	152	178.5	-49.3	-175.6	0	0	0	110.8	I161 N166 V194 M327 L332 I337 K340 V341	I161-L196 HydrophobicContact CG1-CD1 4.3Å; I161-L196 HydrophobicContact CG2-CD1 3.91Å; N166-L196 HydrophobicContact CB-CB 4.29Å; N166-L196 PolarHBondContact O-N 3.46Å; V194-L196 HydrophobicContact CG1-CD2 3.93Å; V194-L196 HydrophobicContact CG1-CG 4.25Å; L196-M327 HydrophobicContact CD2-SD 3.78Å; L196-L332 HydrophobicContact CD1-CD2 4.28Å; L196-L332 HydrophobicContact CD2-CD2 3.79Å; L196-I337 HydrophobicContact CD1-CD1 3.39Å; L196-K340 HydrophobicContact CB-CD 4.27Å; L196-V341 CarbonylContact C-O 3.51Å; L196-V341 VanDerWaalsContact CA-O 3.29Å; L196-V341 WeakPolarHBondContact CA-O 3.23Å
197	F	95.4	Very high	94.2	Very high	7 Å²	7	37.8 Å²	37.8	3%	0.031	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	138.6	-177	-56.6	-94.3	0	0	0	110.6	R195 E201 L202 L257 E260 K340 V341 Y343	R195-F197 HydrophobicContact CB-CE2 4.14Å; R195-F197 HydrophobicContact CB-CZ 4.27Å; R195-F197 HydrophobicContact CG-CD2 4.45Å; R195-F197 HydrophobicContact CG-CE1 4.08Å; R195-F197 HydrophobicContact CG-CE2 3.5Å; R195-F197 VanDerWaalsContact CG-CE2 3.5Å; R195-F197 HydrophobicContact CG-CZ 3.26Å; F197-E201 WeakPolarHBondContact CA-OE2 3.47Å; F197-E201 HydrophobicContact CB-CB 4.34Å; F197-E201 HydrophobicContact CD1-CB 4.22Å; F197-L202 HydrophobicContact CB-CB 4.06Å; F197-L202 HydrophobicContact CB-CD1 4.46Å; F197-L202 HydrophobicContact CD1-CD1 4.37Å; F197-L202 HydrophobicContact CG-CD1 4.2Å; F197-L257 HydrophobicContact CD2-CD2 3.56Å; F197-L257 HydrophobicContact CE2-CD2 3.8Å; F197-L257 HydrophobicContact CG-CD2 4.45Å; F197-E260 WeakPolarHBondContact CE1-OE1 3.37Å; F197-E260 WeakPolarHBondContact CE1-OE2 3.21Å; F197-E260 WeakPolarHBondContact CZ-OE1 3.39Å; F197-E260 WeakPolarHBondContact CZ-OE2 3.45Å; F197-K340 VanDerWaalsContact O-CA 3.31Å; F197-K340 WeakPolarHBondContact O-CA 3.31Å; F197-K340 WeakPolarHBondContact O-CB 3.43Å; F197-V341 HydrophobicContact CB-CG2 4.44Å; F197-V341 PolarHBondContact N-O 3.22Å; F197-V341 PolarHBondContact O-N 2.8Å; F197-V341 VanDerWaalsContact O-N 3.16Å; F197-Y343 AromaticContact CE2-CD1 3.82Å; F197-Y343 HydrophobicContact CE2-CD1 3.82Å; F197-Y343 AromaticContact CE2-CE1 3.5Å; F197-Y343 HydrophobicContact CE2-CE1 3.5Å; F197-Y343 VanDerWaalsContact CE2-CE1 3.5Å; F197-Y343 HydrophobicContact CZ-CD1 4.37Å; F197-Y343 AromaticContact CZ-CE1 3.6Å; F197-Y343 HydrophobicContact CZ-CE1 3.6Å
198	T	94.4	Very high	93.6	Very high	36 Å²	36	39.8 Å²	39.8	22%	0.221	21%	0.212	C	C	.	.			trans	-78.1	169.1	157	68.2	0	0	0	0	110.6	D200 E201 L202 K340	T198-D200 VanDerWaalsContact C-N 3.31Å; T198-D200 PolarHBondContact O-N 3.46Å; T198-E201 PolarHBondContact N-OE2 3.29Å; T198-E201 PolarHBondContact O-N 2.9Å; T198-E201 WeakPolarHBondContact OG1-CG 3.01Å; T198-E201 PolarHBondContact OG1-N 2.92Å; T198-L202 PolarHBondContact O-N 3.34Å; T198-K340 HydrophobicContact CG2-CD 4.45Å; T198-K340 HydrophobicContact CG2-CG 4.45Å
199	S	93.5	Very high	92.9	Very high	35 Å²	35	43.3 Å²	43.3	25%	0.245	24%	0.238	C	C	.	.	H	α-helix	trans	-54.7	-48.9	174	-155.8	0	0	0	0	111.2	E201 L202 F203	S199-E201 VanDerWaalsContact C-N 3.27Å; S199-E201 PolarHBondContact O-N 3.45Å; S199-L202 PolarHBondContact O-N 2.99Å; S199-F203 WeakPolarHBondContact O-CB 3.47Å; S199-F203 VanDerWaalsContact O-CD2 3.27Å; S199-F203 WeakPolarHBondContact O-CD2 3.44Å; S199-F203 PolarHBondContact O-N 3.39Å; S199-F203 WeakPolarHBondContact OG-CD2 3.37Å
200	D	89.9	Confident	92.3	Very high	134 Å²	134	51.3 Å²	51.3	72%	0.717	27%	0.273	S	S	*	.	H	α-helix	trans	-63.5	-31.6	-179.5	-57.8	-25.6	0	0	0	113.1	T198 R204	T198-D200 VanDerWaalsContact C-N 3.31Å; T198-D200 PolarHBondContact O-N 3.46Å; D200-R204 WeakPolarHBondContact O-CA 3.4Å; D200-R204 WeakPolarHBondContact O-CB 3.46Å; D200-R204 PolarHBondContact O-N 3.42Å
201	E	90.8	Very high	91.4	Very high	55 Å²	55	58.7 Å²	58.7	26%	0.257	31%	0.307	S	S	.	.	H	α-helix	trans	-73.7	-46	176.6	-72.1	177.3	135.5	0	0	111.4	R195 F197 T198 S199	R195-E201 IonicContact NH2-OE1 3.34Å; F197-E201 WeakPolarHBondContact CA-OE2 3.47Å; F197-E201 HydrophobicContact CB-CB 4.34Å; F197-E201 HydrophobicContact CD1-CB 4.22Å; T198-E201 PolarHBondContact N-OE2 3.29Å; T198-E201 PolarHBondContact O-N 2.9Å; T198-E201 WeakPolarHBondContact OG1-CG 3.01Å; T198-E201 PolarHBondContact OG1-N 2.92Å; S199-E201 VanDerWaalsContact C-N 3.27Å; S199-E201 PolarHBondContact O-N 3.45Å
202	L	92.7	Very high	90.8	Very high	17 Å²	17	62.7 Å²	62.7	9%	0.089	34%	0.335	C	S	.	.	H	α-helix	trans	-71	-43.2	-176.3	-168.5	65.7	0	0	0	111.9	F197 T198 S199 L215 T253 L256 L257 V341	F197-L202 HydrophobicContact CB-CB 4.06Å; F197-L202 HydrophobicContact CB-CD1 4.46Å; F197-L202 HydrophobicContact CD1-CD1 4.37Å; F197-L202 HydrophobicContact CG-CD1 4.2Å; T198-L202 PolarHBondContact O-N 3.34Å; S199-L202 PolarHBondContact O-N 2.99Å; L202-L215 HydrophobicContact CB-CD2 4.27Å; L202-L215 HydrophobicContact CD2-CD2 3.63Å; L202-T253 HydrophobicContact CD2-CG2 3.88Å; L202-L256 HydrophobicContact CD1-CB 3.81Å; L202-L256 HydrophobicContact CD2-CB 4.37Å; L202-L256 HydrophobicContact CG-CB 3.99Å; L202-L256 HydrophobicContact CG-CD1 4.06Å; L202-L257 HydrophobicContact CD1-CD2 3.88Å; L202-L257 HydrophobicContact CD1-CG 4.17Å; L202-L257 HydrophobicContact CD2-CD2 4.49Å; L202-L257 HydrophobicContact CD2-CG 4.23Å; L202-V341 HydrophobicContact CD2-CG2 4Å
203	F	93.3	Very high	90.4	Very high	18 Å²	18	65.9 Å²	65.9	8%	0.079	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	11.9	-177.2	-57.8	-59.6	0	0	0	113.9	S199 N205 A206 F213 L215 E252 T253 L256	S199-F203 WeakPolarHBondContact O-CB 3.47Å; S199-F203 VanDerWaalsContact O-CD2 3.27Å; S199-F203 WeakPolarHBondContact O-CD2 3.44Å; S199-F203 PolarHBondContact O-N 3.39Å; S199-F203 WeakPolarHBondContact OG-CD2 3.37Å; F203-N205 PolarHBondContact O-N 2.8Å; F203-A206 HydrophobicContact CB-CB 4.21Å; F203-A206 VanDerWaalsContact O-CB 3.29Å; F203-A206 WeakPolarHBondContact O-CB 3.44Å; F203-A206 PolarHBondContact O-N 3Å; F203-F213 HydrophobicContact CB-CD2 4.21Å; F203-F213 HydrophobicContact CD1-CB 4.18Å; F203-F213 HydrophobicContact CD1-CD2 4.18Å; F203-F213 HydrophobicContact CD1-CG 4.27Å; F203-F213 HydrophobicContact CD2-CB 3.69Å; F203-F213 HydrophobicContact CE1-CB 4.29Å; F203-F213 HydrophobicContact CE2-CB 3.8Å; F203-F213 HydrophobicContact CG-CB 3.89Å; F203-F213 HydrophobicContact CG-CD2 4.16Å; F203-F213 HydrophobicContact CG-CG 4.32Å; F203-F213 HydrophobicContact CZ-CB 4.11Å; F203-L215 HydrophobicContact CE2-CD2 3.74Å; F203-L215 HydrophobicContact CE2-CG 4.41Å; F203-L215 HydrophobicContact CZ-CD2 4.21Å; F203-E252 HydrophobicContact CE1-CB 3.94Å; F203-E252 HydrophobicContact CZ-CB 4.47Å; F203-T253 WeakPolarHBondContact CZ-OG1 3.37Å; F203-L256 HydrophobicContact CD1-CD1 3.42Å; F203-L256 VanDerWaalsContact CD1-CD1 3.42Å; F203-L256 HydrophobicContact CE1-CD1 3.54Å
204	R	87.6	Confident	90.2	Very high	105 Å²	105	73.8 Å²	73.8	40%	0.396	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.1	-40.3	-175	-177.1	178.6	-63.2	169.1	-6.6	115.1	Q101 D200	Q101-R204 VanDerWaalsContact CD-CZ 3.48Å; Q101-R204 VanDerWaalsContact NE2-NE 3.16Å; D200-R204 WeakPolarHBondContact O-CA 3.4Å; D200-R204 WeakPolarHBondContact O-CB 3.46Å; D200-R204 PolarHBondContact O-N 3.42Å
205	N	86.3	Confident	90.1	Very high	133 Å²	133	74.4 Å²	74.4	71%	0.711	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	1.4	-176.8	-63.8	-23	0	0	0	112.4	F203	F203-N205 PolarHBondContact O-N 2.8Å
206	A	87.3	Confident	90	Very high	41 Å²	41	75.5 Å²	75.5	34%	0.339	39%	0.39	S	S	.	.	S	Bend	trans	-84.2	141.7	178.7	0	0	0	0	0	110	F203 D208 F213	F203-A206 HydrophobicContact CB-CB 4.21Å; F203-A206 VanDerWaalsContact O-CB 3.29Å; F203-A206 WeakPolarHBondContact O-CB 3.44Å; F203-A206 PolarHBondContact O-N 3Å; A206-D208 PolarHBondContact O-N 3.48Å; A206-F213 HydrophobicContact CB-CD2 3.97Å; A206-F213 HydrophobicContact CB-CE2 3.52Å
207	T	86.4	Confident	89.9	Confident	129 Å²	129	79.3 Å²	79.3	79%	0.791	41%	0.407	S	S	*	.			trans	-83.5	104.5	173	-58.7	0	0	0	0	108.5
208	D	86.2	Confident	89.6	Confident	42 Å²	42	85.8 Å²	85.8	23%	0.225	44%	0.442	C	S	.	.			trans	-125.4	72.2	-179	-167.8	4.8	0	0	0	111.9	A206 F210 Q211 C212 F213	A206-D208 PolarHBondContact O-N 3.48Å; D208-F210 PolarHBondContact O-N 3.13Å; D208-F210 VanDerWaalsContact O-N 3.08Å; D208-Q211 PolarHBondContact O-N 3.48Å; D208-Q211 PolarHBondContact OD1-N 2.79Å; D208-Q211 VanDerWaalsContact OD1-N 3.09Å; D208-Q211 VanDerWaalsContact OD2-C 3.26Å; D208-Q211 WeakPolarHBondContact OD2-CA 3.38Å; D208-C212 VanDerWaalsContact CG-N 3.32Å; D208-C212 PolarHBondContact OD1-N 3.41Å; D208-C212 PolarHBondContact OD2-N 2.99Å; D208-F213 HydrophobicContact CB-CD2 3.43Å; D208-F213 VanDerWaalsContact CB-CD2 3.43Å; D208-F213 HydrophobicContact CB-CE2 3.54Å; D208-F213 HydrophobicContact CB-CG 4.3Å; D208-F213 HydrophobicContact CB-CZ 4.5Å; D208-F213 VanDerWaalsContact CG-CD2 3.47Å; D208-F213 WeakPolarHBondContact OD2-CB 3.42Å; D208-F213 WeakPolarHBondContact OD2-CD2 3.47Å; D208-F213 WeakPolarHBondContact OD2-CG 3.39Å; D208-F213 PolarHBondContact OD2-N 2.84Å
209	P	81.5	Confident	89.3	Confident	102 Å²	102	87.3 Å²	87.3	66%	0.662	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-18.4	-174	26.2	-33.9	0	0	0	113.3
210	F	86.4	Confident	88.9	Confident	169 Å²	169	89.4 Å²	89.4	74%	0.741	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.2	4.8	-177.8	-59.1	-68.3	0	0	0	113.5	D208 C212	D208-F210 PolarHBondContact O-N 3.13Å; D208-F210 VanDerWaalsContact O-N 3.08Å; F210-C212 WeakPolarHBondContact CB-SG 3.35Å; F210-C212 PolarHBondContact O-N 2.96Å; F210-C212 PolarHBondContact O-SG 3.08Å; F210-C212 VanDerWaalsContact O-SG 3.4Å
211	Q	81.5	Confident	88.6	Confident	178 Å²	178	88.6 Å²	88.6	83%	0.832	47%	0.466	S	S	*	.			trans	50.4	42.1	-177	-60.3	-179.4	13.6	0	0	112.4	D208	D208-Q211 PolarHBondContact O-N 3.48Å; D208-Q211 PolarHBondContact OD1-N 2.79Å; D208-Q211 VanDerWaalsContact OD1-N 3.09Å; D208-Q211 VanDerWaalsContact OD2-C 3.26Å; D208-Q211 WeakPolarHBondContact OD2-CA 3.38Å
212	C	85.3	Confident	88.4	Confident	85 Å²	85	91.1 Å²	91.1	57%	0.574	49%	0.49	S	S	*	.			trans	-91	-15.7	-176.1	-71.3	0	0	0	0	112.7	D208 F210 R214	D208-C212 VanDerWaalsContact CG-N 3.32Å; D208-C212 PolarHBondContact OD1-N 3.41Å; D208-C212 PolarHBondContact OD2-N 2.99Å; F210-C212 WeakPolarHBondContact CB-SG 3.35Å; F210-C212 PolarHBondContact O-N 2.96Å; F210-C212 PolarHBondContact O-SG 3.08Å; F210-C212 VanDerWaalsContact O-SG 3.4Å; C212-R214 PolarHBondContact O-N 3.22Å
213	F	89.8	Confident	88	Confident	69 Å²	69	91.3 Å²	91.3	30%	0.303	49%	0.492	S	S	.	.			trans	-68.7	125.1	178.9	-64.9	-36.6	0	0	0	111	F203 A206 D208	F203-F213 HydrophobicContact CB-CD2 4.21Å; F203-F213 HydrophobicContact CD1-CB 4.18Å; F203-F213 HydrophobicContact CD1-CD2 4.18Å; F203-F213 HydrophobicContact CD1-CG 4.27Å; F203-F213 HydrophobicContact CD2-CB 3.69Å; F203-F213 HydrophobicContact CE1-CB 4.29Å; F203-F213 HydrophobicContact CE2-CB 3.8Å; F203-F213 HydrophobicContact CG-CB 3.89Å; F203-F213 HydrophobicContact CG-CD2 4.16Å; F203-F213 HydrophobicContact CG-CG 4.32Å; F203-F213 HydrophobicContact CZ-CB 4.11Å; A206-F213 HydrophobicContact CB-CD2 3.97Å; A206-F213 HydrophobicContact CB-CE2 3.52Å; D208-F213 HydrophobicContact CB-CD2 3.43Å; D208-F213 VanDerWaalsContact CB-CD2 3.43Å; D208-F213 HydrophobicContact CB-CE2 3.54Å; D208-F213 HydrophobicContact CB-CG 4.3Å; D208-F213 HydrophobicContact CB-CZ 4.5Å; D208-F213 VanDerWaalsContact CG-CD2 3.47Å; D208-F213 WeakPolarHBondContact OD2-CB 3.42Å; D208-F213 WeakPolarHBondContact OD2-CD2 3.47Å; D208-F213 WeakPolarHBondContact OD2-CG 3.39Å; D208-F213 PolarHBondContact OD2-N 2.84Å
214	R	93.3	Very high	87.6	Confident	165 Å²	165	95.5 Å²	95.5	62%	0.623	52%	0.521	S	S	*	.			trans	-120.8	144.7	175.1	-61.4	-176.3	-176.2	-167.3	1.4	108.4	C212 L216 T250	C212-R214 PolarHBondContact O-N 3.22Å; R214-L216 VanDerWaalsContact C-N 3.28Å; R214-L216 WeakPolarHBondContact CB-O 3.37Å; R214-T250 WeakPolarHBondContact O-CG2 3.47Å; R214-T250 PolarHBondContact O-OG1 2.81Å
215	L	96.4	Very high	87.3	Confident	13 Å²	13	93 Å²	93	7%	0.068	51%	0.512	C	S	.	.	S	Bend	trans	-64.9	-40.3	170.2	-67.5	-179	0	0	0	111.1	L202 F203 T250 T253 V341	L202-L215 HydrophobicContact CB-CD2 4.27Å; L202-L215 HydrophobicContact CD2-CD2 3.63Å; F203-L215 HydrophobicContact CE2-CD2 3.74Å; F203-L215 HydrophobicContact CE2-CG 4.41Å; F203-L215 HydrophobicContact CZ-CD2 4.21Å; L215-T250 PolarHBondContact O-N 3.24Å; L215-T250 VanDerWaalsContact O-N 3.14Å; L215-T250 PolarHBondContact O-OG1 2.87Å; L215-T253 VanDerWaalsContact CA-OG1 3.28Å; L215-T253 WeakPolarHBondContact CA-OG1 3.46Å; L215-T253 HydrophobicContact CD2-CG2 4.29Å; L215-T253 PolarHBondContact O-OG1 2.77Å; L215-T253 VanDerWaalsContact O-OG1 3.05Å; L215-V341 HydrophobicContact CB-CG1 4.03Å; L215-V341 HydrophobicContact CD1-CG1 4.22Å; L215-V341 HydrophobicContact CD1-CG2 4.09Å; L215-V341 HydrophobicContact CD2-CG1 4.47Å; L215-V341 HydrophobicContact CD2-CG2 3.66Å; L215-V341 HydrophobicContact CG-CG1 4.49Å; L215-V341 HydrophobicContact CG-CG2 4.37Å
216	L	96	Very high	86.8	Confident	53 Å²	53	88.1 Å²	88.1	28%	0.277	49%	0.489	S	S	.	.	B	Isolated β-bridge	trans	-119.4	147.6	-170	-50.8	178.9	0	0	0	111.7	R214 C248 Q329 V341	R214-L216 VanDerWaalsContact C-N 3.28Å; R214-L216 WeakPolarHBondContact CB-O 3.37Å; L216-C248 CarbonylContact C-O 3.46Å; L216-C248 WeakPolarHBondContact CA-O 3.34Å; L216-C248 WeakPolarHBondContact CB-O 3.25Å; L216-Q329 HydrophobicContact CD2-CG 4.15Å; L216-V341 HydrophobicContact CD2-CG1 4.09Å
217	E	93.2	Very high	85.8	Confident	80 Å²	80	91.4 Å²	91.4	37%	0.374	50%	0.497	S	S	.	.			trans	-112.3	149.2	170.6	60.6	-171.9	-147	0	0	111.1	K245 V247 C248 T250	E217-K245 VanDerWaalsContact CD-NZ 3.31Å; E217-K245 IonicContact OE1-NZ 3.53Å; E217-K245 PolarHBondContact OE1-NZ 2.7Å; E217-K245 IonicContact OE2-NZ 3.64Å; E217-V247 WeakPolarHBondContact CG-O 3.37Å; E217-V247 VanDerWaalsContact OE1-O 3.13Å; E217-C248 PolarHBondContact N-O 3.29Å; E217-T250 HydrophobicContact CB-CG2 4.11Å
218	D	89.7	Confident	84	Confident	143 Å²	143	89.7 Å²	89.7	77%	0.765	49%	0.488	S	S	*	.	P	Polyproline II helix	trans	-69.3	131.8	176	-64.2	-46.7	0	0	0	109.7	P220	D218-P220 WeakPolarHBondContact O-CD 3.5Å
219	I	87.4	Confident	82.3	Confident	68 Å²	68	96 Å²	96	35%	0.349	52%	0.522	S	S	.	.	P	Polyproline II helix	trans	-79.8	118	175.6	-53.6	-179.4	0	0	0	108.1	S221 V247 C248	I219-S221 PolarHBondContact O-N 3.42Å; I219-V247 HydrophobicContact CB-CG1 4.48Å; I219-V247 HydrophobicContact CD1-CB 4.35Å; I219-V247 HydrophobicContact CD1-CG1 4.21Å; I219-V247 HydrophobicContact CG1-CG1 4.02Å; I219-V247 HydrophobicContact CG2-CG1 3.87Å; I219-C248 HydrophobicContact CD1-CB 4.21Å; I219-C248 HydrophobicContact CG1-CB 4.37Å
220	P	85.1	Confident	80.5	Confident	78 Å²	78	94.3 Å²	94.3	51%	0.506	51%	0.512	S	S	.	.	P	Polyproline II helix	trans	-59	141.2	178.8	-22.9	33.4	0	0	0	110.9	D218 S222 S223 S226	D218-P220 WeakPolarHBondContact O-CD 3.5Å; P220-S222 PolarHBondContact O-N 2.75Å; P220-S222 VanDerWaalsContact O-N 3.07Å; P220-S223 WeakPolarHBondContact O-CB 3.18Å; P220-S223 PolarHBondContact O-N 2.9Å; P220-S226 WeakPolarHBondContact O-CB 3.47Å
221	S	84.6	Confident	78.7	Confident	118 Å²	118	93.2 Å²	93.2	83%	0.825	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-15.5	176.7	55	0	0	0	0	114.2	I219 S223 S226	I219-S221 PolarHBondContact O-N 3.42Å; S221-S223 VanDerWaalsContact C-N 3.35Å; S221-S226 PolarHBondContact O-OG 3.37Å
222	S	86.7	Confident	77.2	Confident	108 Å²	108	89.5 Å²	89.5	76%	0.755	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-7.6	172.1	61.6	0	0	0	0	113.5	P220	P220-S222 PolarHBondContact O-N 2.75Å; P220-S222 VanDerWaalsContact O-N 3.07Å
223	S	84.8	Confident	75.6	Confident	20 Å²	20	92.6 Å²	92.6	14%	0.14	50%	0.504	C	S	.	.	S	Bend	trans	-67.7	137.5	-179.7	-178.7	0	0	0	0	109.8	P220 S221 Y225 S226	P220-S223 WeakPolarHBondContact O-CB 3.18Å; P220-S223 PolarHBondContact O-N 2.9Å; S221-S223 VanDerWaalsContact C-N 3.35Å; S223-Y225 PolarHBondContact O-N 3.33Å; S223-Y225 PolarHBondContact OG-N 2.98Å; S223-S226 PolarHBondContact O-N 2.82Å; S223-S226 PolarHBondContact O-OG 3.37Å
224	P	83.8	Confident	74.4	Confident	106 Å²	106	98.6 Å²	98.6	69%	0.688	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-11.3	171	28.1	-34.7	0	0	0	112.6	F236	P224-F236 WeakPolarHBondContact O-CZ 3.31Å
225	Y	81.9	Confident	73.7	Confident	54 Å²	54	92.2 Å²	92.2	21%	0.212	50%	0.504	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.6	-2.3	178.6	-50.8	-73	0	0	0	114.1	S223 E227 F236 M240 L241 P242 V247	S223-Y225 PolarHBondContact O-N 3.33Å; S223-Y225 PolarHBondContact OG-N 2.98Å; Y225-E227 PolarHBondContact O-N 3.18Å; Y225-F236 HydrophobicContact CD1-CD1 4.33Å; Y225-F236 HydrophobicContact CD1-CD2 4.25Å; Y225-F236 HydrophobicContact CD1-CE1 4.38Å; Y225-F236 HydrophobicContact CD1-CE2 4.31Å; Y225-F236 HydrophobicContact CD1-CG 4.26Å; Y225-F236 HydrophobicContact CD1-CZ 4.37Å; Y225-M240 WeakPolarHBondContact CE1-O 3.26Å; Y225-M240 PolarHBondContact OH-O 3.45Å; Y225-L241 HydrophobicContact CD1-CD2 4.26Å; Y225-L241 HydrophobicContact CE1-CD2 4.32Å; Y225-P242 HydrophobicContact CE2-CG 3.84Å; Y225-V247 HydrophobicContact CD1-CG2 4.29Å; Y225-V247 HydrophobicContact CD2-CG1 4.28Å; Y225-V247 HydrophobicContact CD2-CG2 3.46Å; Y225-V247 VanDerWaalsContact CD2-CG2 3.46Å; Y225-V247 HydrophobicContact CE2-CG2 4.01Å; Y225-V247 HydrophobicContact CG-CG2 3.62Å
226	S	76.1	Confident	73.1	Confident	30 Å²	30	94.2 Å²	94.2	21%	0.21	51%	0.512	C	S	.	.	S	Bend	trans	-71.5	124.4	170.5	60	0	0	0	0	108.6	P220 S221 S223 P228	P220-S226 WeakPolarHBondContact O-CB 3.47Å; S221-S226 PolarHBondContact O-OG 3.37Å; S223-S226 PolarHBondContact O-N 2.82Å; S223-S226 PolarHBondContact O-OG 3.37Å; S226-P228 WeakPolarHBondContact O-CD 3.34Å
227	E	66.2	Low	72.7	Confident	110 Å²	110	93.4 Å²	93.4	51%	0.514	51%	0.51	S	S	.	.			trans	-55.7	124	-176.3	-74.8	-139.6	168.7	0	0	111.6	Y225 D229	Y225-E227 PolarHBondContact O-N 3.18Å; E227-D229 PolarHBondContact O-N 3.3Å
228	P	48.9	Very low	72.5	Confident	93 Å²	93	89.7 Å²	89.7	60%	0.604	49%	0.493	S	S	*	.			trans	-89.8	80.8	172.3	33	-27.4	0	0	0	108.9	S226 S230	S226-P228 WeakPolarHBondContact O-CD 3.34Å; P228-S230 WeakPolarHBondContact O-CA 3.1Å; P228-S230 WeakPolarHBondContact O-CB 3.33Å; P228-S230 PolarHBondContact O-N 3.08Å; P228-S230 PolarHBondContact O-OG 3.22Å
229	D	49.5	Very low	72.4	Confident	174 Å²	174	90.5 Å²	90.5	93%	0.93	49%	0.487	S	S	*	.	S	Bend	trans	42.8	11.8	163	-77.6	-31	0	0	0	119.2	E227	E227-D229 PolarHBondContact O-N 3.3Å
230	S	43.3	Very low	72.5	Confident	67 Å²	67	91.6 Å²	91.6	47%	0.469	49%	0.492	S	S	.	.	S	Bend	trans	-127.9	96.2	-165.5	52.5	0	0	0	0	111.3	P228	P228-S230 WeakPolarHBondContact O-CA 3.1Å; P228-S230 WeakPolarHBondContact O-CB 3.33Å; P228-S230 PolarHBondContact O-N 3.08Å; P228-S230 PolarHBondContact O-OG 3.22Å
231	H	48.8	Very low	72.8	Confident	146 Å²	146	88.5 Å²	88.5	68%	0.676	47%	0.471	S	S	*	.			trans	68.9	114.9	178.4	-73.1	-49.3	0	0	0	116.1	F233 R234	H231-F233 PolarHBondContact O-N 3.1Å; H231-R234 PolarHBondContact O-N 2.83Å
232	P	49.6	Very low	73.2	Confident	99 Å²	99	84.5 Å²	84.5	64%	0.643	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	18	-179.9	27.5	-34	0	0	0	114.7
233	F	52.5	Low	73.4	Confident	150 Å²	150	85.2 Å²	85.2	66%	0.658	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-132.1	-1.2	-174.3	-59.6	-66.1	0	0	0	113.6	H231 V235 R334	H231-F233 PolarHBondContact O-N 3.1Å; F233-V235 PolarHBondContact O-N 3.37Å; F233-R334 PolarHBondContact O-NH2 3.39Å
234	R	64.6	Low	73.8	Confident	196 Å²	196	88.2 Å²	88.2	74%	0.74	46%	0.459	S	S	*	.			trans	-90.6	85.6	-176.4	-154.3	-179.3	-165.5	-150.9	2.3	111	H231	H231-R234 PolarHBondContact O-N 2.83Å
235	V	77.9	Confident	74.3	Confident	31 Å²	31	84.2 Å²	84.2	19%	0.188	43%	0.43	C	S	.	.	P	Polyproline II helix	trans	-79.1	135.7	178.5	-176	0	0	0	0	110	F127 F233 R328 E330	F127-V235 HydrophobicContact CD1-CB 4.02Å; F127-V235 HydrophobicContact CD1-CG1 4.15Å; F127-V235 HydrophobicContact CD1-CG2 3.78Å; F127-V235 HydrophobicContact CE1-CB 4.35Å; F127-V235 HydrophobicContact CE1-CG1 4.37Å; F127-V235 HydrophobicContact CE1-CG2 3.68Å; F127-V235 HydrophobicContact CG-CG1 4.31Å; F233-V235 PolarHBondContact O-N 3.37Å; V235-R328 VanDerWaalsContact CG1-NH2 3.32Å; V235-E330 HydrophobicContact CG1-CB 4.31Å; V235-E330 HydrophobicContact CG1-CG 3.97Å; V235-E330 HydrophobicContact CG2-CB 4.22Å; V235-E330 HydrophobicContact CG2-CG 4.26Å
236	F	84.8	Confident	74.9	Confident	54 Å²	54	81.7 Å²	81.7	24%	0.237	42%	0.42	C	S	.	.	P	Polyproline II helix	trans	-61	128.7	171.2	-73.6	-81.5	0	0	0	110	P224 Y225 S238 M240 L241 R328	P224-F236 WeakPolarHBondContact O-CZ 3.31Å; Y225-F236 HydrophobicContact CD1-CD1 4.33Å; Y225-F236 HydrophobicContact CD1-CD2 4.25Å; Y225-F236 HydrophobicContact CD1-CE1 4.38Å; Y225-F236 HydrophobicContact CD1-CE2 4.31Å; Y225-F236 HydrophobicContact CD1-CG 4.26Å; Y225-F236 HydrophobicContact CD1-CZ 4.37Å; F236-S238 PolarHBondContact O-N 2.87Å; F236-M240 HydrophobicContact CD1-CE 4.39Å; F236-L241 HydrophobicContact CB-CD2 4.06Å; F236-R328 PolarHBondContact O-NH2 2.75Å
237	P	87.3	Confident	75.7	Confident	36 Å²	36	81.2 Å²	81.2	23%	0.234	42%	0.416	C	S	.	.	P	Polyproline II helix	trans	-53.6	139.4	168.5	-23	32.1	0	0	0	110	Y239 M240	P237-Y239 HydrophobicContact CB-CD1 3.69Å; P237-Y239 HydrophobicContact CB-CE1 3.25Å; P237-Y239 HydrophobicContact CB-CE2 4.25Å; P237-Y239 HydrophobicContact CB-CG 4.34Å; P237-Y239 HydrophobicContact CG-CE1 4.05Å; P237-Y239 PolarHBondContact O-N 2.97Å; P237-Y239 VanDerWaalsContact O-N 3.07Å; P237-M240 HydrophobicContact CB-CG 4.34Å; P237-M240 HydrophobicContact CG-CG 4.43Å; P237-M240 HydrophobicContact CG-SD 3.99Å; P237-M240 WeakPolarHBondContact O-CB 3.41Å; P237-M240 PolarHBondContact O-N 3.45Å
238	S	88.2	Confident	77	Confident	3 Å²	3	76.9 Å²	76.9	2%	0.021	40%	0.398	C	S	.	.	G	3₁₀ helix	trans	-61.1	-26.3	-172.6	141.5	0	0	0	0	112.8	F236 M240 L241 Y285 T289 H290	F236-S238 PolarHBondContact O-N 2.87Å; S238-M240 PolarHBondContact O-N 3.34Å; S238-L241 WeakPolarHBondContact O-CB 3.38Å; S238-L241 PolarHBondContact O-N 3.4Å; S238-L241 VanDerWaalsContact O-N 3.13Å; S238-Y285 VanDerWaalsContact CB-CE2 3.41Å; S238-Y285 WeakPolarHBondContact OG-CD2 3.35Å; S238-Y285 WeakPolarHBondContact OG-CE2 3.33Å; S238-T289 PolarHBondContact OG-O 3.32Å; S238-H290 PolarHBondContact OG-ND1 3.32Å
239	Y	87.7	Confident	79.3	Confident	160 Å²	160	72.5 Å²	72.5	63%	0.627	37%	0.369	S	S	*	.	G	3₁₀ helix	trans	-70.6	-14.2	177.7	65.3	-103.9	0	0	0	112.9	P237 Y285	P237-Y239 HydrophobicContact CB-CD1 3.69Å; P237-Y239 HydrophobicContact CB-CE1 3.25Å; P237-Y239 HydrophobicContact CB-CE2 4.25Å; P237-Y239 HydrophobicContact CB-CG 4.34Å; P237-Y239 HydrophobicContact CG-CE1 4.05Å; P237-Y239 PolarHBondContact O-N 2.97Å; P237-Y239 VanDerWaalsContact O-N 3.07Å; Y239-Y285 HydrophobicContact CD1-CE1 4.24Å; Y239-Y285 AromaticContact CD1-CE2 3.92Å; Y239-Y285 HydrophobicContact CD1-CE2 3.92Å; Y239-Y285 AromaticContact CD1-CZ 3.63Å; Y239-Y285 WeakPolarHBondContact CD1-OH 3.33Å; Y239-Y285 HydrophobicContact CG-CE2 4.36Å
240	M	90.5	Very high	81.5	Confident	91 Å²	91	64.8 Å²	64.8	45%	0.448	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-88.9	-13.7	174.8	-62.5	-173.4	63.7	0	0	112.7	Y225 F236 P237 S238	Y225-M240 WeakPolarHBondContact CE1-O 3.26Å; Y225-M240 PolarHBondContact OH-O 3.45Å; F236-M240 HydrophobicContact CD1-CE 4.39Å; P237-M240 HydrophobicContact CB-CG 4.34Å; P237-M240 HydrophobicContact CG-CG 4.43Å; P237-M240 HydrophobicContact CG-SD 3.99Å; P237-M240 WeakPolarHBondContact O-CB 3.41Å; P237-M240 PolarHBondContact O-N 3.45Å; S238-M240 PolarHBondContact O-N 3.34Å
241	L	91.2	Very high	84	Confident	13 Å²	13	64.8 Å²	64.8	7%	0.068	33%	0.326	C	S	.	.	S	Bend	trans	-76.4	160.5	179.8	-60	171.6	0	0	0	111.1	Y225 F236 S238 Q246 V247 H290 R328	Y225-L241 HydrophobicContact CD1-CD2 4.26Å; Y225-L241 HydrophobicContact CE1-CD2 4.32Å; F236-L241 HydrophobicContact CB-CD2 4.06Å; S238-L241 WeakPolarHBondContact O-CB 3.38Å; S238-L241 PolarHBondContact O-N 3.4Å; S238-L241 VanDerWaalsContact O-N 3.13Å; L241-Q246 HydrophobicContact CD1-CG 4.41Å; L241-V247 HydrophobicContact CD2-CG2 4.35Å; L241-H290 WeakPolarHBondContact CB-NE2 3.49Å; L241-H290 HydrophobicContact CD1-CB 4.01Å; L241-R328 VanDerWaalsContact CD1-NH1 3.29Å
242	P	92.3	Very high	86.2	Confident	34 Å²	34	62.2 Å²	62.2	22%	0.221	31%	0.314	C	S	.	.			trans	-53.7	134.4	171.1	-25.5	36.7	0	0	0	110.6	Y225 D244 V247 H290	Y225-P242 HydrophobicContact CE2-CG 3.84Å; P242-D244 WeakPolarHBondContact CB-OD1 3.36Å; P242-D244 PolarHBondContact O-N 3.29Å; P242-V247 HydrophobicContact CG-CG2 4.04Å; P242-H290 PolarHBondContact O-CE1 2.95Å; P242-H290 VanDerWaalsContact O-CE1 3.28Å; P242-H290 PolarHBondContact O-NE2 3.47Å
243	P	91.5	Very high	88.5	Confident	123 Å²	123	57.5 Å²	57.5	80%	0.799	28%	0.284	S	S	*	.	S	Bend	trans	-65	-17.8	-170.6	25.5	-35.3	0	0	0	114.1
244	D	92.6	Very high	90.7	Very high	83 Å²	83	52.2 Å²	52.2	44%	0.444	26%	0.26	S	S	.	.	S	Bend	trans	-86.4	-47.7	-175.4	65.1	-41.8	0	0	0	113.3	P242 K254	P242-D244 WeakPolarHBondContact CB-OD1 3.36Å; P242-D244 PolarHBondContact O-N 3.29Å; D244-K254 WeakPolarHBondContact O-CE 3.41Å
245	K	95.3	Very high	92.2	Very high	22 Å²	22	48.5 Å²	48.5	10%	0.096	25%	0.253	C	S	.	.	S	Bend	trans	-152.4	164.9	-175.2	71.2	-178.1	-174.3	71.6	0	112.5	E217 H249 K254	E217-K245 VanDerWaalsContact CD-NZ 3.31Å; E217-K245 IonicContact OE1-NZ 3.53Å; E217-K245 PolarHBondContact OE1-NZ 2.7Å; E217-K245 IonicContact OE2-NZ 3.64Å; K245-H249 WeakPolarHBondContact CD-O 3.34Å; K245-H249 WeakPolarHBondContact CE-O 3.49Å; K245-H249 PolarHBondContact NZ-O 3.02Å; K245-K254 HydrophobicContact CB-CB 4.06Å; K245-K254 HydrophobicContact CB-CG 3.84Å
246	Q	94.8	Very high	93.1	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.26	C	S	.	.			trans	-69.3	143.8	166.3	-65.2	178.8	63.6	0	0	109.6	L241 C248 H249 H290 M327 R328	L241-Q246 HydrophobicContact CD1-CG 4.41Å; Q246-C248 PolarHBondContact O-N 3.26Å; Q246-H249 HydrophobicContact CB-CB 4.36Å; Q246-H249 PolarHBondContact NE2-CE1 3.31Å; Q246-H249 PolarHBondContact O-N 2.72Å; Q246-H290 HydrophobicContact CG-CB 3.86Å; Q246-H290 WeakPolarHBondContact CG-O 3.43Å; Q246-H290 PolarHBondContact NE2-O 2.75Å; Q246-M327 PolarHBondContact NE2-O 2.84Å; Q246-R328 VanDerWaalsContact OE1-CA 3.28Å
247	V	92.6	Very high	93.7	Very high	20 Å²	20	47.6 Å²	47.6	12%	0.121	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-36.5	-173.4	-172.6	0	0	0	0	111.5	E217 I219 Y225 L241 P242	E217-V247 WeakPolarHBondContact CG-O 3.37Å; E217-V247 VanDerWaalsContact OE1-O 3.13Å; I219-V247 HydrophobicContact CB-CG1 4.48Å; I219-V247 HydrophobicContact CD1-CB 4.35Å; I219-V247 HydrophobicContact CD1-CG1 4.21Å; I219-V247 HydrophobicContact CG1-CG1 4.02Å; I219-V247 HydrophobicContact CG2-CG1 3.87Å; Y225-V247 HydrophobicContact CD1-CG2 4.29Å; Y225-V247 HydrophobicContact CD2-CG1 4.28Å; Y225-V247 HydrophobicContact CD2-CG2 3.46Å; Y225-V247 VanDerWaalsContact CD2-CG2 3.46Å; Y225-V247 HydrophobicContact CE2-CG2 4.01Å; Y225-V247 HydrophobicContact CG-CG2 3.62Å; L241-V247 HydrophobicContact CD2-CG2 4.35Å; P242-V247 HydrophobicContact CG-CG2 4.04Å
248	C	93.7	Very high	94.3	Very high	19 Å²	19	47.8 Å²	47.8	13%	0.128	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-10.4	179	60.1	0	0	0	0	114.5	L216 E217 I219 Q246 Q329	L216-C248 CarbonylContact C-O 3.46Å; L216-C248 WeakPolarHBondContact CA-O 3.34Å; L216-C248 WeakPolarHBondContact CB-O 3.25Å; E217-C248 PolarHBondContact N-O 3.29Å; I219-C248 HydrophobicContact CD1-CB 4.21Å; I219-C248 HydrophobicContact CG1-CB 4.37Å; Q246-C248 PolarHBondContact O-N 3.26Å; C248-Q329 VanDerWaalsContact SG-CB 3.51Å
249	H	96.3	Very high	94.7	Very high	1 Å²	1	54.6 Å²	54.6	1%	0.005	28%	0.276	C	S	.	.	B	Isolated β-bridge	trans	-88.7	136.4	-179.6	-73.5	177.5	0	0	0	110.6	K245 Q246 Q329	K245-H249 WeakPolarHBondContact CD-O 3.34Å; K245-H249 WeakPolarHBondContact CE-O 3.49Å; K245-H249 PolarHBondContact NZ-O 3.02Å; Q246-H249 HydrophobicContact CB-CB 4.36Å; Q246-H249 PolarHBondContact NE2-CE1 3.31Å; Q246-H249 PolarHBondContact O-N 2.72Å; H249-Q329 PolarHBondContact NE2-OE1 3.36Å
250	T	96.7	Very high	95.1	Very high	13 Å²	13	49.5 Å²	49.5	8%	0.08	26%	0.258	C	S	.	.			trans	-66.7	155.1	169	58.8	0	0	0	0	111	R214 L215 E217 E252 T253 K254	R214-T250 WeakPolarHBondContact O-CG2 3.47Å; R214-T250 PolarHBondContact O-OG1 2.81Å; L215-T250 PolarHBondContact O-N 3.24Å; L215-T250 VanDerWaalsContact O-N 3.14Å; L215-T250 PolarHBondContact O-OG1 2.87Å; E217-T250 HydrophobicContact CB-CG2 4.11Å; T250-E252 VanDerWaalsContact C-N 3.27Å; T250-E252 PolarHBondContact O-N 3.15Å; T250-T253 WeakPolarHBondContact O-CB 3.44Å; T250-T253 PolarHBondContact O-N 3.33Å; T250-T253 VanDerWaalsContact OG1-CB 3.32Å; T250-T253 WeakPolarHBondContact OG1-CB 3.26Å; T250-T253 PolarHBondContact OG1-N 3.3Å; T250-T253 PolarHBondContact OG1-OG1 2.91Å; T250-K254 PolarHBondContact O-N 3.41Å; T250-K254 VanDerWaalsContact O-N 3.07Å
251	T	95.8	Very high	95.4	Very high	67 Å²	67	45.2 Å²	45.2	41%	0.411	24%	0.237	S	C	.	.	H	α-helix	trans	-59.4	-41.9	178.2	-59.9	0	0	0	0	111.1	T253 K254 M255	T251-T253 VanDerWaalsContact C-N 3.35Å; T251-T253 PolarHBondContact O-N 3.19Å; T251-K254 PolarHBondContact O-N 2.86Å; T251-M255 HydrophobicContact CG2-CG 4.35Å; T251-M255 HydrophobicContact CG2-SD 4Å; T251-M255 WeakPolarHBondContact O-CB 3.3Å; T251-M255 VanDerWaalsContact O-CG 3.3Å; T251-M255 WeakPolarHBondContact O-CG 3.43Å; T251-M255 PolarHBondContact O-N 3.17Å
252	E	95.3	Very high	95.8	Very high	92 Å²	92	46.1 Å²	46.1	43%	0.43	24%	0.24	S	C	.	.	H	α-helix	trans	-60.6	-45.2	178.7	-62.3	70.1	-154.8	0	0	110.9	F203 T250 M255 L256	F203-E252 HydrophobicContact CE1-CB 3.94Å; F203-E252 HydrophobicContact CZ-CB 4.47Å; T250-E252 VanDerWaalsContact C-N 3.27Å; T250-E252 PolarHBondContact O-N 3.15Å; E252-M255 PolarHBondContact O-N 3.14Å; E252-L256 WeakPolarHBondContact O-CB 3.27Å; E252-L256 WeakPolarHBondContact O-CG 3.49Å; E252-L256 PolarHBondContact O-N 3.25Å
253	T	97.3	Very high	96	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-58.5	-50.9	176.6	-65.3	0	0	0	0	111.4	L202 F203 L215 T250 T251 M255 L256 L257 V341	L202-T253 HydrophobicContact CD2-CG2 3.88Å; F203-T253 WeakPolarHBondContact CZ-OG1 3.37Å; L215-T253 VanDerWaalsContact CA-OG1 3.28Å; L215-T253 WeakPolarHBondContact CA-OG1 3.46Å; L215-T253 HydrophobicContact CD2-CG2 4.29Å; L215-T253 PolarHBondContact O-OG1 2.77Å; L215-T253 VanDerWaalsContact O-OG1 3.05Å; T250-T253 WeakPolarHBondContact O-CB 3.44Å; T250-T253 PolarHBondContact O-N 3.33Å; T250-T253 VanDerWaalsContact OG1-CB 3.32Å; T250-T253 WeakPolarHBondContact OG1-CB 3.26Å; T250-T253 PolarHBondContact OG1-N 3.3Å; T250-T253 PolarHBondContact OG1-OG1 2.91Å; T251-T253 VanDerWaalsContact C-N 3.35Å; T251-T253 PolarHBondContact O-N 3.19Å; T253-M255 VanDerWaalsContact C-N 3.32Å; T253-M255 PolarHBondContact O-N 3.05Å; T253-L256 PolarHBondContact O-N 2.7Å; T253-L257 HydrophobicContact CG2-CD1 3.8Å; T253-L257 HydrophobicContact CG2-CG 4.44Å; T253-L257 WeakPolarHBondContact O-CB 3.43Å; T253-L257 WeakPolarHBondContact O-CG 3.46Å; T253-L257 PolarHBondContact O-N 3.31Å; T253-V341 HydrophobicContact CG2-CB 4.19Å; T253-V341 HydrophobicContact CG2-CG1 3.97Å; T253-V341 HydrophobicContact CG2-CG2 3.88Å
254	K	97.6	Very high	96.3	Very high	38 Å²	38	40.4 Å²	40.4	17%	0.165	20%	0.203	C	C	.	.	H	α-helix	trans	-58.6	-46.1	178.6	179.2	-92.9	174.7	172.9	0	111.2	D244 K245 T250 T251 E258 I326	D244-K254 WeakPolarHBondContact O-CE 3.41Å; K245-K254 HydrophobicContact CB-CB 4.06Å; K245-K254 HydrophobicContact CB-CG 3.84Å; T250-K254 PolarHBondContact O-N 3.41Å; T250-K254 VanDerWaalsContact O-N 3.07Å; T251-K254 PolarHBondContact O-N 2.86Å; K254-E258 WeakPolarHBondContact CE-OE2 3.22Å; K254-E258 IonicContact NZ-OE2 3.98Å; K254-E258 PolarHBondContact NZ-OE2 3.29Å; K254-E258 VanDerWaalsContact O-CB 3.3Å; K254-E258 WeakPolarHBondContact O-CB 3.3Å; K254-E258 PolarHBondContact O-N 2.9Å; K254-I326 HydrophobicContact CB-CD1 4.36Å; K254-I326 HydrophobicContact CG-CD1 3.81Å
255	M	97.2	Very high	96.5	Very high	119 Å²	119	36.5 Å²	36.5	59%	0.586	18%	0.182	S	C	*	.	H	α-helix	trans	-64.7	-42.8	-177.6	-73.4	-176.5	72.9	0	0	112.3	T251 E252 T253 F259	T251-M255 HydrophobicContact CG2-CG 4.35Å; T251-M255 HydrophobicContact CG2-SD 4Å; T251-M255 WeakPolarHBondContact O-CB 3.3Å; T251-M255 VanDerWaalsContact O-CG 3.3Å; T251-M255 WeakPolarHBondContact O-CG 3.43Å; T251-M255 PolarHBondContact O-N 3.17Å; E252-M255 PolarHBondContact O-N 3.14Å; T253-M255 VanDerWaalsContact C-N 3.32Å; T253-M255 PolarHBondContact O-N 3.05Å; M255-F259 VanDerWaalsContact O-CB 3.26Å; M255-F259 WeakPolarHBondContact O-CB 3.28Å; M255-F259 PolarHBondContact O-N 3.42Å
256	L	96.8	Very high	96.7	Very high	65 Å²	65	39.8 Å²	39.8	34%	0.34	20%	0.196	S	C	.	.	H	α-helix	trans	-68.5	-43.6	179.3	-70.6	173.5	0	0	0	111.9	L202 F203 E252 T253 F259 E260	L202-L256 HydrophobicContact CD1-CB 3.81Å; L202-L256 HydrophobicContact CD2-CB 4.37Å; L202-L256 HydrophobicContact CG-CB 3.99Å; L202-L256 HydrophobicContact CG-CD1 4.06Å; F203-L256 HydrophobicContact CD1-CD1 3.42Å; F203-L256 VanDerWaalsContact CD1-CD1 3.42Å; F203-L256 HydrophobicContact CE1-CD1 3.54Å; E252-L256 WeakPolarHBondContact O-CB 3.27Å; E252-L256 WeakPolarHBondContact O-CG 3.49Å; E252-L256 PolarHBondContact O-N 3.25Å; T253-L256 PolarHBondContact O-N 2.7Å; L256-F259 PolarHBondContact O-N 3.39Å; L256-E260 WeakPolarHBondContact O-CB 3.4Å; L256-E260 PolarHBondContact O-N 2.95Å
257	L	97.9	Very high	96.8	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-62.9	-45.5	176.1	-71.7	172.7	0	0	0	111.9	F197 L202 T253 E260 L261 I326 V341 Y343	F197-L257 HydrophobicContact CD2-CD2 3.56Å; F197-L257 HydrophobicContact CE2-CD2 3.8Å; F197-L257 HydrophobicContact CG-CD2 4.45Å; L202-L257 HydrophobicContact CD1-CD2 3.88Å; L202-L257 HydrophobicContact CD1-CG 4.17Å; L202-L257 HydrophobicContact CD2-CD2 4.49Å; L202-L257 HydrophobicContact CD2-CG 4.23Å; T253-L257 HydrophobicContact CG2-CD1 3.8Å; T253-L257 HydrophobicContact CG2-CG 4.44Å; T253-L257 WeakPolarHBondContact O-CB 3.43Å; T253-L257 WeakPolarHBondContact O-CG 3.46Å; T253-L257 PolarHBondContact O-N 3.31Å; L257-E260 PolarHBondContact O-N 2.91Å; L257-L261 VanDerWaalsContact O-CB 3.23Å; L257-L261 WeakPolarHBondContact O-CB 3.49Å; L257-L261 PolarHBondContact O-N 2.87Å; L257-I326 HydrophobicContact CB-CD1 3.84Å; L257-I326 HydrophobicContact CB-CG1 3.95Å; L257-I326 HydrophobicContact CD1-CD1 4.42Å; L257-I326 HydrophobicContact CD1-CG1 4.42Å; L257-I326 HydrophobicContact CD1-CG2 3.9Å; L257-V341 HydrophobicContact CD1-CB 3.88Å; L257-V341 HydrophobicContact CD1-CG2 3.8Å; L257-V341 HydrophobicContact CD2-CG2 4.22Å; L257-V341 HydrophobicContact CG-CG2 4.37Å; L257-Y343 HydrophobicContact CD2-CD1 4.23Å
258	E	98.4	Very high	97	Very high	41 Å²	41	42 Å²	42	19%	0.192	21%	0.205	C	C	.	.	H	α-helix	trans	-60.4	-47.3	176.4	177.3	177.4	-178.4	0	0	111	K254 E260 K262 W293	K254-E258 WeakPolarHBondContact CE-OE2 3.22Å; K254-E258 IonicContact NZ-OE2 3.98Å; K254-E258 PolarHBondContact NZ-OE2 3.29Å; K254-E258 VanDerWaalsContact O-CB 3.3Å; K254-E258 WeakPolarHBondContact O-CB 3.3Å; K254-E258 PolarHBondContact O-N 2.9Å; E258-E260 PolarHBondContact O-N 2.98Å; E258-K262 HydrophobicContact CG-CD 3.82Å; E258-K262 HydrophobicContact CG-CG 4.27Å; E258-K262 VanDerWaalsContact O-CB 3.31Å; E258-K262 WeakPolarHBondContact O-CB 3.44Å; E258-K262 WeakPolarHBondContact O-CG 3.26Å; E258-K262 PolarHBondContact O-N 2.76Å; E258-K262 WeakPolarHBondContact OE1-CE 3.46Å; E258-K262 IonicContact OE1-NZ 3.72Å; E258-K262 PolarHBondContact OE1-NZ 3.33Å; E258-W293 HydrophobicContact CB-CH2 3.86Å; E258-W293 HydrophobicContact CB-CZ2 4.48Å; E258-W293 VanDerWaalsContact CD-CZ2 3.45Å; E258-W293 HydrophobicContact CG-CH2 3.58Å; E258-W293 HydrophobicContact CG-CZ2 3.82Å; E258-W293 HydrophobicContact CG-CZ3 4.31Å
259	F	97.5	Very high	97.2	Very high	146 Å²	146	41 Å²	41	64%	0.64	20%	0.199	S	C	*	.	H	α-helix	trans	-59.6	-46.9	179.5	178	-96.5	0	0	0	111.3	M255 L256 T263	M255-F259 VanDerWaalsContact O-CB 3.26Å; M255-F259 WeakPolarHBondContact O-CB 3.28Å; M255-F259 PolarHBondContact O-N 3.42Å; L256-F259 PolarHBondContact O-N 3.39Å; F259-T263 WeakPolarHBondContact O-CB 3.44Å; F259-T263 PolarHBondContact O-N 3.05Å; F259-T263 PolarHBondContact O-OG1 3.13Å
260	E	95.7	Very high	97.2	Very high	53 Å²	53	45.2 Å²	45.2	25%	0.248	22%	0.217	C	C	.	.	H	α-helix	trans	-64.9	-50.7	-180	-171	178.2	157.7	0	0	111.8	F197 L256 L257 E258 K262 T263 V264 Y343	F197-E260 WeakPolarHBondContact CE1-OE1 3.37Å; F197-E260 WeakPolarHBondContact CE1-OE2 3.21Å; F197-E260 WeakPolarHBondContact CZ-OE1 3.39Å; F197-E260 WeakPolarHBondContact CZ-OE2 3.45Å; L256-E260 WeakPolarHBondContact O-CB 3.4Å; L256-E260 PolarHBondContact O-N 2.95Å; L257-E260 PolarHBondContact O-N 2.91Å; E258-E260 PolarHBondContact O-N 2.98Å; E260-K262 PolarHBondContact O-N 2.52Å; E260-T263 PolarHBondContact O-N 3.36Å; E260-V264 HydrophobicContact CG-CG2 4.3Å; E260-V264 VanDerWaalsContact O-CG2 3.25Å; E260-V264 WeakPolarHBondContact O-CG2 3.31Å; E260-V264 PolarHBondContact O-N 3.08Å; E260-Y343 HydrophobicContact CB-CE1 4.14Å; E260-Y343 HydrophobicContact CG-CE1 3.92Å; E260-Y343 PolarHBondContact OE1-OH 2.72Å; E260-Y343 VanDerWaalsContact OE1-OH 3.11Å
261	L	98	Very high	97.2	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-55.3	-53.9	179.2	173.2	62.3	0	0	0	111	L257 T263 V264 L265 W293 C324 Y343 F345	L257-L261 VanDerWaalsContact O-CB 3.23Å; L257-L261 WeakPolarHBondContact O-CB 3.49Å; L257-L261 PolarHBondContact O-N 2.87Å; L261-T263 VanDerWaalsContact C-N 3.26Å; L261-T263 PolarHBondContact O-N 3.17Å; L261-V264 PolarHBondContact O-N 2.65Å; L261-L265 HydrophobicContact CD1-CD1 3.56Å; L261-L265 HydrophobicContact CD1-CG 4.07Å; L261-L265 HydrophobicContact CG-CD1 4.03Å; L261-L265 WeakPolarHBondContact O-CG 3.33Å; L261-L265 PolarHBondContact O-N 3.4Å; L261-W293 HydrophobicContact CD2-CE3 4.2Å; L261-W293 HydrophobicContact CD2-CZ3 4.03Å; L261-C324 HydrophobicContact CD1-CB 4.19Å; L261-C324 HydrophobicContact CD2-CB 4.08Å; L261-C324 HydrophobicContact CG-CB 4.5Å; L261-Y343 HydrophobicContact CB-CD1 3.92Å; L261-Y343 HydrophobicContact CB-CD2 4.3Å; L261-Y343 HydrophobicContact CB-CE1 4.39Å; L261-Y343 HydrophobicContact CB-CG 3.88Å; L261-Y343 HydrophobicContact CD1-CD2 3.5Å; L261-Y343 HydrophobicContact CD1-CE2 4.05Å; L261-Y343 HydrophobicContact CD1-CG 3.83Å; L261-Y343 HydrophobicContact CG-CD2 4.41Å; L261-Y343 HydrophobicContact CG-CG 4.27Å; L261-F345 HydrophobicContact CD1-CD1 4.24Å
262	K	98.5	Very high	97.2	Very high	32 Å²	32	44.6 Å²	44.6	14%	0.139	22%	0.215	C	C	.	.	H	α-helix	trans	-64.3	-34.1	-178.3	-70.2	-172.1	169.6	172.8	0	111.6	E258 E260 K266 W281	E258-K262 HydrophobicContact CG-CD 3.82Å; E258-K262 HydrophobicContact CG-CG 4.27Å; E258-K262 VanDerWaalsContact O-CB 3.31Å; E258-K262 WeakPolarHBondContact O-CB 3.44Å; E258-K262 WeakPolarHBondContact O-CG 3.26Å; E258-K262 PolarHBondContact O-N 2.76Å; E258-K262 WeakPolarHBondContact OE1-CE 3.46Å; E258-K262 IonicContact OE1-NZ 3.72Å; E258-K262 PolarHBondContact OE1-NZ 3.33Å; E260-K262 PolarHBondContact O-N 2.52Å; K262-K266 VanDerWaalsContact O-CB 3.31Å; K262-K266 WeakPolarHBondContact O-CB 3.24Å; K262-K266 WeakPolarHBondContact O-CD 3.26Å; K262-K266 WeakPolarHBondContact O-CG 3.13Å; K262-K266 PolarHBondContact O-N 3.12Å; K262-W281 HydrophobicContact CB-CH2 4.25Å; K262-W281 HydrophobicContact CB-CZ2 3.53Å; K262-W281 HydrophobicContact CD-CD2 4.07Å; K262-W281 HydrophobicContact CD-CG 4.27Å; K262-W281 HydrophobicContact CD-CZ2 4.17Å; K262-W281 HydrophobicContact CG-CD2 4.2Å; K262-W281 HydrophobicContact CG-CH2 3.93Å; K262-W281 HydrophobicContact CG-CZ2 3.5Å; K262-W281 VanDerWaalsContact CG-CZ2 3.5Å; K262-W281 HydrophobicContact CG-CZ3 4.44Å
263	T	97.3	Very high	97.1	Very high	35 Å²	35	42.1 Å²	42.1	22%	0.215	20%	0.203	C	C	.	.	H	α-helix	trans	-66.7	-49.9	176.3	-62.5	0	0	0	0	111.3	F259 E260 L261 L265 K266 E267	F259-T263 WeakPolarHBondContact O-CB 3.44Å; F259-T263 PolarHBondContact O-N 3.05Å; F259-T263 PolarHBondContact O-OG1 3.13Å; E260-T263 PolarHBondContact O-N 3.36Å; L261-T263 VanDerWaalsContact C-N 3.26Å; L261-T263 PolarHBondContact O-N 3.17Å; T263-L265 VanDerWaalsContact C-N 3.33Å; T263-L265 PolarHBondContact O-N 3.14Å; T263-K266 PolarHBondContact O-N 3.35Å; T263-E267 HydrophobicContact CG2-CG 4.5Å; T263-E267 WeakPolarHBondContact CG2-OE1 3.46Å; T263-E267 WeakPolarHBondContact O-CB 3.32Å; T263-E267 WeakPolarHBondContact O-CG 3.49Å; T263-E267 PolarHBondContact O-N 2.67Å
264	V	96.4	Very high	97	Very high	3 Å²	3	43.2 Å²	43.2	2%	0.018	22%	0.215	C	C	.	.	H	α-helix	trans	-55.4	-49.5	178.3	171.4	0	0	0	0	110.6	F87 M88 R91 E260 L261 E267 M268	F87-V264 HydrophobicContact CE1-CG1 4.29Å; M88-V264 HydrophobicContact CE-CG1 4.25Å; M88-V264 HydrophobicContact SD-CG1 3.94Å; R91-V264 VanDerWaalsContact NE-CG2 3.29Å; E260-V264 HydrophobicContact CG-CG2 4.3Å; E260-V264 VanDerWaalsContact O-CG2 3.25Å; E260-V264 WeakPolarHBondContact O-CG2 3.31Å; E260-V264 PolarHBondContact O-N 3.08Å; L261-V264 PolarHBondContact O-N 2.65Å; V264-E267 PolarHBondContact O-N 2.99Å; V264-M268 WeakPolarHBondContact O-CB 3.45Å; V264-M268 PolarHBondContact O-N 3.2Å
265	L	98.3	Very high	96.9	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-70.6	-38.4	-175.2	-66.3	178	0	0	0	113.1	L261 T263 M268 A269 W281 L295 L322 C324 F345	L261-L265 HydrophobicContact CD1-CD1 3.56Å; L261-L265 HydrophobicContact CD1-CG 4.07Å; L261-L265 HydrophobicContact CG-CD1 4.03Å; L261-L265 WeakPolarHBondContact O-CG 3.33Å; L261-L265 PolarHBondContact O-N 3.4Å; T263-L265 VanDerWaalsContact C-N 3.33Å; T263-L265 PolarHBondContact O-N 3.14Å; L265-M268 HydrophobicContact CD2-CE 3.59Å; L265-M268 PolarHBondContact O-N 3.47Å; L265-A269 WeakPolarHBondContact O-CB 3.5Å; L265-A269 PolarHBondContact O-N 2.94Å; L265-W281 HydrophobicContact CB-CH2 3.89Å; L265-W281 HydrophobicContact CD1-CH2 3.87Å; L265-W281 HydrophobicContact CD1-CZ3 4.35Å; L265-L295 HydrophobicContact CB-CD2 4.34Å; L265-L322 HydrophobicContact CD1-CD1 3.69Å; L265-L322 HydrophobicContact CD1-CD2 4.38Å; L265-L322 HydrophobicContact CD2-CD2 4.03Å; L265-C324 HydrophobicContact CD1-CB 3.81Å; L265-F345 HydrophobicContact CD1-CB 4.16Å; L265-F345 HydrophobicContact CD2-CB 4.11Å; L265-F345 HydrophobicContact CD2-CD1 3.85Å; L265-F345 HydrophobicContact CD2-CD2 3.93Å; L265-F345 HydrophobicContact CD2-CE1 4.18Å; L265-F345 HydrophobicContact CD2-CE2 4.27Å; L265-F345 HydrophobicContact CD2-CG 3.7Å; L265-F345 HydrophobicContact CD2-CZ 4.37Å
266	K	98	Very high	96.8	Very high	92 Å²	92	47.2 Å²	47.2	40%	0.4	25%	0.245	S	C	.	.	H	α-helix	trans	-64.6	-43.6	173.9	-75.4	172.8	67.2	178.5	0	111.7	K262 T263 M268 A269 K270 L279 W281	K262-K266 VanDerWaalsContact O-CB 3.31Å; K262-K266 WeakPolarHBondContact O-CB 3.24Å; K262-K266 WeakPolarHBondContact O-CD 3.26Å; K262-K266 WeakPolarHBondContact O-CG 3.13Å; K262-K266 PolarHBondContact O-N 3.12Å; T263-K266 PolarHBondContact O-N 3.35Å; K266-M268 VanDerWaalsContact C-N 3.32Å; K266-A269 PolarHBondContact O-N 3.43Å; K266-K270 WeakPolarHBondContact O-CB 3.47Å; K266-K270 WeakPolarHBondContact O-CG 3.26Å; K266-K270 PolarHBondContact O-N 2.87Å; K266-L279 HydrophobicContact CB-CD1 4.2Å; K266-L279 HydrophobicContact CG-CD1 4.08Å; K266-W281 HydrophobicContact CD-CZ2 4.3Å; K266-W281 HydrophobicContact CG-CZ2 3.91Å
267	E	97.2	Very high	96.7	Very high	65 Å²	65	45.5 Å²	45.5	30%	0.304	24%	0.236	S	C	.	.	H	α-helix	trans	-63.4	-40.6	175.9	-76.4	-178.1	-154	0	0	111.6	F87 R91 T263 V264 K270 S271	F87-E267 HydrophobicContact CE2-CB 3.88Å; F87-E267 HydrophobicContact CZ-CB 3.69Å; R91-E267 IonicContact CZ-OE1 3.89Å; R91-E267 IonicContact CZ-OE2 2.62Å; R91-E267 IonicContact NE-OE2 3.14Å; R91-E267 IonicContact NH1-OE1 3.93Å; R91-E267 PolarHBondContact NH1-OE1 3.34Å; R91-E267 IonicContact NH1-OE2 2.85Å; R91-E267 PolarHBondContact NH1-OE2 3.33Å; T263-E267 HydrophobicContact CG2-CG 4.5Å; T263-E267 WeakPolarHBondContact CG2-OE1 3.46Å; T263-E267 WeakPolarHBondContact O-CB 3.32Å; T263-E267 WeakPolarHBondContact O-CG 3.49Å; T263-E267 PolarHBondContact O-N 2.67Å; V264-E267 PolarHBondContact O-N 2.99Å; E267-K270 PolarHBondContact O-N 3.06Å; E267-S271 VanDerWaalsContact O-CB 3.23Å; E267-S271 WeakPolarHBondContact O-CB 3.19Å; E267-S271 PolarHBondContact O-N 2.86Å
268	M	97.6	Very high	96.7	Very high	0 Å²	0	50 Å²	50	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-60.5	-51	175.9	-172.5	171.3	66.8	0	0	111	I84 F87 V264 L265 K266 K270 S271 L272 L322 F345 L347 W352	I84-M268 HydrophobicContact CB-SD 4.49Å; I84-M268 HydrophobicContact CG1-SD 4.25Å; I84-M268 HydrophobicContact CG2-SD 3.68Å; F87-M268 HydrophobicContact CD1-CB 3.78Å; F87-M268 HydrophobicContact CD1-CG 3.74Å; F87-M268 HydrophobicContact CD1-SD 4.23Å; F87-M268 HydrophobicContact CE1-CB 3.47Å; F87-M268 VanDerWaalsContact CE1-CB 3.47Å; F87-M268 HydrophobicContact CE1-CG 3.97Å; F87-M268 HydrophobicContact CE1-SD 4.48Å; F87-M268 HydrophobicContact CE2-CB 4.42Å; F87-M268 HydrophobicContact CG-CB 4.41Å; F87-M268 HydrophobicContact CG-CG 4.28Å; F87-M268 HydrophobicContact CZ-CB 3.83Å; F87-M268 VanDerWaalsContact CZ-N 3.29Å; V264-M268 WeakPolarHBondContact O-CB 3.45Å; V264-M268 PolarHBondContact O-N 3.2Å; L265-M268 HydrophobicContact CD2-CE 3.59Å; L265-M268 PolarHBondContact O-N 3.47Å; K266-M268 VanDerWaalsContact C-N 3.32Å; M268-K270 PolarHBondContact O-N 3.36Å; M268-S271 WeakPolarHBondContact O-CB 3.3Å; M268-S271 PolarHBondContact O-N 3.05Å; M268-S271 VanDerWaalsContact O-N 3.17Å; M268-L272 HydrophobicContact CG-CD1 4.38Å; M268-L272 VanDerWaalsContact O-CD1 3.29Å; M268-L272 WeakPolarHBondContact O-CD1 3.4Å; M268-L272 PolarHBondContact O-N 3.11Å; M268-L272 VanDerWaalsContact O-N 3.13Å; M268-L322 HydrophobicContact CE-CD2 4.44Å; M268-F345 HydrophobicContact CE-CE2 4.41Å; M268-L347 HydrophobicContact CE-CD2 3.63Å; M268-L347 HydrophobicContact SD-CD2 4.41Å; M268-W352 HydrophobicContact CE-CH2 3.85Å; M268-W352 HydrophobicContact CE-CZ2 3.93Å; M268-W352 HydrophobicContact CG-CH2 4.11Å
269	A	97.4	Very high	96.6	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-58.9	-46.8	178.2	0	0	0	0	0	111.6	L265 K266 S271 L272 F273 L279 L295 I321 W352	L265-A269 WeakPolarHBondContact O-CB 3.5Å; L265-A269 PolarHBondContact O-N 2.94Å; K266-A269 PolarHBondContact O-N 3.43Å; A269-S271 VanDerWaalsContact C-N 3.31Å; A269-S271 PolarHBondContact O-N 3.3Å; A269-L272 PolarHBondContact O-N 3.49Å; A269-F273 WeakPolarHBondContact O-CB 3.2Å; A269-F273 WeakPolarHBondContact O-CD2 3.25Å; A269-F273 PolarHBondContact O-N 2.8Å; A269-L279 HydrophobicContact CB-CD1 4.42Å; A269-L279 HydrophobicContact CB-CD2 3.82Å; A269-L295 HydrophobicContact CB-CD2 4.25Å; A269-I321 HydrophobicContact CB-CD1 4.44Å; A269-W352 HydrophobicContact CB-CH2 4.19Å
270	K	96.9	Very high	96.7	Very high	88 Å²	88	48 Å²	48	38%	0.383	25%	0.246	S	C	.	.	H	α-helix	trans	-64.3	-33.9	176.5	-74.1	-179.8	174.8	-115.2	0	113.2	K266 E267 M268 L272 G274 P275 I277 L279	K266-K270 WeakPolarHBondContact O-CB 3.47Å; K266-K270 WeakPolarHBondContact O-CG 3.26Å; K266-K270 PolarHBondContact O-N 2.87Å; E267-K270 PolarHBondContact O-N 3.06Å; M268-K270 PolarHBondContact O-N 3.36Å; K270-L272 VanDerWaalsContact C-N 3.28Å; K270-L272 PolarHBondContact O-N 3.19Å; K270-G274 WeakPolarHBondContact CA-O 3.47Å; K270-G274 CarbonylContact O-C 3.54Å; K270-G274 WeakPolarHBondContact O-CA 3.22Å; K270-G274 PolarHBondContact O-N 3.02Å; K270-P275 PolarHBondContact NZ-O 2.92Å; K270-I277 HydrophobicContact CG-CG2 3.91Å; K270-L279 HydrophobicContact CG-CD1 4.16Å
271	S	95.5	Very high	96.8	Very high	59 Å²	59	48.8 Å²	48.8	41%	0.413	25%	0.247	S	C	.	.	H	α-helix	trans	-67.9	-28.7	177	-173.7	0	0	0	0	112.5	E267 M268 A269	E267-S271 VanDerWaalsContact O-CB 3.23Å; E267-S271 WeakPolarHBondContact O-CB 3.19Å; E267-S271 PolarHBondContact O-N 2.86Å; M268-S271 WeakPolarHBondContact O-CB 3.3Å; M268-S271 PolarHBondContact O-N 3.05Å; M268-S271 VanDerWaalsContact O-N 3.17Å; A269-S271 VanDerWaalsContact C-N 3.31Å; A269-S271 PolarHBondContact O-N 3.3Å
272	L	95.6	Very high	96.8	Very high	9 Å²	9	50.9 Å²	50.9	5%	0.047	26%	0.26	C	S	.	.	H	α-helix	trans	-94	-49.1	-179.6	-85.4	75.4	0	0	0	111.9	I80 R83 I84 M268 A269 K270 W352 L356	I80-L272 HydrophobicContact CD1-CD2 4.44Å; I80-L272 HydrophobicContact CG2-CD2 4.48Å; R83-L272 HydrophobicContact CB-CD2 4.29Å; R83-L272 HydrophobicContact CB-CG 4.42Å; R83-L272 PolarHBondContact NH2-O 2.7Å; I84-L272 HydrophobicContact CG1-CD2 3.94Å; M268-L272 HydrophobicContact CG-CD1 4.38Å; M268-L272 VanDerWaalsContact O-CD1 3.29Å; M268-L272 WeakPolarHBondContact O-CD1 3.4Å; M268-L272 PolarHBondContact O-N 3.11Å; M268-L272 VanDerWaalsContact O-N 3.13Å; A269-L272 PolarHBondContact O-N 3.49Å; K270-L272 VanDerWaalsContact C-N 3.28Å; K270-L272 PolarHBondContact O-N 3.19Å; L272-W352 HydrophobicContact CB-CE3 4.37Å; L272-W352 HydrophobicContact CB-CZ3 3.96Å; L272-W352 HydrophobicContact CD1-CZ3 4.49Å; L272-W352 HydrophobicContact CD2-CE3 3.64Å; L272-W352 HydrophobicContact CD2-CZ3 3.67Å; L272-W352 HydrophobicContact CG-CZ3 4.23Å; L272-L356 HydrophobicContact CB-CD2 4.46Å; L272-L356 WeakPolarHBondContact O-CD1 3.38Å
273	F	94.6	Very high	96.7	Very high	39 Å²	39	56 Å²	56	17%	0.171	29%	0.288	C	S	.	.	H	α-helix	trans	-89.9	-10.7	-175.1	-65.7	-73.8	0	0	0	114.6	A269 I277 I297 W352 R355 L356	A269-F273 WeakPolarHBondContact O-CB 3.2Å; A269-F273 WeakPolarHBondContact O-CD2 3.25Å; A269-F273 PolarHBondContact O-N 2.8Å; F273-I277 HydrophobicContact CB-CB 3.96Å; F273-I277 HydrophobicContact CB-CD1 4.2Å; F273-I277 HydrophobicContact CB-CG1 3.86Å; F273-I277 HydrophobicContact CB-CG2 4.18Å; F273-I277 HydrophobicContact CG-CG1 4.45Å; F273-I297 HydrophobicContact CD1-CD1 4.29Å; F273-I297 HydrophobicContact CD2-CD1 4.28Å; F273-I297 HydrophobicContact CE1-CD1 3.88Å; F273-I297 HydrophobicContact CE2-CD1 3.87Å; F273-I297 HydrophobicContact CG-CD1 4.48Å; F273-I297 HydrophobicContact CZ-CD1 3.66Å; F273-W352 HydrophobicContact CD2-CE3 4.39Å; F273-W352 HydrophobicContact CD2-CZ3 4.19Å; F273-W352 AromaticContact CE2-CD2 3.99Å; F273-W352 HydrophobicContact CE2-CD2 3.99Å; F273-W352 AromaticContact CE2-CE3 3.44Å; F273-W352 HydrophobicContact CE2-CE3 3.44Å; F273-W352 VanDerWaalsContact CE2-CE3 3.44Å; F273-W352 HydrophobicContact CE2-CH2 4.28Å; F273-W352 AromaticContact CE2-CZ3 3.61Å; F273-W352 HydrophobicContact CE2-CZ3 3.61Å; F273-W352 HydrophobicContact CZ-CD2 4.25Å; F273-W352 AromaticContact CZ-CE3 3.91Å; F273-W352 HydrophobicContact CZ-CE3 3.91Å; F273-W352 HydrophobicContact CZ-CZ3 4.5Å; F273-R355 HydrophobicContact CE1-CB 3.71Å; F273-R355 HydrophobicContact CZ-CB 4.1Å; F273-L356 HydrophobicContact CD1-CB 4.35Å; F273-L356 HydrophobicContact CD1-CD1 3.82Å; F273-L356 HydrophobicContact CE1-CB 3.79Å; F273-L356 HydrophobicContact CE1-CD1 4.12Å; F273-L356 HydrophobicContact CG-CD1 4.49Å; F273-L356 HydrophobicContact CZ-CB 4.45Å
274	G	94.2	Very high	96.6	Very high	24 Å²	24	55.6 Å²	55.6	25%	0.247	29%	0.289	C	S	.	.			trans	104	160.5	-177.2	0	0	0	0	0	113.4	K270 D276 I277	K270-G274 WeakPolarHBondContact CA-O 3.47Å; K270-G274 CarbonylContact O-C 3.54Å; K270-G274 WeakPolarHBondContact O-CA 3.22Å; K270-G274 PolarHBondContact O-N 3.02Å; G274-D276 VanDerWaalsContact C-N 3.26Å; G274-D276 PolarHBondContact O-N 2.71Å; G274-I277 VanDerWaalsContact O-CG2 3.27Å; G274-I277 WeakPolarHBondContact O-CG2 3.48Å; G274-I277 PolarHBondContact O-N 2.94Å
275	P	95.4	Very high	96.5	Very high	90 Å²	90	59.2 Å²	59.2	58%	0.584	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-26.6	-171.2	26.7	-35.1	0	0	0	114	K270	K270-P275 PolarHBondContact NZ-O 2.92Å
276	D	95.3	Very high	96.4	Very high	150 Å²	150	61.5 Å²	61.5	80%	0.802	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.2	-1.3	-173.8	-55.5	-45.3	0	0	0	113.4	G274 Q278	G274-D276 VanDerWaalsContact C-N 3.26Å; G274-D276 PolarHBondContact O-N 2.71Å; D276-Q278 PolarHBondContact O-N 2.73Å
277	I	95.4	Very high	96.3	Very high	29 Å²	29	57.5 Å²	57.5	15%	0.149	30%	0.296	C	S	.	.			trans	-58	127.6	177.7	-166.6	64	0	0	0	110.4	K270 F273 G274 L279 I297 K298 T299	K270-I277 HydrophobicContact CG-CG2 3.91Å; F273-I277 HydrophobicContact CB-CB 3.96Å; F273-I277 HydrophobicContact CB-CD1 4.2Å; F273-I277 HydrophobicContact CB-CG1 3.86Å; F273-I277 HydrophobicContact CB-CG2 4.18Å; F273-I277 HydrophobicContact CG-CG1 4.45Å; G274-I277 VanDerWaalsContact O-CG2 3.27Å; G274-I277 WeakPolarHBondContact O-CG2 3.48Å; G274-I277 PolarHBondContact O-N 2.94Å; I277-L279 HydrophobicContact CG2-CD1 4.32Å; I277-L279 HydrophobicContact CG2-CD2 4.36Å; I277-L279 HydrophobicContact CG2-CG 4.21Å; I277-I297 HydrophobicContact CD1-CB 4.28Å; I277-I297 HydrophobicContact CG1-CB 4.11Å; I277-I297 HydrophobicContact CG1-CG2 3.87Å; I277-K298 WeakPolarHBondContact CD1-O 3.19Å; I277-T299 HydrophobicContact CD1-CG2 4.24Å
278	Q	96.9	Very high	96.2	Very high	96 Å²	96	55.6 Å²	55.6	45%	0.449	29%	0.287	S	S	.	.			trans	-78.4	134	175.4	-68.4	-179.8	64.6	0	0	109.6	D276 I297 K298 W318	D276-Q278 PolarHBondContact O-N 2.73Å; Q278-I297 WeakPolarHBondContact O-CA 3.31Å; Q278-K298 HydrophobicContact CB-CB 3.8Å; Q278-K298 PolarHBondContact O-N 3.06Å; Q278-W318 HydrophobicContact CB-CH2 3.99Å
279	L	97.8	Very high	96.3	Very high	38 Å²	38	55.7 Å²	55.7	20%	0.199	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	138.1	-173.7	-64.8	164.8	0	0	0	109.2	K266 A269 K270 I277 L295 E296 I297	K266-L279 HydrophobicContact CB-CD1 4.2Å; K266-L279 HydrophobicContact CG-CD1 4.08Å; A269-L279 HydrophobicContact CB-CD1 4.42Å; A269-L279 HydrophobicContact CB-CD2 3.82Å; K270-L279 HydrophobicContact CG-CD1 4.16Å; I277-L279 HydrophobicContact CG2-CD1 4.32Å; I277-L279 HydrophobicContact CG2-CD2 4.36Å; I277-L279 HydrophobicContact CG2-CG 4.21Å; L279-L295 HydrophobicContact CB-CD1 4.18Å; L279-L295 HydrophobicContact CD2-CD1 4.04Å; L279-L295 HydrophobicContact CD2-CD2 4.2Å; L279-L295 HydrophobicContact CD2-CG 4.2Å; L279-E296 WeakPolarHBondContact CA-O 3.23Å; L279-I297 HydrophobicContact CD2-CG2 3.42Å; L279-I297 VanDerWaalsContact CD2-CG2 3.42Å
280	R	97.9	Very high	96.3	Very high	107 Å²	107	56.3 Å²	56.3	40%	0.404	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	148.9	167.4	72.7	-178.7	-177.2	173.5	3.5	111.3	V282 E296 W318	R280-V282 HydrophobicContact CG-CG2 4.49Å; R280-E296 HydrophobicContact CG-CB 3.99Å; R280-E296 IonicContact CZ-OE2 3.24Å; R280-E296 PolarHBondContact N-O 3.42Å; R280-E296 IonicContact NE-OE2 3.56Å; R280-E296 PolarHBondContact NE-OE2 2.56Å; R280-E296 IonicContact NH2-OE1 3.32Å; R280-E296 IonicContact NH2-OE2 2.7Å; R280-E296 PolarHBondContact NH2-OE2 3.11Å; R280-E296 PolarHBondContact O-N 3.19Å; R280-W318 HydrophobicContact CB-CE3 4.45Å; R280-W318 HydrophobicContact CB-CH2 3.99Å; R280-W318 HydrophobicContact CB-CZ3 3.92Å; R280-W318 HydrophobicContact CG-CD2 4.09Å; R280-W318 HydrophobicContact CG-CE3 3.63Å; R280-W318 HydrophobicContact CG-CH2 4.02Å; R280-W318 HydrophobicContact CG-CZ2 4.43Å; R280-W318 HydrophobicContact CG-CZ3 3.6Å
281	W	98.2	Very high	96.3	Very high	68 Å²	68	52.6 Å²	52.6	26%	0.258	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	132.5	172.2	-65.9	107.6	0	0	0	109.1	K262 L265 K266 W293 E294 L295	K262-W281 HydrophobicContact CB-CH2 4.25Å; K262-W281 HydrophobicContact CB-CZ2 3.53Å; K262-W281 HydrophobicContact CD-CD2 4.07Å; K262-W281 HydrophobicContact CD-CG 4.27Å; K262-W281 HydrophobicContact CD-CZ2 4.17Å; K262-W281 HydrophobicContact CG-CD2 4.2Å; K262-W281 HydrophobicContact CG-CH2 3.93Å; K262-W281 HydrophobicContact CG-CZ2 3.5Å; K262-W281 VanDerWaalsContact CG-CZ2 3.5Å; K262-W281 HydrophobicContact CG-CZ3 4.44Å; L265-W281 HydrophobicContact CB-CH2 3.89Å; L265-W281 HydrophobicContact CD1-CH2 3.87Å; L265-W281 HydrophobicContact CD1-CZ3 4.35Å; K266-W281 HydrophobicContact CD-CZ2 4.3Å; K266-W281 HydrophobicContact CG-CZ2 3.91Å; W281-W293 HydrophobicContact CE3-CB 3.9Å; W281-W293 HydrophobicContact CZ3-CB 4.38Å; W281-E294 WeakPolarHBondContact CA-O 3.09Å; W281-L295 HydrophobicContact CD2-CD1 3.97Å; W281-L295 HydrophobicContact CE3-CB 4.05Å; W281-L295 HydrophobicContact CE3-CD1 4Å; W281-L295 HydrophobicContact CH2-CB 4.05Å; W281-L295 HydrophobicContact CH2-CD1 3.92Å; W281-L295 HydrophobicContact CH2-CD2 4.2Å; W281-L295 HydrophobicContact CH2-CG 4.28Å; W281-L295 HydrophobicContact CZ2-CD1 3.87Å; W281-L295 HydrophobicContact CZ3-CB 3.62Å; W281-L295 HydrophobicContact CZ3-CD1 3.98Å; W281-L295 HydrophobicContact CZ3-CG 4.27Å
282	V	98.1	Very high	96.5	Very high	45 Å²	45	50 Å²	50	27%	0.273	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	134.8	172.1	-178.8	0	0	0	0	107.3	R280 A284 W293 E294 E296	R280-V282 HydrophobicContact CG-CG2 4.49Å; V282-A284 PolarHBondContact O-N 3.36Å; V282-W293 CarbonylContact O-C 3.59Å; V282-W293 WeakPolarHBondContact O-CA 3.13Å; V282-E294 HydrophobicContact CB-CB 4.39Å; V282-E294 PolarHBondContact N-O 2.73Å; V282-E294 PolarHBondContact O-N 2.86Å; V282-E296 HydrophobicContact CG2-CG 3.96Å
283	N	97	Very high	96.6	Very high	138 Å²	138	50 Å²	50	74%	0.738	26%	0.256	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.7	131.5	173.2	-71.4	-25.5	0	0	0	108.7	W293	N283-W293 VanDerWaalsContact OD1-CD1 3.31Å; N283-W293 PolarHBondContact OD1-NE1 3Å
284	A	95.6	Very high	96.8	Very high	28 Å²	28	50.3 Å²	50.3	23%	0.231	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	179.1	-177.2	0	0	0	0	0	110.5	V282 F286 S292 E294	V282-A284 PolarHBondContact O-N 3.36Å; A284-F286 HydrophobicContact CB-CE2 3.89Å; A284-F286 HydrophobicContact CB-CZ 4.17Å; A284-S292 PolarHBondContact N-O 3.48Å; A284-S292 WeakPolarHBondContact O-CB 3.19Å; A284-E294 HydrophobicContact CB-CG 3.84Å
285	Y	94.5	Very high	97	Very high	79 Å²	79	49.1 Å²	49.1	31%	0.31	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	127.1	175.8	169.2	-99.9	0	0	0	109.9	S238 Y239 P287	S238-Y285 VanDerWaalsContact CB-CE2 3.41Å; S238-Y285 WeakPolarHBondContact OG-CD2 3.35Å; S238-Y285 WeakPolarHBondContact OG-CE2 3.33Å; Y239-Y285 HydrophobicContact CD1-CE1 4.24Å; Y239-Y285 AromaticContact CD1-CE2 3.92Å; Y239-Y285 HydrophobicContact CD1-CE2 3.92Å; Y239-Y285 AromaticContact CD1-CZ 3.63Å; Y239-Y285 WeakPolarHBondContact CD1-OH 3.33Å; Y239-Y285 HydrophobicContact CG-CE2 4.36Å; Y285-P287 HydrophobicContact CE1-CG 4.07Å
286	F	96	Very high	97.1	Very high	47 Å²	47	46 Å²	46	21%	0.206	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	136	169.4	-55.2	-71	0	0	0	108.7	A284 F288 T289 E294	A284-F286 HydrophobicContact CB-CE2 3.89Å; A284-F286 HydrophobicContact CB-CZ 4.17Å; F286-F288 HydrophobicContact CB-CD1 4.43Å; F286-F288 HydrophobicContact CB-CE1 4.14Å; F286-F288 HydrophobicContact CB-CE2 4.24Å; F286-F288 HydrophobicContact CB-CZ 4.04Å; F286-F288 HydrophobicContact CD1-CZ 4.45Å; F286-F288 HydrophobicContact CG-CZ 4.41Å; F286-F288 PolarHBondContact O-N 3.01Å; F286-T289 WeakPolarHBondContact CB-OG1 3.36Å; F286-T289 PolarHBondContact O-N 3.01Å; F286-E294 HydrophobicContact CZ-CG 4.34Å
287	P	95.3	Very high	97.1	Very high	9 Å²	9	38.9 Å²	38.9	6%	0.058	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-24.1	-177.1	-27.9	37.1	0	0	0	115	L126 F127 I128 Y285 R328	L126-P287 CarbonylContact O-C 3.53Å; L126-P287 WeakPolarHBondContact O-CB 3.38Å; F127-P287 HydrophobicContact CB-CB 4.27Å; F127-P287 WeakPolarHBondContact O-CB 3.39Å; I128-P287 HydrophobicContact CG1-CB 4.3Å; I128-P287 HydrophobicContact CG1-CG 4.1Å; Y285-P287 HydrophobicContact CE1-CG 4.07Å; P287-R328 WeakPolarHBondContact O-CG 3.37Å
288	F	95.9	Very high	97	Very high	25 Å²	25	40 Å²	40	11%	0.11	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.3	-0.1	-176.3	48	-86.2	0	0	0	114.8	L126 F286 R328 L331	L126-F288 HydrophobicContact CB-CB 3.9Å; L126-F288 HydrophobicContact CB-CD1 3.66Å; L126-F288 HydrophobicContact CB-CE1 4.48Å; L126-F288 HydrophobicContact CB-CG 4Å; L126-F288 HydrophobicContact CD1-CD1 4.21Å; L126-F288 HydrophobicContact CD1-CE1 4.35Å; L126-F288 HydrophobicContact CD2-CB 4.01Å; L126-F288 HydrophobicContact CD2-CG 4.14Å; L126-F288 HydrophobicContact CG-CD1 4.35Å; L126-F288 HydrophobicContact CG-CG 4.46Å; L126-F288 WeakPolarHBondContact O-CB 3.46Å; L126-F288 PolarHBondContact O-N 3.45Å; F286-F288 HydrophobicContact CB-CD1 4.43Å; F286-F288 HydrophobicContact CB-CE1 4.14Å; F286-F288 HydrophobicContact CB-CE2 4.24Å; F286-F288 HydrophobicContact CB-CZ 4.04Å; F286-F288 HydrophobicContact CD1-CZ 4.45Å; F286-F288 HydrophobicContact CG-CZ 4.41Å; F286-F288 PolarHBondContact O-N 3.01Å; F288-R328 WeakPolarHBondContact O-CG 3.43Å; F288-R328 PolarHBondContact O-N 3.3Å; F288-L331 HydrophobicContact CB-CD1 4.47Å
289	T	98.1	Very high	96.5	Very high	2 Å²	2	36.4 Å²	36.4	1%	0.012	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	143.1	171.8	51.1	0	0	0	0	112.4	S238 F286 S292 I326	S238-T289 PolarHBondContact OG-O 3.32Å; F286-T289 WeakPolarHBondContact CB-OG1 3.36Å; F286-T289 PolarHBondContact O-N 3.01Å; T289-S292 VanDerWaalsContact C-OG 3.23Å; T289-S292 WeakPolarHBondContact CB-OG 3.3Å; T289-S292 PolarHBondContact O-OG 3.14Å; T289-S292 PolarHBondContact OG1-OG 2.7Å; T289-I326 CarbonylContact C-O 3.47Å; T289-I326 WeakPolarHBondContact CA-O 3.15Å; T289-I326 VanDerWaalsContact CB-O 3.29Å; T289-I326 WeakPolarHBondContact CB-O 3.23Å
290	H	97.7	Very high	95.6	Very high	13 Å²	13	40 Å²	40	6%	0.06	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.6	128.3	174.5	-171.7	75.5	0	0	0	112	S238 L241 P242 Q246 I326	S238-H290 PolarHBondContact OG-ND1 3.32Å; L241-H290 WeakPolarHBondContact CB-NE2 3.49Å; L241-H290 HydrophobicContact CD1-CB 4.01Å; P242-H290 PolarHBondContact O-CE1 2.95Å; P242-H290 VanDerWaalsContact O-CE1 3.28Å; P242-H290 PolarHBondContact O-NE2 3.47Å; Q246-H290 HydrophobicContact CG-CB 3.86Å; Q246-H290 WeakPolarHBondContact CG-O 3.43Å; Q246-H290 PolarHBondContact NE2-O 2.75Å; H290-I326 PolarHBondContact N-O 2.79Å
291	P	98	Very high	94	Very high	9 Å²	9	35.1 Å²	35.1	6%	0.058	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	cis	-61.4	163.2	-14.7	28.2	-38.6	0	0	0	112.7	W293 G325 I326	P291-W293 HydrophobicContact CB-CH2 4.02Å; P291-W293 HydrophobicContact CB-CZ2 3.78Å; P291-W293 HydrophobicContact CG-CH2 3.41Å; P291-W293 VanDerWaalsContact CG-CH2 3.41Å; P291-W293 HydrophobicContact CG-CZ2 3.55Å; P291-W293 HydrophobicContact CG-CZ3 4.27Å; P291-G325 VanDerWaalsContact O-CA 3.29Å; P291-G325 WeakPolarHBondContact O-CA 3.3Å; P291-I326 HydrophobicContact CG-CD1 4.25Å; P291-I326 PolarHBondContact O-N 2.85Å; P291-I326 VanDerWaalsContact O-N 3.09Å
292	S	98.5	Very high	92	Very high	5 Å²	5	33.2 Å²	33.2	4%	0.035	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	147	-174.6	-70.2	0	0	0	0	111.6	A284 T289 C324	A284-S292 PolarHBondContact N-O 3.48Å; A284-S292 WeakPolarHBondContact O-CB 3.19Å; T289-S292 VanDerWaalsContact C-OG 3.23Å; T289-S292 WeakPolarHBondContact CB-OG 3.3Å; T289-S292 PolarHBondContact O-OG 3.14Å; T289-S292 PolarHBondContact OG1-OG 2.7Å; S292-C324 CarbonylContact C-O 3.59Å; S292-C324 WeakPolarHBondContact CA-O 3.35Å
293	W	98.5	Very high	89.9	Confident	8 Å²	8	32.6 Å²	32.6	3%	0.03	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	155.6	-179.8	-53.3	-80.5	0	0	0	112.1	E258 L261 W281 V282 N283 P291 C324 I326	E258-W293 HydrophobicContact CB-CH2 3.86Å; E258-W293 HydrophobicContact CB-CZ2 4.48Å; E258-W293 VanDerWaalsContact CD-CZ2 3.45Å; E258-W293 HydrophobicContact CG-CH2 3.58Å; E258-W293 HydrophobicContact CG-CZ2 3.82Å; E258-W293 HydrophobicContact CG-CZ3 4.31Å; L261-W293 HydrophobicContact CD2-CE3 4.2Å; L261-W293 HydrophobicContact CD2-CZ3 4.03Å; W281-W293 HydrophobicContact CE3-CB 3.9Å; W281-W293 HydrophobicContact CZ3-CB 4.38Å; V282-W293 CarbonylContact O-C 3.59Å; V282-W293 WeakPolarHBondContact O-CA 3.13Å; N283-W293 VanDerWaalsContact OD1-CD1 3.31Å; N283-W293 PolarHBondContact OD1-NE1 3Å; P291-W293 HydrophobicContact CB-CH2 4.02Å; P291-W293 HydrophobicContact CB-CZ2 3.78Å; P291-W293 HydrophobicContact CG-CH2 3.41Å; P291-W293 VanDerWaalsContact CG-CH2 3.41Å; P291-W293 HydrophobicContact CG-CZ2 3.55Å; P291-W293 HydrophobicContact CG-CZ3 4.27Å; W293-C324 PolarHBondContact N-O 3.29Å; W293-C324 PolarHBondContact O-N 3.12Å; W293-C324 VanDerWaalsContact O-O 3.06Å; W293-I326 HydrophobicContact CH2-CD1 4.4Å; W293-I326 HydrophobicContact CZ3-CG1 4.42Å
294	E	98.6	Very high	87.4	Confident	46 Å²	46	28.7 Å²	28.7	22%	0.215	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	142.8	162.5	-74.6	162.5	179.8	0	0	109.3	W281 V282 A284 F286 E320 L322	W281-E294 WeakPolarHBondContact CA-O 3.09Å; V282-E294 HydrophobicContact CB-CB 4.39Å; V282-E294 PolarHBondContact N-O 2.73Å; V282-E294 PolarHBondContact O-N 2.86Å; A284-E294 HydrophobicContact CB-CG 3.84Å; F286-E294 HydrophobicContact CZ-CG 4.34Å; E294-E320 HydrophobicContact CB-CG 3.91Å; E294-E320 HydrophobicContact CG-CG 3.87Å; E294-L322 VanDerWaalsContact CA-O 3.3Å; E294-L322 WeakPolarHBondContact CA-O 3.47Å
295	L	98.5	Very high	84.9	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	128.2	168.5	-175.1	61.6	0	0	0	108.5	L265 A269 L279 W281 I321 L322	L265-L295 HydrophobicContact CB-CD2 4.34Å; A269-L295 HydrophobicContact CB-CD2 4.25Å; L279-L295 HydrophobicContact CB-CD1 4.18Å; L279-L295 HydrophobicContact CD2-CD1 4.04Å; L279-L295 HydrophobicContact CD2-CD2 4.2Å; L279-L295 HydrophobicContact CD2-CG 4.2Å; W281-L295 HydrophobicContact CD2-CD1 3.97Å; W281-L295 HydrophobicContact CE3-CB 4.05Å; W281-L295 HydrophobicContact CE3-CD1 4Å; W281-L295 HydrophobicContact CH2-CB 4.05Å; W281-L295 HydrophobicContact CH2-CD1 3.92Å; W281-L295 HydrophobicContact CH2-CD2 4.2Å; W281-L295 HydrophobicContact CH2-CG 4.28Å; W281-L295 HydrophobicContact CZ2-CD1 3.87Å; W281-L295 HydrophobicContact CZ3-CB 3.62Å; W281-L295 HydrophobicContact CZ3-CD1 3.98Å; W281-L295 HydrophobicContact CZ3-CG 4.27Å; L295-I321 HydrophobicContact CB-CG1 4.33Å; L295-I321 HydrophobicContact CD2-CD1 4Å; L295-I321 HydrophobicContact CG-CD1 4.15Å; L295-I321 HydrophobicContact CG-CG1 4.3Å; L295-I321 WeakPolarHBondContact O-CG1 3.17Å; L295-I321 PolarHBondContact O-N 3.45Å; L295-L322 HydrophobicContact CB-CD1 3.89Å; L295-L322 HydrophobicContact CB-CD2 4.05Å; L295-L322 HydrophobicContact CB-CG 3.76Å; L295-L322 HydrophobicContact CD2-CD2 3.94Å; L295-L322 PolarHBondContact N-O 3.46Å
296	E	97.6	Very high	82.5	Confident	25 Å²	25	34.5 Å²	34.5	12%	0.117	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	142.7	172.9	-51.2	-168.7	152.8	0	0	111.2	L279 R280 V282 W318 T319 E320	L279-E296 WeakPolarHBondContact CA-O 3.23Å; R280-E296 HydrophobicContact CG-CB 3.99Å; R280-E296 IonicContact CZ-OE2 3.24Å; R280-E296 PolarHBondContact N-O 3.42Å; R280-E296 IonicContact NE-OE2 3.56Å; R280-E296 PolarHBondContact NE-OE2 2.56Å; R280-E296 IonicContact NH2-OE1 3.32Å; R280-E296 IonicContact NH2-OE2 2.7Å; R280-E296 PolarHBondContact NH2-OE2 3.11Å; R280-E296 PolarHBondContact O-N 3.19Å; V282-E296 HydrophobicContact CG2-CG 3.96Å; E296-W318 HydrophobicContact CB-CE3 4.02Å; E296-W318 WeakPolarHBondContact OE2-CB 3.2Å; E296-T319 CarbonylContact C-O 3.57Å; E296-T319 WeakPolarHBondContact CA-O 3.07Å; E296-E320 HydrophobicContact CG-CB 4.19Å
297	I	95.8	Very high	80.1	Confident	0 Å²	0	40 Å²	40	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	147.9	170	55.5	174	0	0	0	110.5	F273 I277 Q278 L279 T299 W318 T319 I321 R355	F273-I297 HydrophobicContact CD1-CD1 4.29Å; F273-I297 HydrophobicContact CD2-CD1 4.28Å; F273-I297 HydrophobicContact CE1-CD1 3.88Å; F273-I297 HydrophobicContact CE2-CD1 3.87Å; F273-I297 HydrophobicContact CG-CD1 4.48Å; F273-I297 HydrophobicContact CZ-CD1 3.66Å; I277-I297 HydrophobicContact CD1-CB 4.28Å; I277-I297 HydrophobicContact CG1-CB 4.11Å; I277-I297 HydrophobicContact CG1-CG2 3.87Å; Q278-I297 WeakPolarHBondContact O-CA 3.31Å; L279-I297 HydrophobicContact CD2-CG2 3.42Å; L279-I297 VanDerWaalsContact CD2-CG2 3.42Å; I297-T299 HydrophobicContact CB-CG2 4.46Å; I297-T299 HydrophobicContact CD1-CG2 3.61Å; I297-T299 HydrophobicContact CG1-CG2 3.97Å; I297-W318 WeakPolarHBondContact O-CA 3.27Å; I297-T319 PolarHBondContact N-O 2.87Å; I297-T319 PolarHBondContact O-N 3.27Å; I297-I321 HydrophobicContact CD1-CG2 3.73Å; I297-I321 HydrophobicContact CG1-CD1 4.48Å; I297-I321 HydrophobicContact CG1-CG2 3.66Å; I297-I321 HydrophobicContact CG2-CD1 3.55Å; I297-I321 HydrophobicContact CG2-CG1 4.32Å; I297-R355 HydrophobicContact CD1-CB 4.12Å; I297-R355 HydrophobicContact CD1-CG 4.19Å
298	K	93.5	Very high	77.8	Confident	51 Å²	51	41 Å²	41	22%	0.222	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	119.2	168.8	-147.8	-173.5	-167.8	-164.4	0	109.5	I277 Q278 E316 E317 W318	I277-K298 WeakPolarHBondContact CD1-O 3.19Å; Q278-K298 HydrophobicContact CB-CB 3.8Å; Q278-K298 PolarHBondContact O-N 3.06Å; K298-E316 HydrophobicContact CD-CB 4.23Å; K298-E316 WeakPolarHBondContact CE-OE2 3.26Å; K298-E316 HydrophobicContact CG-CB 4.19Å; K298-E316 IonicContact NZ-OE2 2.71Å; K298-E316 PolarHBondContact NZ-OE2 3.38Å; K298-E317 WeakPolarHBondContact CA-O 3.16Å; K298-W318 HydrophobicContact CB-CD2 4.09Å; K298-W318 HydrophobicContact CB-CE3 3.9Å; K298-W318 HydrophobicContact CB-CH2 3.93Å; K298-W318 HydrophobicContact CB-CZ2 4.1Å; K298-W318 HydrophobicContact CB-CZ3 3.81Å; K298-W318 HydrophobicContact CD-CZ2 3.97Å; K298-W318 HydrophobicContact CG-CD2 4.01Å; K298-W318 HydrophobicContact CG-CE3 4.34Å; K298-W318 HydrophobicContact CG-CG 4.46Å; K298-W318 HydrophobicContact CG-CH2 4.47Å; K298-W318 HydrophobicContact CG-CZ2 4.13Å
299	T	86	Confident	75.6	Confident	21 Å²	21	45.6 Å²	45.6	13%	0.129	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	158.3	177.3	59.1	0	0	0	0	110	I277 I297 E316 E317 R355	I277-T299 HydrophobicContact CD1-CG2 4.24Å; I297-T299 HydrophobicContact CB-CG2 4.46Å; I297-T299 HydrophobicContact CD1-CG2 3.61Å; I297-T299 HydrophobicContact CG1-CG2 3.97Å; T299-E316 WeakPolarHBondContact O-CA 3.39Å; T299-E317 PolarHBondContact N-O 2.98Å; T299-E317 PolarHBondContact O-N 3Å; T299-R355 WeakPolarHBondContact OG1-CD 3.03Å; T299-R355 PolarHBondContact OG1-NE 3.23Å; T299-R355 PolarHBondContact OG1-NH1 3.17Å
300	K	77.8	Confident	73.5	Confident	115 Å²	115	50.9 Å²	50.9	50%	0.5	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	139.1	169.3	-66.6	-170.1	171.5	-163.3	0	109	G302 E313	K300-G302 PolarHBondContact O-N 3.01Å; K300-G302 VanDerWaalsContact O-N 3.14Å; K300-E313 IonicContact NZ-OE1 2.73Å; K300-E313 PolarHBondContact NZ-OE1 3.07Å
301	S	65.3	Low	71.5	Confident	3 Å²	3	57.5 Å²	57.5	2%	0.021	32%	0.316	C	S	.	.			trans	-58	121.2	-177.3	-172	0	0	0	0	109.4	S304 K314 P315 E317	S301-S304 PolarHBondContact OG-OG 2.65Å; S301-K314 WeakPolarHBondContact O-CD 3.41Å; S301-P315 WeakPolarHBondContact CA-O 3.33Å; S301-P315 WeakPolarHBondContact CB-O 3.4Å; S301-P315 PolarHBondContact N-O 2.97Å; S301-E317 WeakPolarHBondContact CA-OE1 3.2Å; S301-E317 WeakPolarHBondContact CB-OE2 3.35Å; S301-E317 VanDerWaalsContact OG-CD 3.31Å; S301-E317 PolarHBondContact OG-OE1 2.73Å; S301-E317 PolarHBondContact OG-OE2 3.12Å
302	G	56.3	Low	69.8	Low	29 Å²	29	59.3 Å²	59.3	30%	0.299	33%	0.329	S	S	.	.			trans	-102.9	-19.2	-175.6	0	0	0	0	0	113	K300 E317	K300-G302 PolarHBondContact O-N 3.01Å; K300-G302 VanDerWaalsContact O-N 3.14Å; G302-E317 PolarHBondContact N-OE1 2.79Å
303	Y	54.4	Low	68.1	Low	31 Å²	31	66.1 Å²	66.1	12%	0.122	36%	0.36	C	S	.	.	S	Bend	trans	-126.1	-12.3	-160.2	-46.3	-53.2	0	0	0	114.6	L183 N305 M354 R355	L183-Y303 HydrophobicContact CD1-CD2 4.32Å; L183-Y303 HydrophobicContact CD2-CD1 3.84Å; L183-Y303 HydrophobicContact CD2-CD2 3.53Å; L183-Y303 HydrophobicContact CD2-CE1 4.25Å; L183-Y303 HydrophobicContact CD2-CE2 3.83Å; L183-Y303 HydrophobicContact CD2-CG 3.51Å; Y303-N305 PolarHBondContact O-N 2.76Å; Y303-M354 HydrophobicContact CD1-CE 4Å; Y303-M354 HydrophobicContact CE1-CB 3.94Å; Y303-M354 HydrophobicContact CE1-CE 3.51Å; Y303-M354 WeakPolarHBondContact OH-CB 3.35Å; Y303-R355 VanDerWaalsContact CD2-NH2 3.26Å; Y303-R355 WeakPolarHBondContact OH-CD 3.25Å; Y303-R355 PolarHBondContact OH-N 3.01Å; Y303-R355 PolarHBondContact OH-NE 2.83Å
304	S	43.6	Very low	66.7	Low	57 Å²	57	71.2 Å²	71.2	40%	0.399	38%	0.383	S	S	.	.	S	Bend	trans	-68.4	134.9	173.5	54	0	0	0	0	108.8	S301 Y306	S301-S304 PolarHBondContact OG-OG 2.65Å; S304-Y306 PolarHBondContact O-N 3.45Å
305	N	43.2	Very low	65.8	Low	120 Å²	120	71.9 Å²	71.9	64%	0.642	39%	0.391	S	S	*	.			trans	-64	65	154.1	-71.1	-35.6	0	0	0	107.3	Y303 D307	Y303-N305 PolarHBondContact O-N 2.76Å; N305-D307 VanDerWaalsContact C-N 3.3Å; N305-D307 PolarHBondContact O-N 2.95Å
306	Y	44.1	Very low	65.1	Low	109 Å²	109	76.7 Å²	76.7	43%	0.427	41%	0.414	S	S	.	.			trans	-68.3	99	174.5	-174.1	-102.6	0	0	0	105.8	S304 G308 P315	S304-Y306 PolarHBondContact O-N 3.45Å; Y306-G308 PolarHBondContact O-N 3.36Å; Y306-G308 VanDerWaalsContact O-N 3.15Å; Y306-P315 HydrophobicContact CD2-CG 4.43Å; Y306-P315 HydrophobicContact CE2-CG 4.46Å
307	D	45.8	Very low	64.6	Low	162 Å²	162	78 Å²	78	87%	0.866	42%	0.42	S	S	*	.			trans	-70.8	6.8	175	-74.6	-24.6	0	0	0	112.4	N305	N305-D307 VanDerWaalsContact C-N 3.3Å; N305-D307 PolarHBondContact O-N 2.95Å
308	G	46.2	Very low	64.5	Low	29 Å²	29	81.9 Å²	81.9	30%	0.299	43%	0.434	S	S	.	.	S	Bend	trans	-68.2	147.6	169.4	0	0	0	0	0	110.2	Y306	Y306-G308 PolarHBondContact O-N 3.36Å; Y306-G308 VanDerWaalsContact O-N 3.15Å
309	D	50	Low	64.4	Low	123 Å²	123	80.2 Å²	80.2	66%	0.658	43%	0.428	S	S	*	.			trans	-52.4	146.8	-176.7	-150.4	-13.4	0	0	0	110.5	D311 S312	D309-D311 PolarHBondContact O-N 2.78Å; D309-S312 PolarHBondContact N-OG 3.28Å; D309-S312 WeakPolarHBondContact O-CB 3.17Å; D309-S312 PolarHBondContact O-N 3.35Å; D309-S312 PolarHBondContact O-OG 3.25Å
310	S	54.8	Low	64.9	Low	113 Å²	113	82.1 Å²	82.1	79%	0.79	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-17.2	-171.1	59.3	0	0	0	0	114.9
311	D	54.2	Low	65.7	Low	152 Å²	152	76.8 Å²	76.8	81%	0.813	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-7.5	177.6	-76.7	-25.1	0	0	0	114.6	D309	D309-D311 PolarHBondContact O-N 2.78Å
312	S	62.9	Low	67.3	Low	47 Å²	47	76.7 Å²	76.7	33%	0.329	41%	0.412	S	S	.	.	S	Bend	trans	-78.6	132.8	179.6	-19.3	0	0	0	0	110.8	D309 K314	D309-S312 PolarHBondContact N-OG 3.28Å; D309-S312 WeakPolarHBondContact O-CB 3.17Å; D309-S312 PolarHBondContact O-N 3.35Å; D309-S312 PolarHBondContact O-OG 3.25Å; S312-K314 PolarHBondContact O-N 3.3Å; S312-K314 VanDerWaalsContact O-N 3.16Å
313	E	64.1	Low	69.3	Low	148 Å²	148	75.9 Å²	75.9	69%	0.692	40%	0.404	S	S	*	.	P	Polyproline II helix	trans	-63.2	119.9	178.7	-165.5	169.6	-155.8	0	0	110.6	K300	K300-E313 IonicContact NZ-OE1 2.73Å; K300-E313 PolarHBondContact NZ-OE1 3.07Å
314	K	68.5	Low	71.4	Confident	114 Å²	114	74.6 Å²	74.6	50%	0.496	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-58.2	132.3	-179.3	-61.1	-166.8	-173.4	-178	0	110.1	S301 S312	S301-K314 WeakPolarHBondContact O-CD 3.41Å; S312-K314 PolarHBondContact O-N 3.3Å; S312-K314 VanDerWaalsContact O-N 3.16Å
315	P	78.8	Confident	74.1	Confident	61 Å²	61	71.9 Å²	71.9	40%	0.396	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-62.6	145.6	-178	25.8	-33.5	0	0	0	110.5	S301 Y306	S301-P315 WeakPolarHBondContact CA-O 3.33Å; S301-P315 WeakPolarHBondContact CB-O 3.4Å; S301-P315 PolarHBondContact N-O 2.97Å; Y306-P315 HydrophobicContact CD2-CG 4.43Å; Y306-P315 HydrophobicContact CE2-CG 4.46Å
316	E	83.8	Confident	76.7	Confident	101 Å²	101	66.1 Å²	66.1	47%	0.472	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	138.9	171.1	-64.4	-173.9	126.8	0	0	110.6	K298 T299	K298-E316 HydrophobicContact CD-CB 4.23Å; K298-E316 WeakPolarHBondContact CE-OE2 3.26Å; K298-E316 HydrophobicContact CG-CB 4.19Å; K298-E316 IonicContact NZ-OE2 2.71Å; K298-E316 PolarHBondContact NZ-OE2 3.38Å; T299-E316 WeakPolarHBondContact O-CA 3.39Å
317	E	88.2	Confident	79.3	Confident	53 Å²	53	61 Å²	61	25%	0.248	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	145.6	176.2	70	-165.7	177.7	0	0	111	K298 T299 S301 G302 R355	K298-E317 WeakPolarHBondContact CA-O 3.16Å; T299-E317 PolarHBondContact N-O 2.98Å; T299-E317 PolarHBondContact O-N 3Å; S301-E317 WeakPolarHBondContact CA-OE1 3.2Å; S301-E317 WeakPolarHBondContact CB-OE2 3.35Å; S301-E317 VanDerWaalsContact OG-CD 3.31Å; S301-E317 PolarHBondContact OG-OE1 2.73Å; S301-E317 PolarHBondContact OG-OE2 3.12Å; G302-E317 PolarHBondContact N-OE1 2.79Å; E317-R355 IonicContact OE1-CZ 3.11Å; E317-R355 IonicContact OE1-NH1 3.14Å; E317-R355 PolarHBondContact OE1-NH1 3.19Å; E317-R355 IonicContact OE1-NH2 3.02Å; E317-R355 PolarHBondContact OE1-NH2 2.9Å
318	W	93.1	Very high	81.7	Confident	80 Å²	80	53.3 Å²	53.3	30%	0.303	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	135.9	169.2	-72.3	102.8	0	0	0	109.3	Q278 R280 E296 I297 K298	Q278-W318 HydrophobicContact CB-CH2 3.99Å; R280-W318 HydrophobicContact CB-CE3 4.45Å; R280-W318 HydrophobicContact CB-CH2 3.99Å; R280-W318 HydrophobicContact CB-CZ3 3.92Å; R280-W318 HydrophobicContact CG-CD2 4.09Å; R280-W318 HydrophobicContact CG-CE3 3.63Å; R280-W318 HydrophobicContact CG-CH2 4.02Å; R280-W318 HydrophobicContact CG-CZ2 4.43Å; R280-W318 HydrophobicContact CG-CZ3 3.6Å; E296-W318 HydrophobicContact CB-CE3 4.02Å; E296-W318 WeakPolarHBondContact OE2-CB 3.2Å; I297-W318 WeakPolarHBondContact O-CA 3.27Å; K298-W318 HydrophobicContact CB-CD2 4.09Å; K298-W318 HydrophobicContact CB-CE3 3.9Å; K298-W318 HydrophobicContact CB-CH2 3.93Å; K298-W318 HydrophobicContact CB-CZ2 4.1Å; K298-W318 HydrophobicContact CB-CZ3 3.81Å; K298-W318 HydrophobicContact CD-CZ2 3.97Å; K298-W318 HydrophobicContact CG-CD2 4.01Å; K298-W318 HydrophobicContact CG-CE3 4.34Å; K298-W318 HydrophobicContact CG-CG 4.46Å; K298-W318 HydrophobicContact CG-CH2 4.47Å; K298-W318 HydrophobicContact CG-CZ2 4.13Å
319	T	92.3	Very high	84.1	Confident	16 Å²	16	52 Å²	52	10%	0.098	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	120.3	-179.2	-60.7	0	0	0	0	110.1	E296 I297 I321 R351 R355	E296-T319 CarbonylContact C-O 3.57Å; E296-T319 WeakPolarHBondContact CA-O 3.07Å; I297-T319 PolarHBondContact N-O 2.87Å; I297-T319 PolarHBondContact O-N 3.27Å; T319-I321 PolarHBondContact O-N 3.48Å; T319-R351 HydrophobicContact CG2-CG 4.08Å; T319-R355 PolarHBondContact OG1-NH2 2.93Å
320	E	95.3	Very high	86.1	Confident	62 Å²	62	47.9 Å²	47.9	29%	0.29	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.6	120.3	168.5	-177.1	-125.1	144.1	0	0	110.6	E294 E296 R351	E294-E320 HydrophobicContact CB-CG 3.91Å; E294-E320 HydrophobicContact CG-CG 3.87Å; E296-E320 HydrophobicContact CG-CB 4.19Å; E320-R351 WeakPolarHBondContact O-CD 3.35Å; E320-R351 PolarHBondContact O-NH1 3.05Å; E320-R351 IonicContact OE1-NH1 3.92Å; E320-R351 IonicContact OE2-NH1 2.63Å; E320-R351 PolarHBondContact OE2-NH1 3.3Å
321	I	95.8	Very high	88	Confident	2 Å²	2	42.5 Å²	42.5	1%	0.01	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	-14.1	-177	49	160.1	0	0	0	113.4	A269 L295 I297 T319 W352	A269-I321 HydrophobicContact CB-CD1 4.44Å; L295-I321 HydrophobicContact CB-CG1 4.33Å; L295-I321 HydrophobicContact CD2-CD1 4Å; L295-I321 HydrophobicContact CG-CD1 4.15Å; L295-I321 HydrophobicContact CG-CG1 4.3Å; L295-I321 WeakPolarHBondContact O-CG1 3.17Å; L295-I321 PolarHBondContact O-N 3.45Å; I297-I321 HydrophobicContact CD1-CG2 3.73Å; I297-I321 HydrophobicContact CG1-CD1 4.48Å; I297-I321 HydrophobicContact CG1-CG2 3.66Å; I297-I321 HydrophobicContact CG2-CD1 3.55Å; I297-I321 HydrophobicContact CG2-CG1 4.32Å; T319-I321 PolarHBondContact O-N 3.48Å; I321-W352 HydrophobicContact CD1-CH2 4.33Å; I321-W352 HydrophobicContact CD1-CZ2 3.75Å; I321-W352 PolarHBondContact O-NE1 2.62Å
322	L	98.4	Very high	90	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.005	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.8	154.8	176.2	64.5	93	0	0	0	111	L265 M268 E294 L295 C324 G346 L347 W352	L265-L322 HydrophobicContact CD1-CD1 3.69Å; L265-L322 HydrophobicContact CD1-CD2 4.38Å; L265-L322 HydrophobicContact CD2-CD2 4.03Å; M268-L322 HydrophobicContact CE-CD2 4.44Å; E294-L322 VanDerWaalsContact CA-O 3.3Å; E294-L322 WeakPolarHBondContact CA-O 3.47Å; L295-L322 HydrophobicContact CB-CD1 3.89Å; L295-L322 HydrophobicContact CB-CD2 4.05Å; L295-L322 HydrophobicContact CB-CG 3.76Å; L295-L322 HydrophobicContact CD2-CD2 3.94Å; L295-L322 PolarHBondContact N-O 3.46Å; L322-C324 HydrophobicContact CD1-CB 3.9Å; L322-G346 WeakPolarHBondContact CA-O 3.17Å; L322-G346 WeakPolarHBondContact CB-O 3.29Å; L322-L347 HydrophobicContact CB-CB 3.68Å; L322-W352 HydrophobicContact CD2-CZ2 4.08Å
323	G	98.6	Very high	91.5	Very high	13 Å²	13	37.5 Å²	37.5	13%	0.134	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	147	161.1	0	0	0	0	0	110.9	F345 G346	G323-F345 CarbonylContact O-C 3.54Å; G323-F345 WeakPolarHBondContact O-CA 3.23Å; G323-G346 PolarHBondContact N-O 3.35Å; G323-G346 PolarHBondContact O-N 3Å
324	C	98.9	Very high	92.7	Very high	3 Å²	3	34.8 Å²	34.8	2%	0.02	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	168.3	178.7	69	0	0	0	0	112.4	L261 L265 S292 W293 L322 A344 F345	L261-C324 HydrophobicContact CD1-CB 4.19Å; L261-C324 HydrophobicContact CD2-CB 4.08Å; L261-C324 HydrophobicContact CG-CB 4.5Å; L265-C324 HydrophobicContact CD1-CB 3.81Å; S292-C324 CarbonylContact C-O 3.59Å; S292-C324 WeakPolarHBondContact CA-O 3.35Å; W293-C324 PolarHBondContact N-O 3.29Å; W293-C324 PolarHBondContact O-N 3.12Å; W293-C324 VanDerWaalsContact O-O 3.06Å; L322-C324 HydrophobicContact CD1-CB 3.9Å; C324-A344 CarbonylContact C-O 3.58Å; C324-A344 VanDerWaalsContact CA-O 3.26Å; C324-A344 WeakPolarHBondContact CA-O 3.26Å; C324-A344 WeakPolarHBondContact CB-O 3.45Å; C324-F345 HydrophobicContact CB-CB 3.61Å
325	G	98.7	Very high	93.9	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	178.2	179.9	169.6	0	0	0	0	0	113.5	P291 Y343 A344	P291-G325 VanDerWaalsContact O-CA 3.29Å; P291-G325 WeakPolarHBondContact O-CA 3.3Å; G325-Y343 WeakPolarHBondContact O-CA 3.38Å; G325-Y343 WeakPolarHBondContact O-CB 3.34Å; G325-A344 PolarHBondContact N-O 3.34Å; G325-A344 PolarHBondContact O-N 3.27Å
326	I	98.7	Very high	94.6	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	126	172.1	-66.5	173.9	0	0	0	107.6	K254 L257 T289 H290 P291 W293	K254-I326 HydrophobicContact CB-CD1 4.36Å; K254-I326 HydrophobicContact CG-CD1 3.81Å; L257-I326 HydrophobicContact CB-CD1 3.84Å; L257-I326 HydrophobicContact CB-CG1 3.95Å; L257-I326 HydrophobicContact CD1-CD1 4.42Å; L257-I326 HydrophobicContact CD1-CG1 4.42Å; L257-I326 HydrophobicContact CD1-CG2 3.9Å; T289-I326 CarbonylContact C-O 3.47Å; T289-I326 WeakPolarHBondContact CA-O 3.15Å; T289-I326 VanDerWaalsContact CB-O 3.29Å; T289-I326 WeakPolarHBondContact CB-O 3.23Å; H290-I326 PolarHBondContact N-O 2.79Å; P291-I326 HydrophobicContact CG-CD1 4.25Å; P291-I326 PolarHBondContact O-N 2.85Å; P291-I326 VanDerWaalsContact O-N 3.09Å; W293-I326 HydrophobicContact CH2-CD1 4.4Å; W293-I326 HydrophobicContact CZ3-CG1 4.42Å
327	M	98.4	Very high	95.1	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.9	140.1	-176.5	-63	-176.5	72	0	0	110.9	Q157 I161 V194 L196 Q246 Q329 L331 L332 G342 A344	Q157-M327 VanDerWaalsContact OE1-CE 3.26Å; I161-M327 HydrophobicContact CD1-CE 3.39Å; I161-M327 HydrophobicContact CD1-SD 4.38Å; V194-M327 HydrophobicContact CG1-CE 4.37Å; V194-M327 HydrophobicContact CG1-SD 3.74Å; L196-M327 HydrophobicContact CD2-SD 3.78Å; Q246-M327 PolarHBondContact NE2-O 2.84Å; M327-Q329 PolarHBondContact O-N 3.17Å; M327-L331 HydrophobicContact CE-CD1 4.33Å; M327-L331 HydrophobicContact CE-CD2 3.7Å; M327-L332 HydrophobicContact CE-CD2 4.32Å; M327-G342 PolarHBondContact N-O 2.63Å; M327-A344 HydrophobicContact CG-CB 3.84Å; M327-A344 HydrophobicContact SD-CB 4.12Å
328	R	96.2	Very high	95.3	Very high	2 Å²	2	27.1 Å²	27.1	1%	0.008	15%	0.148	C	C	.	.	P	Polyproline II helix	trans	-60.5	128.8	174.4	-68	-74.3	-77	121.4	0.1	109.9	F127 V235 F236 L241 Q246 P287 F288 E330 L331	F127-R328 HydrophobicContact CD2-CB 4.15Å; F127-R328 HydrophobicContact CD2-CG 4.27Å; F127-R328 HydrophobicContact CE2-CB 3.66Å; F127-R328 HydrophobicContact CE2-CG 4.29Å; V235-R328 VanDerWaalsContact CG1-NH2 3.32Å; F236-R328 PolarHBondContact O-NH2 2.75Å; L241-R328 VanDerWaalsContact CD1-NH1 3.29Å; Q246-R328 VanDerWaalsContact OE1-CA 3.28Å; P287-R328 WeakPolarHBondContact O-CG 3.37Å; F288-R328 WeakPolarHBondContact O-CG 3.43Å; F288-R328 PolarHBondContact O-N 3.3Å; R328-E330 IonicContact CZ-OE1 2.7Å; R328-E330 IonicContact CZ-OE2 3.25Å; R328-E330 IonicContact NE-OE2 2.91Å; R328-E330 VanDerWaalsContact NH1-CD 3.32Å; R328-E330 IonicContact NH1-OE1 3.47Å; R328-E330 PolarHBondContact NH1-OE1 2.83Å; R328-E330 IonicContact NH1-OE2 2.67Å; R328-E330 PolarHBondContact NH1-OE2 2.96Å; R328-E330 IonicContact NH2-OE1 2.77Å; R328-E330 PolarHBondContact NH2-OE1 3.18Å; R328-E330 IonicContact NH2-OE2 2.64Å; R328-E330 PolarHBondContact O-N 3.02Å; R328-L331 WeakPolarHBondContact O-CB 3.15Å; R328-L331 PolarHBondContact O-N 2.94Å
329	Q	95.8	Very high	95.4	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-60.1	-35.4	-175.7	-169.3	60	27.1	0	0	111.8	L216 C248 H249 M327 L331 L332 E333 P338 K340	L216-Q329 HydrophobicContact CD2-CG 4.15Å; C248-Q329 VanDerWaalsContact SG-CB 3.51Å; H249-Q329 PolarHBondContact NE2-OE1 3.36Å; M327-Q329 PolarHBondContact O-N 3.17Å; Q329-L331 PolarHBondContact O-N 3.11Å; Q329-L331 VanDerWaalsContact O-N 3.14Å; Q329-L332 WeakPolarHBondContact O-CB 3.49Å; Q329-L332 PolarHBondContact O-N 2.74Å; Q329-E333 HydrophobicContact CG-CG 4.46Å; Q329-E333 WeakPolarHBondContact O-CG 3.34Å; Q329-E333 PolarHBondContact O-N 2.78Å; Q329-P338 PolarHBondContact NE2-O 2.92Å; Q329-P338 VanDerWaalsContact NE2-O 3.09Å; Q329-K340 PolarHBondContact NE2-O 3.15Å; Q329-K340 PolarHBondContact OE1-O 2.67Å
330	E	93.4	Very high	95.6	Very high	37 Å²	37	28.8 Å²	28.8	17%	0.173	16%	0.161	C	C	.	.	H	α-helix	trans	-59.2	-26.6	177.7	-58.1	90.2	150.6	0	0	112	F127 V235 R328 R334	F127-E330 HydrophobicContact CE1-CB 4.21Å; F127-E330 HydrophobicContact CE2-CB 4.34Å; F127-E330 HydrophobicContact CZ-CB 3.68Å; V235-E330 HydrophobicContact CG1-CB 4.31Å; V235-E330 HydrophobicContact CG1-CG 3.97Å; V235-E330 HydrophobicContact CG2-CB 4.22Å; V235-E330 HydrophobicContact CG2-CG 4.26Å; R328-E330 IonicContact CZ-OE1 2.7Å; R328-E330 IonicContact CZ-OE2 3.25Å; R328-E330 IonicContact NE-OE2 2.91Å; R328-E330 VanDerWaalsContact NH1-CD 3.32Å; R328-E330 IonicContact NH1-OE1 3.47Å; R328-E330 PolarHBondContact NH1-OE1 2.83Å; R328-E330 IonicContact NH1-OE2 2.67Å; R328-E330 PolarHBondContact NH1-OE2 2.96Å; R328-E330 IonicContact NH2-OE1 2.77Å; R328-E330 PolarHBondContact NH2-OE1 3.18Å; R328-E330 IonicContact NH2-OE2 2.64Å; R328-E330 PolarHBondContact O-N 3.02Å; E330-R334 WeakPolarHBondContact O-CB 3.08Å; E330-R334 WeakPolarHBondContact O-CG 3.09Å; E330-R334 PolarHBondContact O-N 2.81Å
331	L	94.4	Very high	95.8	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-71.7	-43.5	175.9	-173	155.8	0	0	0	110.1	L126 F127 L158 I161 F288 M327 R328 Q329 R334 S335	L126-L331 HydrophobicContact CD2-CD1 3.89Å; F127-L331 HydrophobicContact CE2-CB 3.82Å; F127-L331 HydrophobicContact CZ-CB 3.93Å; L158-L331 HydrophobicContact CD1-CD2 4.4Å; L158-L331 HydrophobicContact CD1-CG 4.29Å; I161-L331 HydrophobicContact CD1-CD2 3.66Å; F288-L331 HydrophobicContact CB-CD1 4.47Å; M327-L331 HydrophobicContact CE-CD1 4.33Å; M327-L331 HydrophobicContact CE-CD2 3.7Å; R328-L331 WeakPolarHBondContact O-CB 3.15Å; R328-L331 PolarHBondContact O-N 2.94Å; Q329-L331 PolarHBondContact O-N 3.11Å; Q329-L331 VanDerWaalsContact O-N 3.14Å; L331-R334 PolarHBondContact O-N 2.9Å; L331-S335 PolarHBondContact O-N 3.14Å; L331-S335 PolarHBondContact O-OG 2.82Å
332	L	95.9	Very high	95.9	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-67.6	-38.7	178.4	-55.5	-178.4	0	0	0	111.4	I161 L196 M327 Q329 S335 G336 I337 K340	I161-L332 HydrophobicContact CD1-CD2 4.24Å; I161-L332 HydrophobicContact CG2-CD2 4.34Å; L196-L332 HydrophobicContact CD1-CD2 4.28Å; L196-L332 HydrophobicContact CD2-CD2 3.79Å; M327-L332 HydrophobicContact CE-CD2 4.32Å; Q329-L332 WeakPolarHBondContact O-CB 3.49Å; Q329-L332 PolarHBondContact O-N 2.74Å; L332-S335 PolarHBondContact O-N 2.92Å; L332-G336 PolarHBondContact O-N 2.85Å; L332-I337 HydrophobicContact CB-CG1 4.25Å; L332-I337 HydrophobicContact CD2-CD1 4.14Å; L332-I337 CarbonylContact O-C 3.52Å; L332-I337 WeakPolarHBondContact O-CG1 3.49Å; L332-I337 PolarHBondContact O-N 2.76Å; L332-K340 WeakPolarHBondContact CD1-O 3.25Å
333	E	93.5	Very high	95.9	Very high	94 Å²	94	25.9 Å²	25.9	44%	0.439	15%	0.147	S	C	.	.	H	α-helix	trans	-59.5	-46.8	171.9	-69.4	167	-176.4	0	0	111.3	Q329 S335 G336 P338	Q329-E333 HydrophobicContact CG-CG 4.46Å; Q329-E333 WeakPolarHBondContact O-CG 3.34Å; Q329-E333 PolarHBondContact O-N 2.78Å; E333-S335 VanDerWaalsContact C-N 3.26Å; E333-S335 PolarHBondContact O-N 3.47Å; E333-G336 PolarHBondContact O-N 3.42Å; E333-P338 HydrophobicContact CG-CB 3.99Å
334	R	90.7	Very high	95.9	Very high	91 Å²	91	25.3 Å²	25.3	34%	0.343	14%	0.142	S	C	.	.	H	α-helix	trans	-65.6	-26.7	176.5	-75.4	175.1	-179.3	-161.2	1.2	113.6	L158 F233 E330 L331 G336	L158-R334 HydrophobicContact CD1-CB 4.11Å; F233-R334 PolarHBondContact O-NH2 3.39Å; E330-R334 WeakPolarHBondContact O-CB 3.08Å; E330-R334 WeakPolarHBondContact O-CG 3.09Å; E330-R334 PolarHBondContact O-N 2.81Å; L331-R334 PolarHBondContact O-N 2.9Å; R334-G336 PolarHBondContact O-N 3.38Å
335	S	93.1	Very high	95.9	Very high	12 Å²	12	25.3 Å²	25.3	8%	0.084	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-0.8	171.8	-66.5	0	0	0	0	114	L158 I161 S162 L331 L332 E333	L158-S335 WeakPolarHBondContact CD1-OG 3.3Å; L158-S335 PolarHBondContact O-OG 2.9Å; I161-S335 VanDerWaalsContact CG2-CB 3.5Å; S162-S335 WeakPolarHBondContact OG-CA 3.42Å; S162-S335 WeakPolarHBondContact OG-CB 3.41Å; S162-S335 PolarHBondContact OG-OG 3.48Å; L331-S335 PolarHBondContact O-N 3.14Å; L331-S335 PolarHBondContact O-OG 2.82Å; L332-S335 PolarHBondContact O-N 2.92Å; E333-S335 VanDerWaalsContact C-N 3.26Å; E333-S335 PolarHBondContact O-N 3.47Å
336	G	93.4	Very high	95.9	Very high	59 Å²	59	26 Å²	26	61%	0.608	15%	0.148	S	C	*	.	T	Hydrogen-bonded Turn	trans	78.8	19	-180	0	0	0	0	0	114.4	L332 E333 R334 P338	L332-G336 PolarHBondContact O-N 2.85Å; E333-G336 PolarHBondContact O-N 3.42Å; R334-G336 PolarHBondContact O-N 3.38Å; G336-P338 VanDerWaalsContact C-CD 3.41Å
337	I	93.9	Very high	95.8	Very high	28 Å²	28	26 Å²	26	14%	0.144	15%	0.148	C	C	.	.			trans	-127.8	58.2	-179.8	55.9	156.3	0	0	0	112.6	I161 L196 L332 N339 K340	I161-I337 HydrophobicContact CG2-CD1 3.23Å; I161-I337 HydrophobicContact CG2-CG1 3.85Å; L196-I337 HydrophobicContact CD1-CD1 3.39Å; L332-I337 HydrophobicContact CB-CG1 4.25Å; L332-I337 HydrophobicContact CD2-CD1 4.14Å; L332-I337 CarbonylContact O-C 3.52Å; L332-I337 WeakPolarHBondContact O-CG1 3.49Å; L332-I337 PolarHBondContact O-N 2.76Å; I337-N339 PolarHBondContact O-N 2.94Å; I337-N339 VanDerWaalsContact O-N 3.09Å; I337-K340 HydrophobicContact CD1-CD 4.46Å; I337-K340 PolarHBondContact O-N 2.96Å
338	P	93.8	Very high	95.8	Very high	69 Å²	69	26.8 Å²	26.8	45%	0.448	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-17.5	-174	30	-38.1	0	0	0	113.8	Q329 E333 G336 K340	Q329-P338 PolarHBondContact NE2-O 2.92Å; Q329-P338 VanDerWaalsContact NE2-O 3.09Å; E333-P338 HydrophobicContact CG-CB 3.99Å; G336-P338 VanDerWaalsContact C-CD 3.41Å; P338-K340 VanDerWaalsContact C-N 3.26Å; P338-K340 PolarHBondContact O-N 3.16Å
339	N	94.6	Very high	95.9	Very high	106 Å²	106	26.7 Å²	26.7	57%	0.567	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.8	14.1	-176.3	68.1	-37.2	0	0	0	114.2	I337	I337-N339 PolarHBondContact O-N 2.94Å; I337-N339 VanDerWaalsContact O-N 3.09Å
340	K	96.9	Very high	96	Very high	26 Å²	26	27 Å²	27	11%	0.113	16%	0.158	C	C	.	.			trans	-126.1	163.1	178.2	-62.3	-164.6	-175.3	-160.8	0	111	N166 L196 F197 T198 Q329 L332 I337 P338	N166-K340 PolarHBondContact ND2-NZ 2.61Å; N166-K340 VanDerWaalsContact ND2-NZ 3.11Å; N166-K340 PolarHBondContact OD1-NZ 3.29Å; L196-K340 HydrophobicContact CB-CD 4.27Å; F197-K340 VanDerWaalsContact O-CA 3.31Å; F197-K340 WeakPolarHBondContact O-CA 3.31Å; F197-K340 WeakPolarHBondContact O-CB 3.43Å; T198-K340 HydrophobicContact CG2-CD 4.45Å; T198-K340 HydrophobicContact CG2-CG 4.45Å; Q329-K340 PolarHBondContact NE2-O 3.15Å; Q329-K340 PolarHBondContact OE1-O 2.67Å; L332-K340 WeakPolarHBondContact CD1-O 3.25Å; I337-K340 HydrophobicContact CD1-CD 4.46Å; I337-K340 PolarHBondContact O-N 2.96Å; P338-K340 VanDerWaalsContact C-N 3.26Å; P338-K340 PolarHBondContact O-N 3.16Å
341	V	98.2	Very high	96.1	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	164.5	169.3	-65.6	0	0	0	0	108.6	L196 F197 L202 L215 L216 T253 L257	L196-V341 CarbonylContact C-O 3.51Å; L196-V341 VanDerWaalsContact CA-O 3.29Å; L196-V341 WeakPolarHBondContact CA-O 3.23Å; F197-V341 HydrophobicContact CB-CG2 4.44Å; F197-V341 PolarHBondContact N-O 3.22Å; F197-V341 PolarHBondContact O-N 2.8Å; F197-V341 VanDerWaalsContact O-N 3.16Å; L202-V341 HydrophobicContact CD2-CG2 4Å; L215-V341 HydrophobicContact CB-CG1 4.03Å; L215-V341 HydrophobicContact CD1-CG1 4.22Å; L215-V341 HydrophobicContact CD1-CG2 4.09Å; L215-V341 HydrophobicContact CD2-CG1 4.47Å; L215-V341 HydrophobicContact CD2-CG2 3.66Å; L215-V341 HydrophobicContact CG-CG1 4.49Å; L215-V341 HydrophobicContact CG-CG2 4.37Å; L216-V341 HydrophobicContact CD2-CG1 4.09Å; T253-V341 HydrophobicContact CG2-CB 4.19Å; T253-V341 HydrophobicContact CG2-CG1 3.97Å; T253-V341 HydrophobicContact CG2-CG2 3.88Å; L257-V341 HydrophobicContact CD1-CB 3.88Å; L257-V341 HydrophobicContact CD1-CG2 3.8Å; L257-V341 HydrophobicContact CD2-CG2 4.22Å; L257-V341 HydrophobicContact CG-CG2 4.37Å
342	G	97.8	Very high	96.2	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-168.5	174.3	-179.8	0	0	0	0	0	114.4	R195 M327	R195-G342 CarbonylContact O-C 3.54Å; R195-G342 WeakPolarHBondContact O-CA 3.33Å; M327-G342 PolarHBondContact N-O 2.63Å
343	Y	98.5	Very high	96.2	Very high	3 Å²	3	29.6 Å²	29.6	1%	0.012	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	156.3	171.3	58.8	-110.2	0	0	0	110.7	R195 F197 L257 E260 L261 G325	R195-Y343 HydrophobicContact CB-CD2 4.07Å; R195-Y343 HydrophobicContact CB-CE1 4.13Å; R195-Y343 HydrophobicContact CB-CE2 3.49Å; R195-Y343 VanDerWaalsContact CB-CE2 3.49Å; R195-Y343 HydrophobicContact CG-CE1 4.3Å; R195-Y343 HydrophobicContact CG-CE2 4.36Å; R195-Y343 PolarHBondContact N-O 2.92Å; R195-Y343 PolarHBondContact O-N 3.21Å; F197-Y343 AromaticContact CE2-CD1 3.82Å; F197-Y343 HydrophobicContact CE2-CD1 3.82Å; F197-Y343 AromaticContact CE2-CE1 3.5Å; F197-Y343 HydrophobicContact CE2-CE1 3.5Å; F197-Y343 VanDerWaalsContact CE2-CE1 3.5Å; F197-Y343 HydrophobicContact CZ-CD1 4.37Å; F197-Y343 AromaticContact CZ-CE1 3.6Å; F197-Y343 HydrophobicContact CZ-CE1 3.6Å; L257-Y343 HydrophobicContact CD2-CD1 4.23Å; E260-Y343 HydrophobicContact CB-CE1 4.14Å; E260-Y343 HydrophobicContact CG-CE1 3.92Å; E260-Y343 PolarHBondContact OE1-OH 2.72Å; E260-Y343 VanDerWaalsContact OE1-OH 3.11Å; L261-Y343 HydrophobicContact CB-CD1 3.92Å; L261-Y343 HydrophobicContact CB-CD2 4.3Å; L261-Y343 HydrophobicContact CB-CE1 4.39Å; L261-Y343 HydrophobicContact CB-CG 3.88Å; L261-Y343 HydrophobicContact CD1-CD2 3.5Å; L261-Y343 HydrophobicContact CD1-CE2 4.05Å; L261-Y343 HydrophobicContact CD1-CG 3.83Å; L261-Y343 HydrophobicContact CG-CD2 4.41Å; L261-Y343 HydrophobicContact CG-CG 4.27Å; G325-Y343 WeakPolarHBondContact O-CA 3.38Å; G325-Y343 WeakPolarHBondContact O-CB 3.34Å
344	A	98.7	Very high	96.2	Very high	2 Å²	2	25.4 Å²	25.4	2%	0.017	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	152.6	172.6	0	0	0	0	0	110.6	G193 V194 C324 G325 M327	G193-A344 CarbonylContact O-C 3.5Å; G193-A344 VanDerWaalsContact O-CA 3.25Å; G193-A344 WeakPolarHBondContact O-CA 3.49Å; V194-A344 HydrophobicContact CG2-CB 4.05Å; C324-A344 CarbonylContact C-O 3.58Å; C324-A344 VanDerWaalsContact CA-O 3.26Å; C324-A344 WeakPolarHBondContact CA-O 3.26Å; C324-A344 WeakPolarHBondContact CB-O 3.45Å; G325-A344 PolarHBondContact N-O 3.34Å; G325-A344 PolarHBondContact O-N 3.27Å; M327-A344 HydrophobicContact CG-CB 3.84Å; M327-A344 HydrophobicContact SD-CB 4.12Å
345	F	98.8	Very high	96.3	Very high	2 Å²	2	22.1 Å²	22.1	1%	0.009	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	149.4	169.3	62.1	-95.8	0	0	0	110.4	M88 L169 L191 E192 G193 L261 L265 M268 G323 C324 L347	M88-F345 HydrophobicContact CE-CE1 4.33Å; M88-F345 HydrophobicContact CE-CZ 4.14Å; M88-F345 HydrophobicContact SD-CZ 4.49Å; L169-F345 HydrophobicContact CD2-CZ 4.25Å; L191-F345 HydrophobicContact CD2-CE2 4.05Å; E192-F345 CarbonylContact C-O 3.56Å; E192-F345 VanDerWaalsContact CA-O 3.3Å; E192-F345 WeakPolarHBondContact CA-O 3.22Å; G193-F345 PolarHBondContact N-O 3.43Å; G193-F345 PolarHBondContact O-N 3.3Å; L261-F345 HydrophobicContact CD1-CD1 4.24Å; L265-F345 HydrophobicContact CD1-CB 4.16Å; L265-F345 HydrophobicContact CD2-CB 4.11Å; L265-F345 HydrophobicContact CD2-CD1 3.85Å; L265-F345 HydrophobicContact CD2-CD2 3.93Å; L265-F345 HydrophobicContact CD2-CE1 4.18Å; L265-F345 HydrophobicContact CD2-CE2 4.27Å; L265-F345 HydrophobicContact CD2-CG 3.7Å; L265-F345 HydrophobicContact CD2-CZ 4.37Å; M268-F345 HydrophobicContact CE-CE2 4.41Å; G323-F345 CarbonylContact O-C 3.54Å; G323-F345 WeakPolarHBondContact O-CA 3.23Å; C324-F345 HydrophobicContact CB-CB 3.61Å; F345-L347 HydrophobicContact CD2-CD2 4.43Å; F345-L347 HydrophobicContact CE2-CD2 4.3Å
346	G	98.6	Very high	96.3	Very high	14 Å²	14	22.3 Å²	22.3	14%	0.144	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	126.4	174.1	0	0	0	0	0	109.5	L191 L322 G323	L191-G346 WeakPolarHBondContact O-CA 3.41Å; L322-G346 WeakPolarHBondContact CA-O 3.17Å; L322-G346 WeakPolarHBondContact CB-O 3.29Å; G323-G346 PolarHBondContact N-O 3.35Å; G323-G346 PolarHBondContact O-N 3Å
347	L	98	Very high	96.4	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	144.8	-179.7	66.9	88.8	0	0	0	111.6	I84 Q190 L191 M268 L322 F345 L349 W352	I84-L347 HydrophobicContact CD1-CD1 3.77Å; I84-L347 HydrophobicContact CD1-CD2 3.91Å; Q190-L347 CarbonylContact C-O 3.53Å; Q190-L347 WeakPolarHBondContact CA-O 3.44Å; L191-L347 HydrophobicContact CB-CD1 3.91Å; L191-L347 HydrophobicContact CB-CG 4Å; L191-L347 HydrophobicContact CD2-CD2 4.22Å; L191-L347 PolarHBondContact N-O 3.03Å; L191-L347 PolarHBondContact O-N 3.4Å; M268-L347 HydrophobicContact CE-CD2 3.63Å; M268-L347 HydrophobicContact SD-CD2 4.41Å; L322-L347 HydrophobicContact CB-CB 3.68Å; F345-L347 HydrophobicContact CD2-CD2 4.43Å; F345-L347 HydrophobicContact CE2-CD2 4.3Å; L347-L349 HydrophobicContact CD1-CD2 3.69Å; L347-L349 HydrophobicContact CD1-CG 4.39Å; L347-W352 HydrophobicContact CD1-CG 4.32Å; L347-W352 HydrophobicContact CD2-CZ2 4.22Å
348	G	97.5	Very high	96.3	Very high	18 Å²	18	23.8 Å²	23.8	19%	0.186	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	115.3	174.7	0	0	0	0	0	111.3	E350 R351 W352	G348-E350 VanDerWaalsContact C-N 3.34Å; G348-E350 PolarHBondContact O-N 2.81Å; G348-R351 PolarHBondContact O-N 2.74Å; G348-W352 VanDerWaalsContact O-CD1 3.23Å; G348-W352 PolarHBondContact O-N 3.14Å; G348-W352 VanDerWaalsContact O-N 3.15Å
349	L	98.4	Very high	96.2	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-63.7	-38.7	-175.8	-68.9	179.1	0	0	0	112.2	H70 L77 I80 K81 I84 H189 L191 L347 W352 A353	H70-L349 HydrophobicContact CB-CD1 4.26Å; L77-L349 HydrophobicContact CD2-CB 4Å; I80-L349 HydrophobicContact CB-CD2 4.38Å; I80-L349 HydrophobicContact CG2-CD2 3.7Å; K81-L349 HydrophobicContact CB-CD1 4.46Å; I84-L349 HydrophobicContact CD1-CD2 4.19Å; H189-L349 HydrophobicContact CB-CB 4.15Å; H189-L349 HydrophobicContact CB-CD1 3.83Å; H189-L349 HydrophobicContact CB-CG 4.33Å; H189-L349 PolarHBondContact O-N 3.02Å; L191-L349 HydrophobicContact CB-CD2 4.04Å; L191-L349 HydrophobicContact CB-CG 4.43Å; L347-L349 HydrophobicContact CD1-CD2 3.69Å; L347-L349 HydrophobicContact CD1-CG 4.39Å; L349-W352 PolarHBondContact O-N 2.95Å; L349-A353 VanDerWaalsContact O-CB 3.27Å; L349-A353 WeakPolarHBondContact O-CB 3.22Å; L349-A353 PolarHBondContact O-N 2.76Å
350	E	97.6	Very high	95.9	Very high	5 Å²	5	18 Å²	18	2%	0.023	9%	0.093	C	C	.	.	H	α-helix	trans	-60.4	-47.9	176.2	-74.3	77.9	177.5	0	0	110.2	L77 F188 H189 G348 W352 A353 M354 I362 F365	L77-E350 HydrophobicContact CD1-CG 4.31Å; L77-E350 WeakPolarHBondContact CD1-OE1 3.36Å; L77-E350 HydrophobicContact CD2-CB 4.47Å; L77-E350 HydrophobicContact CD2-CG 3.96Å; F188-E350 VanDerWaalsContact CA-OE1 3.25Å; F188-E350 WeakPolarHBondContact CA-OE1 3.26Å; F188-E350 HydrophobicContact CB-CG 4.39Å; H189-E350 IonicContact CE1-OE1 2.61Å; H189-E350 IonicContact CG-OE1 2.64Å; H189-E350 PolarHBondContact N-OE1 2.86Å; H189-E350 PolarHBondContact N-OE2 2.91Å; H189-E350 IonicContact ND1-OE1 3.63Å; H189-E350 PolarHBondContact ND1-OE1 2.77Å; G348-E350 VanDerWaalsContact C-N 3.34Å; G348-E350 PolarHBondContact O-N 2.81Å; E350-W352 VanDerWaalsContact C-N 3.28Å; E350-W352 PolarHBondContact O-N 2.67Å; E350-A353 PolarHBondContact O-N 2.79Å; E350-A353 VanDerWaalsContact O-N 3.12Å; E350-M354 HydrophobicContact CB-SD 4.44Å; E350-M354 WeakPolarHBondContact O-CB 3.35Å; E350-M354 WeakPolarHBondContact O-CG 3.46Å; E350-M354 PolarHBondContact O-N 3.27Å; E350-I362 HydrophobicContact CB-CD1 4.05Å; E350-I362 HydrophobicContact CB-CG1 4.25Å; E350-I362 HydrophobicContact CG-CD1 3.93Å; E350-I362 HydrophobicContact CG-CG1 3.91Å; E350-F365 HydrophobicContact CB-CD2 4.26Å; E350-F365 HydrophobicContact CB-CE2 3.86Å; E350-F365 HydrophobicContact CG-CD2 3.65Å; E350-F365 HydrophobicContact CG-CE2 3.76Å; E350-F365 HydrophobicContact CG-CG 4.37Å
351	R	95	Very high	95.6	Very high	92 Å²	92	17.2 Å²	17.2	35%	0.347	9%	0.09	S	C	.	.	H	α-helix	trans	-63.3	-37.7	-178.4	-161.9	171.7	-71.8	174.3	-2.1	111.8	T319 E320 G348 R355	T319-R351 HydrophobicContact CG2-CG 4.08Å; E320-R351 WeakPolarHBondContact O-CD 3.35Å; E320-R351 PolarHBondContact O-NH1 3.05Å; E320-R351 IonicContact OE1-NH1 3.92Å; E320-R351 IonicContact OE2-NH1 2.63Å; E320-R351 PolarHBondContact OE2-NH1 3.3Å; G348-R351 PolarHBondContact O-N 2.74Å; R351-R355 VanDerWaalsContact O-CG 3.25Å; R351-R355 WeakPolarHBondContact O-CG 3.23Å; R351-R355 PolarHBondContact O-N 3.06Å
352	W	96.3	Very high	95.4	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-65.5	-48.1	171.4	-80.8	65.3	0	0	0	112.2	I80 M268 A269 L272 F273 I321 L322 L347 G348 L349 E350 R355 L356	I80-W352 HydrophobicContact CG2-CB 4.1Å; M268-W352 HydrophobicContact CE-CH2 3.85Å; M268-W352 HydrophobicContact CE-CZ2 3.93Å; M268-W352 HydrophobicContact CG-CH2 4.11Å; A269-W352 HydrophobicContact CB-CH2 4.19Å; L272-W352 HydrophobicContact CB-CE3 4.37Å; L272-W352 HydrophobicContact CB-CZ3 3.96Å; L272-W352 HydrophobicContact CD1-CZ3 4.49Å; L272-W352 HydrophobicContact CD2-CE3 3.64Å; L272-W352 HydrophobicContact CD2-CZ3 3.67Å; L272-W352 HydrophobicContact CG-CZ3 4.23Å; F273-W352 HydrophobicContact CD2-CE3 4.39Å; F273-W352 HydrophobicContact CD2-CZ3 4.19Å; F273-W352 AromaticContact CE2-CD2 3.99Å; F273-W352 HydrophobicContact CE2-CD2 3.99Å; F273-W352 AromaticContact CE2-CE3 3.44Å; F273-W352 HydrophobicContact CE2-CE3 3.44Å; F273-W352 VanDerWaalsContact CE2-CE3 3.44Å; F273-W352 HydrophobicContact CE2-CH2 4.28Å; F273-W352 AromaticContact CE2-CZ3 3.61Å; F273-W352 HydrophobicContact CE2-CZ3 3.61Å; F273-W352 HydrophobicContact CZ-CD2 4.25Å; F273-W352 AromaticContact CZ-CE3 3.91Å; F273-W352 HydrophobicContact CZ-CE3 3.91Å; F273-W352 HydrophobicContact CZ-CZ3 4.5Å; I321-W352 HydrophobicContact CD1-CH2 4.33Å; I321-W352 HydrophobicContact CD1-CZ2 3.75Å; I321-W352 PolarHBondContact O-NE1 2.62Å; L322-W352 HydrophobicContact CD2-CZ2 4.08Å; L347-W352 HydrophobicContact CD1-CG 4.32Å; L347-W352 HydrophobicContact CD2-CZ2 4.22Å; G348-W352 VanDerWaalsContact O-CD1 3.23Å; G348-W352 PolarHBondContact O-N 3.14Å; G348-W352 VanDerWaalsContact O-N 3.15Å; L349-W352 PolarHBondContact O-N 2.95Å; E350-W352 VanDerWaalsContact C-N 3.28Å; E350-W352 PolarHBondContact O-N 2.67Å; W352-R355 PolarHBondContact O-N 3.27Å; W352-L356 WeakPolarHBondContact O-CB 3.3Å; W352-L356 PolarHBondContact O-N 2.85Å
353	A	96.4	Very high	95.2	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-63.1	-44.4	-178.8	0	0	0	0	0	112	L77 I80 L349 E350 R355 L356 Y357 F365	L77-A353 HydrophobicContact CD2-CB 3.97Å; I80-A353 HydrophobicContact CG1-CB 3.89Å; L349-A353 VanDerWaalsContact O-CB 3.27Å; L349-A353 WeakPolarHBondContact O-CB 3.22Å; L349-A353 PolarHBondContact O-N 2.76Å; E350-A353 PolarHBondContact O-N 2.79Å; E350-A353 VanDerWaalsContact O-N 3.12Å; A353-R355 VanDerWaalsContact C-N 3.33Å; A353-R355 PolarHBondContact O-N 3.05Å; A353-L356 PolarHBondContact O-N 2.81Å; A353-Y357 HydrophobicContact CB-CD2 3.93Å; A353-Y357 HydrophobicContact CB-CE2 4.15Å; A353-Y357 WeakPolarHBondContact O-CA 3.49Å; A353-Y357 VanDerWaalsContact O-CB 3.26Å; A353-Y357 WeakPolarHBondContact O-CB 3.3Å; A353-Y357 WeakPolarHBondContact O-CD2 3.29Å; A353-Y357 PolarHBondContact O-N 3.25Å; A353-F365 HydrophobicContact CB-CE1 3.72Å; A353-F365 HydrophobicContact CB-CZ 3.58Å
354	M	94.3	Very high	95	Very high	7 Å²	7	17.6 Å²	17.6	3%	0.034	9%	0.092	C	C	.	.	H	α-helix	trans	-62.3	-40.7	179	-66.7	169.2	80.2	0	0	111.4	S182 L183 Y303 E350 E358 I359 I362 F365	S182-M354 WeakPolarHBondContact O-CE 3.45Å; L183-M354 HydrophobicContact CD2-CE 3.77Å; Y303-M354 HydrophobicContact CD1-CE 4Å; Y303-M354 HydrophobicContact CE1-CB 3.94Å; Y303-M354 HydrophobicContact CE1-CE 3.51Å; Y303-M354 WeakPolarHBondContact OH-CB 3.35Å; E350-M354 HydrophobicContact CB-SD 4.44Å; E350-M354 WeakPolarHBondContact O-CB 3.35Å; E350-M354 WeakPolarHBondContact O-CG 3.46Å; E350-M354 PolarHBondContact O-N 3.27Å; M354-E358 CarbonylContact O-C 3.59Å; M354-E358 WeakPolarHBondContact O-CA 3.47Å; M354-E358 PolarHBondContact O-N 3.41Å; M354-I359 HydrophobicContact CB-CB 4.49Å; M354-I359 WeakPolarHBondContact CB-O 3.41Å; M354-I359 HydrophobicContact CG-CB 4.23Å; M354-I359 HydrophobicContact CG-CG2 4.49Å; M354-I359 WeakPolarHBondContact CG-O 3.27Å; M354-I359 PolarHBondContact O-N 3.06Å; M354-I359 VanDerWaalsContact O-N 3.11Å; M354-I362 HydrophobicContact CE-CB 4.36Å; M354-I362 HydrophobicContact SD-CB 4.22Å; M354-F365 HydrophobicContact CG-CE2 3.46Å; M354-F365 VanDerWaalsContact CG-CE2 3.46Å; M354-F365 HydrophobicContact CG-CZ 3.65Å; M354-F365 HydrophobicContact SD-CE2 4.02Å
355	R	92.8	Very high	94.9	Very high	21 Å²	21	17.5 Å²	17.5	8%	0.079	9%	0.091	C	C	.	.	H	α-helix	trans	-72	-41.1	175.1	-66.3	-61.4	-173.2	-168.3	-7.3	113	F273 I297 T299 Y303 E317 T319 R351 W352 A353	F273-R355 HydrophobicContact CE1-CB 3.71Å; F273-R355 HydrophobicContact CZ-CB 4.1Å; I297-R355 HydrophobicContact CD1-CB 4.12Å; I297-R355 HydrophobicContact CD1-CG 4.19Å; T299-R355 WeakPolarHBondContact OG1-CD 3.03Å; T299-R355 PolarHBondContact OG1-NE 3.23Å; T299-R355 PolarHBondContact OG1-NH1 3.17Å; Y303-R355 VanDerWaalsContact CD2-NH2 3.26Å; Y303-R355 WeakPolarHBondContact OH-CD 3.25Å; Y303-R355 PolarHBondContact OH-N 3.01Å; Y303-R355 PolarHBondContact OH-NE 2.83Å; E317-R355 IonicContact OE1-CZ 3.11Å; E317-R355 IonicContact OE1-NH1 3.14Å; E317-R355 PolarHBondContact OE1-NH1 3.19Å; E317-R355 IonicContact OE1-NH2 3.02Å; E317-R355 PolarHBondContact OE1-NH2 2.9Å; T319-R355 PolarHBondContact OG1-NH2 2.93Å; R351-R355 VanDerWaalsContact O-CG 3.25Å; R351-R355 WeakPolarHBondContact O-CG 3.23Å; R351-R355 PolarHBondContact O-N 3.06Å; W352-R355 PolarHBondContact O-N 3.27Å; A353-R355 VanDerWaalsContact C-N 3.33Å; A353-R355 PolarHBondContact O-N 3.05Å
356	L	93.5	Very high	94.7	Very high	17 Å²	17	17.8 Å²	17.8	9%	0.089	9%	0.092	C	C	.	.	H	α-helix	trans	-73.4	-47.1	-174.6	-173.9	60.1	0	0	0	111.1	I80 L272 F273 W352 A353 K386	I80-L356 HydrophobicContact CD1-CB 4.29Å; I80-L356 HydrophobicContact CD1-CD2 3.3Å; I80-L356 HydrophobicContact CD1-CG 4.38Å; L272-L356 HydrophobicContact CB-CD2 4.46Å; L272-L356 WeakPolarHBondContact O-CD1 3.38Å; F273-L356 HydrophobicContact CD1-CB 4.35Å; F273-L356 HydrophobicContact CD1-CD1 3.82Å; F273-L356 HydrophobicContact CE1-CB 3.79Å; F273-L356 HydrophobicContact CE1-CD1 4.12Å; F273-L356 HydrophobicContact CG-CD1 4.49Å; F273-L356 HydrophobicContact CZ-CB 4.45Å; W352-L356 WeakPolarHBondContact O-CB 3.3Å; W352-L356 PolarHBondContact O-N 2.85Å; A353-L356 PolarHBondContact O-N 2.81Å; L356-K386 PolarHBondContact O-NZ 3.12Å
357	Y	94.4	Very high	94.3	Very high	1 Å²	1	17.5 Å²	17.5	0%	0.004	9%	0.088	C	C	.	.	H	α-helix	trans	-95.3	-2.2	-175.7	-52.9	-45.5	0	0	0	113.7	P76 L79 I80 A353 I359 F376 I385 Y387	P76-Y357 HydrophobicContact CB-CD2 3.89Å; P76-Y357 HydrophobicContact CB-CE2 3.78Å; L79-Y357 WeakPolarHBondContact CB-OH 3.2Å; I80-Y357 HydrophobicContact CD1-CE2 3.69Å; I80-Y357 WeakPolarHBondContact CD1-OH 3.41Å; I80-Y357 HydrophobicContact CG1-CE2 3.71Å; A353-Y357 HydrophobicContact CB-CD2 3.93Å; A353-Y357 HydrophobicContact CB-CE2 4.15Å; A353-Y357 WeakPolarHBondContact O-CA 3.49Å; A353-Y357 VanDerWaalsContact O-CB 3.26Å; A353-Y357 WeakPolarHBondContact O-CB 3.3Å; A353-Y357 WeakPolarHBondContact O-CD2 3.29Å; A353-Y357 PolarHBondContact O-N 3.25Å; Y357-I359 VanDerWaalsContact C-N 3.34Å; Y357-I359 HydrophobicContact CD2-CD1 4.21Å; Y357-I359 PolarHBondContact O-N 2.85Å; Y357-F376 HydrophobicContact CD1-CE1 4.34Å; Y357-F376 HydrophobicContact CD2-CD1 4.47Å; Y357-F376 AromaticContact CD2-CE1 3.78Å; Y357-F376 HydrophobicContact CD2-CE1 3.78Å; Y357-F376 HydrophobicContact CE2-CE1 4.33Å; Y357-F376 AromaticContact CG-CE1 3.79Å; Y357-F376 HydrophobicContact CG-CE1 3.79Å; Y357-I385 HydrophobicContact CD1-CB 4.11Å; Y357-I385 WeakPolarHBondContact CD1-O 3.5Å; Y357-I385 HydrophobicContact CE1-CB 4.27Å; Y357-Y387 VanDerWaalsContact O-CB 3.26Å; Y357-Y387 WeakPolarHBondContact O-CB 3.46Å; Y357-Y387 PolarHBondContact O-N 3.28Å
358	E	91.5	Very high	93.9	Very high	117 Å²	117	24.9 Å²	24.9	55%	0.547	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.3	40.7	-178.4	-62.3	172.5	-156	0	0	113.1	M354 P360 K386	M354-E358 CarbonylContact O-C 3.59Å; M354-E358 WeakPolarHBondContact O-CA 3.47Å; M354-E358 PolarHBondContact O-N 3.41Å; E358-P360 WeakPolarHBondContact O-CD 3.4Å; E358-K386 HydrophobicContact CG-CD 4.05Å; E358-K386 WeakPolarHBondContact OE1-CD 3.39Å; E358-K386 WeakPolarHBondContact OE1-CE 3.31Å; E358-K386 IonicContact OE1-NZ 3.82Å; E358-K386 PolarHBondContact OE1-NZ 3.16Å
359	I	91.8	Very high	93.4	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	12%	0.123	C	C	.	.			trans	-82.1	117.4	174.8	-59.9	165.8	0	0	0	107.8	P76 M354 Y357 D361 L364 F365 F372 F376 Y387	P76-I359 HydrophobicContact CB-CD1 4.33Å; P76-I359 HydrophobicContact CG-CD1 4.47Å; M354-I359 HydrophobicContact CB-CB 4.49Å; M354-I359 WeakPolarHBondContact CB-O 3.41Å; M354-I359 HydrophobicContact CG-CB 4.23Å; M354-I359 HydrophobicContact CG-CG2 4.49Å; M354-I359 WeakPolarHBondContact CG-O 3.27Å; M354-I359 PolarHBondContact O-N 3.06Å; M354-I359 VanDerWaalsContact O-N 3.11Å; Y357-I359 VanDerWaalsContact C-N 3.34Å; Y357-I359 HydrophobicContact CD2-CD1 4.21Å; Y357-I359 PolarHBondContact O-N 2.85Å; I359-D361 PolarHBondContact O-N 2.85Å; I359-L364 HydrophobicContact CG2-CB 3.93Å; I359-L364 HydrophobicContact CG2-CD1 3.73Å; I359-L364 HydrophobicContact CG2-CG 4.46Å; I359-F365 HydrophobicContact CB-CZ 4.34Å; I359-F365 HydrophobicContact CD1-CD1 4.32Å; I359-F365 HydrophobicContact CD1-CE1 3.37Å; I359-F365 HydrophobicContact CD1-CZ 3.58Å; I359-F365 HydrophobicContact CG2-CE2 4.44Å; I359-F365 HydrophobicContact CG2-CZ 4.24Å; I359-F372 HydrophobicContact CD1-CE2 4.19Å; I359-F372 HydrophobicContact CD1-CZ 4.25Å; I359-F372 HydrophobicContact CG1-CE2 4.41Å; I359-F372 HydrophobicContact CG2-CE2 4.43Å; I359-F376 HydrophobicContact CD1-CE1 4.37Å; I359-F376 HydrophobicContact CD1-CZ 3.76Å; I359-F376 HydrophobicContact CG1-CZ 4.2Å; I359-Y387 HydrophobicContact CG1-CD1 4.41Å; I359-Y387 HydrophobicContact CG1-CG 4.21Å
360	P	88.8	Confident	92.9	Very high	53 Å²	53	31.5 Å²	31.5	34%	0.344	15%	0.148	S	C	.	.			trans	-80.2	-17.4	-169.6	31.5	-37.3	0	0	0	114.2	E358 L364 Y387	E358-P360 WeakPolarHBondContact O-CD 3.4Å; P360-L364 HydrophobicContact CG-CD1 4.14Å; P360-Y387 HydrophobicContact CG-CE1 4.45Å
361	D	90.5	Very high	92.5	Very high	9 Å²	9	32.7 Å²	32.7	5%	0.048	16%	0.161	C	C	.	.			trans	-144.1	128	-171	-168	-54.7	0	0	0	110.8	I359 R363 L364	I359-D361 PolarHBondContact O-N 2.85Å; D361-R363 PolarHBondContact O-N 2.9Å; D361-R363 WeakPolarHBondContact OD1-CB 3.09Å; D361-R363 WeakPolarHBondContact OD1-CG 3.11Å; D361-R363 IonicContact OD1-CZ 2.79Å; D361-R363 PolarHBondContact OD1-N 3.29Å; D361-R363 IonicContact OD1-NE 2.75Å; D361-R363 PolarHBondContact OD1-NE 3.34Å; D361-R363 IonicContact OD1-NH2 3.89Å; D361-R363 IonicContact OD2-CZ 3.61Å; D361-R363 IonicContact OD2-NE 3.94Å; D361-R363 PolarHBondContact OD2-NE 3.11Å; D361-R363 VanDerWaalsContact OD2-NE 3.11Å; D361-R363 IonicContact OD2-NH2 3.94Å; D361-R363 PolarHBondContact OD2-NH2 3.17Å; D361-L364 HydrophobicContact CB-CD1 4.41Å; D361-L364 WeakPolarHBondContact O-CB 3.34Å; D361-L364 PolarHBondContact O-N 2.86Å; D361-L364 VanDerWaalsContact O-N 3.15Å
362	I	94.7	Very high	92.3	Very high	6 Å²	6	28.4 Å²	28.4	3%	0.031	15%	0.145	C	C	.	.	G	3₁₀ helix	trans	-60.8	-27.1	-178.7	-165.1	166.6	0	0	0	113	S182 L183 Y185 F188 E350 M354 L364 F365	S182-I362 WeakPolarHBondContact O-CB 3.31Å; S182-I362 WeakPolarHBondContact O-CG2 3.1Å; S182-I362 PolarHBondContact O-N 3.33Å; L183-I362 WeakPolarHBondContact O-CD1 3.44Å; Y185-I362 HydrophobicContact CD2-CG2 4.2Å; Y185-I362 HydrophobicContact CG-CG2 4.48Å; F188-I362 HydrophobicContact CB-CD1 4.49Å; E350-I362 HydrophobicContact CB-CD1 4.05Å; E350-I362 HydrophobicContact CB-CG1 4.25Å; E350-I362 HydrophobicContact CG-CD1 3.93Å; E350-I362 HydrophobicContact CG-CG1 3.91Å; M354-I362 HydrophobicContact CE-CB 4.36Å; M354-I362 HydrophobicContact SD-CB 4.22Å; I362-L364 PolarHBondContact O-N 3.24Å; I362-F365 HydrophobicContact CG1-CD2 4Å; I362-F365 HydrophobicContact CG1-CE2 4.41Å; I362-F365 VanDerWaalsContact O-CD2 3.25Å; I362-F365 WeakPolarHBondContact O-CD2 3.35Å; I362-F365 PolarHBondContact O-N 3.17Å
363	R	93	Very high	92.2	Very high	3 Å²	3	30.4 Å²	30.4	1%	0.011	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	-62.8	-25	177.9	-60.3	176.3	-67.7	155	-2.4	112.1	Y185 D361 F365 W366 S367 D440 I442 E443 R468	Y185-R363 HydrophobicContact CD2-CG 4.01Å; Y185-R363 HydrophobicContact CE2-CB 4.44Å; Y185-R363 HydrophobicContact CE2-CG 3.88Å; D361-R363 PolarHBondContact O-N 2.9Å; D361-R363 WeakPolarHBondContact OD1-CB 3.09Å; D361-R363 WeakPolarHBondContact OD1-CG 3.11Å; D361-R363 IonicContact OD1-CZ 2.79Å; D361-R363 PolarHBondContact OD1-N 3.29Å; D361-R363 IonicContact OD1-NE 2.75Å; D361-R363 PolarHBondContact OD1-NE 3.34Å; D361-R363 IonicContact OD1-NH2 3.89Å; D361-R363 IonicContact OD2-CZ 3.61Å; D361-R363 IonicContact OD2-NE 3.94Å; D361-R363 PolarHBondContact OD2-NE 3.11Å; D361-R363 VanDerWaalsContact OD2-NE 3.11Å; D361-R363 IonicContact OD2-NH2 3.94Å; D361-R363 PolarHBondContact OD2-NH2 3.17Å; R363-F365 PolarHBondContact O-N 3.24Å; R363-W366 PolarHBondContact O-N 3.39Å; R363-S367 PolarHBondContact O-N 3.15Å; R363-D440 PolarHBondContact NH1-O 3.37Å; R363-I442 PolarHBondContact NH1-O 3.06Å; R363-E443 VanDerWaalsContact CZ-CB 3.48Å; R363-E443 IonicContact CZ-OE1 3.34Å; R363-E443 VanDerWaalsContact NH2-CB 3.32Å; R363-E443 IonicContact NH2-OE1 2.68Å; R363-E443 PolarHBondContact NH2-OE1 3.29Å; R363-R468 PolarHBondContact NH1-O 3.37Å; R363-R468 VanDerWaalsContact NH1-O 3.09Å
364	L	94	Very high	92.1	Very high	2 Å²	2	34.5 Å²	34.5	1%	0.01	18%	0.177	C	C	.	.	G	3₁₀ helix	trans	-61.8	-32	178.1	-71.9	169	0	0	0	112.5	I359 P360 D361 I362 W366 S367 F372 Y387 Q470	I359-L364 HydrophobicContact CG2-CB 3.93Å; I359-L364 HydrophobicContact CG2-CD1 3.73Å; I359-L364 HydrophobicContact CG2-CG 4.46Å; P360-L364 HydrophobicContact CG-CD1 4.14Å; D361-L364 HydrophobicContact CB-CD1 4.41Å; D361-L364 WeakPolarHBondContact O-CB 3.34Å; D361-L364 PolarHBondContact O-N 2.86Å; D361-L364 VanDerWaalsContact O-N 3.15Å; I362-L364 PolarHBondContact O-N 3.24Å; L364-W366 PolarHBondContact O-N 2.86Å; L364-S367 WeakPolarHBondContact O-CB 3.14Å; L364-S367 PolarHBondContact O-N 3.34Å; L364-S367 VanDerWaalsContact O-N 3.17Å; L364-F372 HydrophobicContact CB-CD2 4.07Å; L364-F372 HydrophobicContact CB-CE2 3.73Å; L364-F372 HydrophobicContact CB-CZ 4.11Å; L364-F372 HydrophobicContact CD2-CD2 4.37Å; L364-F372 WeakPolarHBondContact O-CD1 3.06Å; L364-F372 WeakPolarHBondContact O-CE1 3.3Å; L364-F372 WeakPolarHBondContact O-CZ 3.45Å; L364-Y387 HydrophobicContact CD1-CD1 4.5Å; L364-Y387 HydrophobicContact CD1-CE1 3.69Å; L364-Q470 HydrophobicContact CD2-CB 4.1Å; L364-Q470 HydrophobicContact CD2-CG 4.02Å
365	F	96.6	Very high	92.1	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-62	-27.1	173.6	-62.6	-63.8	0	0	0	112.8	L69 H75 P76 L77 E350 A353 M354 I359 I362 R363 F372	L69-F365 HydrophobicContact CD1-CB 4.4Å; L69-F365 VanDerWaalsContact CD1-O 3.29Å; L69-F365 WeakPolarHBondContact CD1-O 3.44Å; H75-F365 PolarHBondContact NE2-O 3.14Å; P76-F365 HydrophobicContact CB-CD1 4.43Å; P76-F365 HydrophobicContact CB-CE1 4.04Å; P76-F365 HydrophobicContact CG-CD1 3.68Å; P76-F365 HydrophobicContact CG-CE1 3.76Å; L77-F365 HydrophobicContact CD1-CB 4.44Å; L77-F365 HydrophobicContact CD1-CD1 4.4Å; L77-F365 HydrophobicContact CD1-CG 4.42Å; L77-F365 HydrophobicContact CD2-CD1 3.91Å; L77-F365 HydrophobicContact CD2-CE1 3.79Å; L77-F365 HydrophobicContact CD2-CG 4.37Å; L77-F365 HydrophobicContact CD2-CZ 4.18Å; L77-F365 HydrophobicContact CG-CD1 3.93Å; L77-F365 HydrophobicContact CG-CE1 4.26Å; L77-F365 HydrophobicContact CG-CG 4.41Å; E350-F365 HydrophobicContact CB-CD2 4.26Å; E350-F365 HydrophobicContact CB-CE2 3.86Å; E350-F365 HydrophobicContact CG-CD2 3.65Å; E350-F365 HydrophobicContact CG-CE2 3.76Å; E350-F365 HydrophobicContact CG-CG 4.37Å; A353-F365 HydrophobicContact CB-CE1 3.72Å; A353-F365 HydrophobicContact CB-CZ 3.58Å; M354-F365 HydrophobicContact CG-CE2 3.46Å; M354-F365 VanDerWaalsContact CG-CE2 3.46Å; M354-F365 HydrophobicContact CG-CZ 3.65Å; M354-F365 HydrophobicContact SD-CE2 4.02Å; I359-F365 HydrophobicContact CB-CZ 4.34Å; I359-F365 HydrophobicContact CD1-CD1 4.32Å; I359-F365 HydrophobicContact CD1-CE1 3.37Å; I359-F365 HydrophobicContact CD1-CZ 3.58Å; I359-F365 HydrophobicContact CG2-CE2 4.44Å; I359-F365 HydrophobicContact CG2-CZ 4.24Å; I362-F365 HydrophobicContact CG1-CD2 4Å; I362-F365 HydrophobicContact CG1-CE2 4.41Å; I362-F365 VanDerWaalsContact O-CD2 3.25Å; I362-F365 WeakPolarHBondContact O-CD2 3.35Å; I362-F365 PolarHBondContact O-N 3.17Å; R363-F365 PolarHBondContact O-N 3.24Å; F365-F372 HydrophobicContact CD1-CZ 4.37Å
366	W	95.2	Very high	92.3	Very high	9 Å²	9	35.8 Å²	35.8	3%	0.034	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-92.7	-11	-179.1	-64	92.7	0	0	0	112.9	L64 R67 L69 Y185 V187 H189 R363 L364	L64-W366 HydrophobicContact CB-CH2 4.28Å; L64-W366 HydrophobicContact CB-CZ3 4.07Å; L64-W366 HydrophobicContact CD2-CD2 4.31Å; L64-W366 HydrophobicContact CD2-CE3 3.54Å; L64-W366 HydrophobicContact CD2-CH2 4.3Å; L64-W366 HydrophobicContact CD2-CZ3 3.52Å; L64-W366 HydrophobicContact CG-CZ3 4.33Å; R67-W366 HydrophobicContact CB-CZ3 3.79Å; R67-W366 HydrophobicContact CG-CE3 4.4Å; R67-W366 HydrophobicContact CG-CZ3 3.87Å; R67-W366 PolarHBondContact NH2-O 3.28Å; L69-W366 HydrophobicContact CD1-CD2 3.72Å; L69-W366 HydrophobicContact CD1-CE3 3.82Å; L69-W366 HydrophobicContact CD1-CG 4.32Å; L69-W366 HydrophobicContact CD1-CH2 4.07Å; L69-W366 HydrophobicContact CD1-CZ2 3.96Å; L69-W366 HydrophobicContact CD1-CZ3 4.01Å; L69-W366 HydrophobicContact CG-CE3 4.44Å; L69-W366 HydrophobicContact CG-CH2 4.38Å; L69-W366 HydrophobicContact CG-CZ3 4.26Å; Y185-W366 AromaticContact CD1-CD1 3.6Å; Y185-W366 HydrophobicContact CD1-CD2 4.27Å; Y185-W366 AromaticContact CD1-CE2 3.7Å; Y185-W366 HydrophobicContact CD1-CG 4.22Å; Y185-W366 HydrophobicContact CD1-CZ2 4.28Å; Y185-W366 AromaticContact CD1-NE1 3.22Å; Y185-W366 HydrophobicContact CE1-CB 4.45Å; Y185-W366 AromaticContact CE1-CD1 3.41Å; Y185-W366 VanDerWaalsContact CE1-CD1 3.41Å; Y185-W366 AromaticContact CE1-CD2 3.66Å; Y185-W366 HydrophobicContact CE1-CD2 3.66Å; Y185-W366 AromaticContact CE1-CE2 3.56Å; Y185-W366 HydrophobicContact CE1-CE3 4.45Å; Y185-W366 AromaticContact CE1-CG 3.6Å; Y185-W366 HydrophobicContact CE1-CG 3.6Å; Y185-W366 HydrophobicContact CE1-CZ2 4.29Å; Y185-W366 AromaticContact CE1-NE1 3.38Å; Y185-W366 HydrophobicContact CE2-CG 4.41Å; Y185-W366 AromaticContact CG-CD1 4Å; Y185-W366 AromaticContact CG-NE1 3.85Å; Y185-W366 AromaticContact CZ-CD1 3.64Å; Y185-W366 AromaticContact CZ-CG 3.7Å; V187-W366 HydrophobicContact CB-CH2 3.81Å; V187-W366 HydrophobicContact CB-CZ2 3.61Å; V187-W366 HydrophobicContact CG1-CH2 3.68Å; V187-W366 HydrophobicContact CG1-CZ2 3.74Å; V187-W366 WeakPolarHBondContact O-CZ2 3.46Å; H189-W366 AromaticContact CE1-CZ2 3.84Å; R363-W366 PolarHBondContact O-N 3.39Å; L364-W366 PolarHBondContact O-N 2.86Å
367	S	90.4	Very high	92.5	Very high	8 Å²	8	39.8 Å²	39.8	6%	0.056	21%	0.205	C	C	.	.			trans	-60.2	146.9	177	-176.7	0	0	0	0	112.4	R363 L364 D369 H471	R363-S367 PolarHBondContact O-N 3.15Å; L364-S367 WeakPolarHBondContact O-CB 3.14Å; L364-S367 PolarHBondContact O-N 3.34Å; L364-S367 VanDerWaalsContact O-N 3.17Å; S367-D369 VanDerWaalsContact OG-CB 3.27Å; S367-D369 WeakPolarHBondContact OG-CB 3.18Å; S367-D369 PolarHBondContact OG-N 2.94Å; S367-H471 PolarHBondContact OG-CE1 3.32Å; S367-H471 PolarHBondContact OG-NE2 2.93Å
368	K	89.5	Confident	92.6	Very high	155 Å²	155	41.1 Å²	41.1	67%	0.674	21%	0.213	S	C	*	.			trans	-100.9	5.5	171.5	-62.3	178	-176.3	173.3	0	112.1	Q370	K368-Q370 PolarHBondContact O-N 2.87Å; K368-Q370 PolarHBondContact O-NE2 2.98Å
369	D	87.8	Confident	92.7	Very high	47 Å²	47	43.6 Å²	43.6	25%	0.251	23%	0.23	S	C	.	.			trans	-67.8	127.3	-177.8	178.8	-96.7	0	0	0	111.7	S367 G371 F372 L373 H471	S367-D369 VanDerWaalsContact OG-CB 3.27Å; S367-D369 WeakPolarHBondContact OG-CB 3.18Å; S367-D369 PolarHBondContact OG-N 2.94Å; D369-G371 VanDerWaalsContact C-N 3.27Å; D369-G371 PolarHBondContact O-N 3.02Å; D369-G371 WeakPolarHBondContact OD1-CA 3.42Å; D369-G371 PolarHBondContact OD1-N 3.47Å; D369-F372 PolarHBondContact O-N 3.15Å; D369-F372 PolarHBondContact OD1-N 3.41Å; D369-L373 WeakPolarHBondContact O-CG 3.07Å; D369-L373 PolarHBondContact O-N 2.94Å; D369-H471 WeakPolarHBondContact CB-CE1 3.16Å; D369-H471 WeakPolarHBondContact CB-ND1 3.23Å; D369-H471 IonicContact OD2-ND1 3.14Å
370	Q	87.8	Confident	92.9	Very high	110 Å²	110	47.7 Å²	47.7	51%	0.514	25%	0.252	S	S	.	.	H	α-helix	trans	-71.4	-25.7	-178.7	-61.5	-58.2	-56.4	0	0	111.6	K368 F372 L373 N374	K368-Q370 PolarHBondContact O-N 2.87Å; K368-Q370 PolarHBondContact O-NE2 2.98Å; Q370-F372 VanDerWaalsContact C-N 3.33Å; Q370-F372 PolarHBondContact O-N 2.8Å; Q370-L373 PolarHBondContact O-N 3.06Å; Q370-N374 WeakPolarHBondContact O-CB 3.2Å; Q370-N374 PolarHBondContact O-N 2.82Å; Q370-N374 PolarHBondContact O-ND2 3.45Å; Q370-N374 VanDerWaalsContact O-ND2 3.1Å
371	G	87.4	Confident	93.3	Very high	30 Å²	30	47.1 Å²	47.1	31%	0.309	25%	0.245	S	C	.	.	H	α-helix	trans	-64.6	-35.1	173.8	0	0	0	0	0	112.9	D369 Q375	D369-G371 VanDerWaalsContact C-N 3.27Å; D369-G371 PolarHBondContact O-N 3.02Å; D369-G371 WeakPolarHBondContact OD1-CA 3.42Å; D369-G371 PolarHBondContact OD1-N 3.47Å; G371-Q375 WeakPolarHBondContact O-CG 3.37Å; G371-Q375 PolarHBondContact O-NE2 3.5Å
372	F	92.2	Very high	93.5	Very high	1 Å²	1	49.6 Å²	49.6	0%	0.004	26%	0.257	C	S	.	.	H	α-helix	trans	-72.9	-56.2	168.7	173.9	-100	0	0	0	111.6	P76 I359 L364 F365 D369 Q370 N374 Q375 F376 Y387	P76-F372 HydrophobicContact CG-CE1 4.19Å; P76-F372 HydrophobicContact CG-CZ 3.92Å; I359-F372 HydrophobicContact CD1-CE2 4.19Å; I359-F372 HydrophobicContact CD1-CZ 4.25Å; I359-F372 HydrophobicContact CG1-CE2 4.41Å; I359-F372 HydrophobicContact CG2-CE2 4.43Å; L364-F372 HydrophobicContact CB-CD2 4.07Å; L364-F372 HydrophobicContact CB-CE2 3.73Å; L364-F372 HydrophobicContact CB-CZ 4.11Å; L364-F372 HydrophobicContact CD2-CD2 4.37Å; L364-F372 WeakPolarHBondContact O-CD1 3.06Å; L364-F372 WeakPolarHBondContact O-CE1 3.3Å; L364-F372 WeakPolarHBondContact O-CZ 3.45Å; F365-F372 HydrophobicContact CD1-CZ 4.37Å; D369-F372 PolarHBondContact O-N 3.15Å; D369-F372 PolarHBondContact OD1-N 3.41Å; Q370-F372 VanDerWaalsContact C-N 3.33Å; Q370-F372 PolarHBondContact O-N 2.8Å; F372-N374 PolarHBondContact O-N 2.94Å; F372-Q375 WeakPolarHBondContact O-CB 3.31Å; F372-Q375 PolarHBondContact O-N 3.18Å; F372-F376 AromaticContact CD2-CE2 3.99Å; F372-F376 HydrophobicContact CD2-CE2 3.99Å; F372-F376 HydrophobicContact CE1-CD2 4.5Å; F372-F376 HydrophobicContact CE1-CE2 4.18Å; F372-F376 AromaticContact CE2-CE2 3.55Å; F372-F376 HydrophobicContact CE2-CE2 3.55Å; F372-F376 HydrophobicContact CE2-CZ 4.14Å; F372-F376 HydrophobicContact CG-CE2 4.47Å; F372-F376 HydrophobicContact CZ-CD2 4.39Å; F372-F376 AromaticContact CZ-CE2 3.67Å; F372-F376 HydrophobicContact CZ-CE2 3.67Å; F372-F376 HydrophobicContact CZ-CZ 4.34Å; F372-F376 WeakPolarHBondContact O-CD2 3.49Å; F372-Y387 AromaticContact CD2-CD2 3.95Å; F372-Y387 HydrophobicContact CD2-CD2 3.95Å; F372-Y387 AromaticContact CD2-CE2 3.55Å; F372-Y387 HydrophobicContact CD2-CE2 3.55Å; F372-Y387 HydrophobicContact CE2-CD2 4.25Å; F372-Y387 HydrophobicContact CE2-CE2 4.23Å
373	L	93.4	Very high	93.5	Very high	42 Å²	42	50.2 Å²	50.2	22%	0.22	26%	0.263	C	S	.	.	H	α-helix	trans	-63.7	-38.5	-171.3	-66.3	171.7	0	0	0	113	D369 Q370 Q375 F376	D369-L373 WeakPolarHBondContact O-CG 3.07Å; D369-L373 PolarHBondContact O-N 2.94Å; Q370-L373 PolarHBondContact O-N 3.06Å; L373-Q375 PolarHBondContact O-N 2.85Å; L373-F376 PolarHBondContact O-N 2.88Å; L373-F376 VanDerWaalsContact O-N 3.14Å
374	N	94.4	Very high	93.6	Very high	86 Å²	86	56.2 Å²	56.2	46%	0.46	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-65.7	-21.1	-178.8	-69.9	-20.2	0	0	0	113.3	Q370 F372 F376 I377	Q370-N374 WeakPolarHBondContact O-CB 3.2Å; Q370-N374 PolarHBondContact O-N 2.82Å; Q370-N374 PolarHBondContact O-ND2 3.45Å; Q370-N374 VanDerWaalsContact O-ND2 3.1Å; F372-N374 PolarHBondContact O-N 2.94Å; N374-F376 PolarHBondContact O-N 2.93Å; N374-I377 HydrophobicContact CB-CD1 4.4Å; N374-I377 PolarHBondContact O-N 3.02Å; N374-I377 WeakPolarHBondContact OD1-CD1 3.45Å
375	Q	95.3	Very high	93.6	Very high	55 Å²	55	57.3 Å²	57.3	26%	0.257	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-70.4	-17.7	177.1	-66.3	-177.1	57.8	0	0	113.1	G371 F372 L373 K388	G371-Q375 WeakPolarHBondContact O-CG 3.37Å; G371-Q375 PolarHBondContact O-NE2 3.5Å; F372-Q375 WeakPolarHBondContact O-CB 3.31Å; F372-Q375 PolarHBondContact O-N 3.18Å; L373-Q375 PolarHBondContact O-N 2.85Å; Q375-K388 PolarHBondContact NE2-O 3.4Å; Q375-K388 PolarHBondContact OE1-O 2.96Å
376	F	97.2	Very high	93.5	Very high	0 Å²	0	62 Å²	62	0%	0	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-104.6	0.3	-179.1	-59.7	-80.5	0	0	0	113.6	H74 P76 L79 Y357 I359 F372 L373 N374 T378 I385	H74-F376 WeakPolarHBondContact O-CB 3.33Å; P76-F376 HydrophobicContact CB-CD1 3.81Å; P76-F376 HydrophobicContact CB-CD2 4.42Å; P76-F376 HydrophobicContact CB-CE1 3.82Å; P76-F376 HydrophobicContact CB-CE2 4.43Å; P76-F376 HydrophobicContact CB-CG 4.13Å; P76-F376 HydrophobicContact CB-CZ 4.14Å; P76-F376 HydrophobicContact CG-CD1 4.45Å; P76-F376 HydrophobicContact CG-CD2 4.19Å; P76-F376 HydrophobicContact CG-CE1 4.47Å; P76-F376 HydrophobicContact CG-CE2 4.21Å; P76-F376 HydrophobicContact CG-CG 4.31Å; P76-F376 HydrophobicContact CG-CZ 4.35Å; L79-F376 HydrophobicContact CD1-CB 4.04Å; L79-F376 HydrophobicContact CD1-CD1 4.32Å; Y357-F376 HydrophobicContact CD1-CE1 4.34Å; Y357-F376 HydrophobicContact CD2-CD1 4.47Å; Y357-F376 AromaticContact CD2-CE1 3.78Å; Y357-F376 HydrophobicContact CD2-CE1 3.78Å; Y357-F376 HydrophobicContact CE2-CE1 4.33Å; Y357-F376 AromaticContact CG-CE1 3.79Å; Y357-F376 HydrophobicContact CG-CE1 3.79Å; I359-F376 HydrophobicContact CD1-CE1 4.37Å; I359-F376 HydrophobicContact CD1-CZ 3.76Å; I359-F376 HydrophobicContact CG1-CZ 4.2Å; F372-F376 AromaticContact CD2-CE2 3.99Å; F372-F376 HydrophobicContact CD2-CE2 3.99Å; F372-F376 HydrophobicContact CE1-CD2 4.5Å; F372-F376 HydrophobicContact CE1-CE2 4.18Å; F372-F376 AromaticContact CE2-CE2 3.55Å; F372-F376 HydrophobicContact CE2-CE2 3.55Å; F372-F376 HydrophobicContact CE2-CZ 4.14Å; F372-F376 HydrophobicContact CG-CE2 4.47Å; F372-F376 HydrophobicContact CZ-CD2 4.39Å; F372-F376 AromaticContact CZ-CE2 3.67Å; F372-F376 HydrophobicContact CZ-CE2 3.67Å; F372-F376 HydrophobicContact CZ-CZ 4.34Å; F372-F376 WeakPolarHBondContact O-CD2 3.49Å; L373-F376 PolarHBondContact O-N 2.88Å; L373-F376 VanDerWaalsContact O-N 3.14Å; N374-F376 PolarHBondContact O-N 2.93Å; F376-T378 PolarHBondContact O-N 3Å; F376-T378 VanDerWaalsContact O-N 3.14Å; F376-I385 HydrophobicContact CD1-CD1 4.26Å; F376-I385 HydrophobicContact CD1-CG2 3.83Å; F376-I385 HydrophobicContact CE1-CG2 3.79Å
377	I	96.7	Very high	93.3	Very high	102 Å²	102	62.5 Å²	62.5	52%	0.523	33%	0.33	S	S	.	.			trans	-69.3	111.6	172.8	-61.8	176	0	0	0	108.5	H74 N374	H74-I377 HydrophobicContact CB-CG1 4.27Å; N374-I377 HydrophobicContact CB-CD1 4.4Å; N374-I377 PolarHBondContact O-N 3.02Å; N374-I377 WeakPolarHBondContact OD1-CD1 3.45Å
378	T	95.5	Very high	93.3	Very high	29 Å²	29	69.6 Å²	69.6	18%	0.178	36%	0.36	C	S	.	.			trans	-150.5	147.4	179.7	-177.8	0	0	0	0	110	H74 L79 F376 D380 I385	H74-T378 PolarHBondContact CE1-O 2.86Å; H74-T378 PolarHBondContact ND1-O 2.99Å; L79-T378 HydrophobicContact CD1-CG2 4.21Å; L79-T378 HydrophobicContact CD2-CG2 4.09Å; F376-T378 PolarHBondContact O-N 3Å; F376-T378 VanDerWaalsContact O-N 3.14Å; T378-D380 WeakPolarHBondContact CG2-O 3.28Å; T378-D380 PolarHBondContact OG1-N 2.98Å; T378-D380 PolarHBondContact OG1-O 2.99Å; T378-I385 HydrophobicContact CG2-CD1 3.99Å
379	D	93.9	Very high	93	Very high	169 Å²	169	65.7 Å²	65.7	90%	0.904	35%	0.35	S	S	*	.	S	Bend	trans	-86.4	-17.5	168.7	-66.2	-36.4	0	0	0	112
380	D	96.5	Very high	92.2	Very high	85 Å²	85	67 Å²	67	46%	0.455	36%	0.36	S	S	.	.			trans	-107.1	111.3	176.1	179.6	15.9	0	0	0	110.4	T378 H382 A383	T378-D380 WeakPolarHBondContact CG2-O 3.28Å; T378-D380 PolarHBondContact OG1-N 2.98Å; T378-D380 PolarHBondContact OG1-O 2.99Å; D380-H382 PolarHBondContact O-N 3.18Å; D380-H382 WeakPolarHBondContact OD1-CB 3.45Å; D380-H382 IonicContact OD1-CD2 2.73Å; D380-H382 PolarHBondContact OD1-N 3.45Å; D380-A383 HydrophobicContact CB-CB 4.44Å; D380-A383 VanDerWaalsContact O-CB 3.26Å; D380-A383 WeakPolarHBondContact O-CB 3.5Å; D380-A383 PolarHBondContact O-N 3.04Å; D380-A383 VanDerWaalsContact O-N 3.13Å
381	I	96.4	Very high	91.5	Very high	41 Å²	41	64.8 Å²	64.8	21%	0.21	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-19.6	176.5	66.3	174.2	0	0	0	112.5	L79 Q82 R83 D86	L79-I381 HydrophobicContact CD2-CG2 4.3Å; Q82-I381 HydrophobicContact CB-CD1 4.13Å; Q82-I381 HydrophobicContact CB-CG2 4.26Å; R83-I381 WeakPolarHBondContact CD-O 3.44Å; R83-I381 HydrophobicContact CG-CB 4.21Å; R83-I381 HydrophobicContact CG-CD1 4.43Å; R83-I381 HydrophobicContact CG-CG1 4.26Å; R83-I381 WeakPolarHBondContact CG-O 3.07Å; D86-I381 HydrophobicContact CB-CD1 4.03Å
382	H	96	Very high	90.8	Very high	62 Å²	62	69.9 Å²	69.9	29%	0.287	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.8	3.3	179	-62.5	-70.8	0	0	0	113.5	D86 D380	D86-H382 IonicContact OD2-CE1 2.74Å; D86-H382 PolarHBondContact OD2-CE1 2.95Å; D86-H382 VanDerWaalsContact OD2-CE1 3.24Å; D86-H382 IonicContact OD2-NE2 2.64Å; D86-H382 PolarHBondContact OD2-NE2 2.97Å; D380-H382 PolarHBondContact O-N 3.18Å; D380-H382 WeakPolarHBondContact OD1-CB 3.45Å; D380-H382 IonicContact OD1-CD2 2.73Å; D380-H382 PolarHBondContact OD1-N 3.45Å
383	A	95.2	Very high	90.4	Very high	19 Å²	19	71.5 Å²	71.5	16%	0.157	38%	0.382	C	S	.	.			trans	-53.8	134.5	177.1	0	0	0	0	0	111.1	D380 I385	D380-A383 HydrophobicContact CB-CB 4.44Å; D380-A383 VanDerWaalsContact O-CB 3.26Å; D380-A383 WeakPolarHBondContact O-CB 3.5Å; D380-A383 PolarHBondContact O-N 3.04Å; D380-A383 VanDerWaalsContact O-N 3.13Å; A383-I385 HydrophobicContact CB-CD1 4.43Å; A383-I385 HydrophobicContact CB-CG1 4.07Å; A383-I385 PolarHBondContact O-N 2.88Å
384	P	93.6	Very high	90.1	Very high	128 Å²	128	73 Å²	73	83%	0.831	39%	0.394	S	S	*	.			trans	-78.7	71.6	-179.4	32.9	-35.8	0	0	0	110.6
385	I	95	Very high	90	Very high	25 Å²	25	71.2 Å²	71.2	13%	0.128	39%	0.388	C	S	.	.			trans	-75.6	134.6	-178.7	-57.2	175.2	0	0	0	109.5	L79 Y357 F376 T378 A383	L79-I385 HydrophobicContact CD1-CD1 4.11Å; Y357-I385 HydrophobicContact CD1-CB 4.11Å; Y357-I385 WeakPolarHBondContact CD1-O 3.5Å; Y357-I385 HydrophobicContact CE1-CB 4.27Å; F376-I385 HydrophobicContact CD1-CD1 4.26Å; F376-I385 HydrophobicContact CD1-CG2 3.83Å; F376-I385 HydrophobicContact CE1-CG2 3.79Å; T378-I385 HydrophobicContact CG2-CD1 3.99Å; A383-I385 HydrophobicContact CB-CD1 4.43Å; A383-I385 HydrophobicContact CB-CG1 4.07Å; A383-I385 PolarHBondContact O-N 2.88Å
386	K	93.2	Very high	89.9	Confident	100 Å²	100	69 Å²	69	44%	0.435	38%	0.378	S	S	.	.			trans	-126.2	123.1	168	-66.3	-63.7	-173.4	170.8	0	107.9	L356 E358 K388	L356-K386 PolarHBondContact O-NZ 3.12Å; E358-K386 HydrophobicContact CG-CD 4.05Å; E358-K386 WeakPolarHBondContact OE1-CD 3.39Å; E358-K386 WeakPolarHBondContact OE1-CE 3.31Å; E358-K386 IonicContact OE1-NZ 3.82Å; E358-K386 PolarHBondContact OE1-NZ 3.16Å; K386-K388 PolarHBondContact O-N 3.38Å
387	Y	92.8	Very high	89.9	Confident	19 Å²	19	72.7 Å²	72.7	8%	0.075	40%	0.397	C	S	.	.	P	Polyproline II helix	trans	-62.6	129.4	178.7	173.3	-118.5	0	0	0	109.6	Y357 I359 P360 L364 F372 P389	Y357-Y387 VanDerWaalsContact O-CB 3.26Å; Y357-Y387 WeakPolarHBondContact O-CB 3.46Å; Y357-Y387 PolarHBondContact O-N 3.28Å; I359-Y387 HydrophobicContact CG1-CD1 4.41Å; I359-Y387 HydrophobicContact CG1-CG 4.21Å; P360-Y387 HydrophobicContact CG-CE1 4.45Å; L364-Y387 HydrophobicContact CD1-CD1 4.5Å; L364-Y387 HydrophobicContact CD1-CE1 3.69Å; F372-Y387 AromaticContact CD2-CD2 3.95Å; F372-Y387 HydrophobicContact CD2-CD2 3.95Å; F372-Y387 AromaticContact CD2-CE2 3.55Å; F372-Y387 HydrophobicContact CD2-CE2 3.55Å; F372-Y387 HydrophobicContact CE2-CD2 4.25Å; F372-Y387 HydrophobicContact CE2-CE2 4.23Å; Y387-P389 HydrophobicContact CE1-CB 4.47Å; Y387-P389 HydrophobicContact CE1-CG 4.28Å
388	K	89.9	Confident	89.9	Confident	156 Å²	156	69 Å²	69	68%	0.678	38%	0.378	S	S	*	.	P	Polyproline II helix	trans	-103.8	118.2	171.5	-64.7	-178.7	-178.1	178	0	107.7	Q375 K386 V390	Q375-K388 PolarHBondContact NE2-O 3.4Å; Q375-K388 PolarHBondContact OE1-O 2.96Å; K386-K388 PolarHBondContact O-N 3.38Å; K388-V390 PolarHBondContact O-N 3.41Å
389	P	82.7	Confident	90	Very high	74 Å²	74	71.1 Å²	71.1	48%	0.481	39%	0.388	S	S	.	.	P	Polyproline II helix	trans	-54.3	125.4	175.4	-26.2	34.6	0	0	0	110.8	Y387 S391 I392	Y387-P389 HydrophobicContact CE1-CB 4.47Å; Y387-P389 HydrophobicContact CE1-CG 4.28Å; P389-S391 VanDerWaalsContact C-N 3.34Å; P389-I392 HydrophobicContact CB-CG1 4.3Å
390	V	71.5	Confident	90.1	Very high	74 Å²	74	63.9 Å²	63.9	45%	0.448	35%	0.35	S	S	.	.	S	Bend	trans	-68.1	-39.7	178.9	-172	0	0	0	0	110	K388	K388-V390 PolarHBondContact O-N 3.41Å
391	S	72.9	Confident	90.1	Very high	63 Å²	63	60.6 Å²	60.6	44%	0.441	33%	0.333	S	S	.	.			trans	-172.1	144.1	167.5	-79.5	0	0	0	0	109.1	P389 F393	P389-S391 VanDerWaalsContact C-N 3.34Å; S391-F393 VanDerWaalsContact CB-CZ 3.44Å
392	I	73.3	Confident	89.9	Confident	137 Å²	137	58.7 Å²	58.7	70%	0.703	32%	0.323	S	S	*	.			trans	-98.5	109.5	172.4	-58.3	175.7	0	0	0	107.6	P389	P389-I392 HydrophobicContact CB-CG1 4.3Å
393	F	83.3	Confident	89.7	Confident	35 Å²	35	58.1 Å²	58.1	15%	0.154	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-86	146.1	179.5	-59.6	-73.5	0	0	0	111.2	S391 R468 D469 Q470 H471 K472 T473	S391-F393 VanDerWaalsContact CB-CZ 3.44Å; F393-R468 VanDerWaalsContact O-CD 3.25Å; F393-R468 WeakPolarHBondContact O-CD 3.37Å; F393-R468 WeakPolarHBondContact O-CG 3.36Å; F393-R468 PolarHBondContact O-NH1 3.19Å; F393-D469 VanDerWaalsContact CD2-O 3.3Å; F393-D469 WeakPolarHBondContact CD2-O 3.36Å; F393-Q470 WeakPolarHBondContact CE2-O 3.48Å; F393-H471 VanDerWaalsContact CE2-CA 3.45Å; F393-H471 VanDerWaalsContact CZ-O 3.27Å; F393-H471 WeakPolarHBondContact CZ-O 3.32Å; F393-K472 VanDerWaalsContact CE2-N 3.29Å; F393-K472 WeakPolarHBondContact CG-O 3.39Å; F393-T473 WeakPolarHBondContact CD1-OG1 3.42Å
394	P	87.6	Confident	89.3	Confident	74 Å²	74	57.4 Å²	57.4	48%	0.481	31%	0.312	S	S	.	.	P	Polyproline II helix	trans	-69.8	145	178.7	29	-34.4	0	0	0	110.9	T473	P394-T473 HydrophobicContact CG-CG2 3.9Å
395	P	91.7	Very high	88.7	Confident	49 Å²	49	52.3 Å²	52.3	32%	0.318	28%	0.278	S	S	.	.	P	Polyproline II helix	trans	-78.6	152.9	178.4	31.6	-34	0	0	0	112.5	I397 I466 Y467 R468	P395-I397 HydrophobicContact CB-CG1 4.46Å; P395-I466 HydrophobicContact CB-CG2 3.69Å; P395-Y467 CarbonylContact C-O 3.54Å; P395-Y467 VanDerWaalsContact CA-O 3.25Å; P395-Y467 WeakPolarHBondContact CA-O 3.32Å; P395-R468 HydrophobicContact CB-CB 4.49Å
396	C	93.9	Very high	87.5	Confident	7 Å²	7	56.2 Å²	56.2	5%	0.047	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	122.5	161.1	-70.7	0	0	0	0	108.8	Y467 M476 V479	C396-Y467 PolarHBondContact N-O 3.31Å; C396-Y467 PolarHBondContact O-N 2.92Å; C396-M476 HydrophobicContact CB-CE 3.79Å; C396-M476 HydrophobicContact CB-SD 4.23Å; C396-V479 HydrophobicContact CB-CB 4.23Å; C396-V479 HydrophobicContact CB-CG1 4.13Å; C396-V479 HydrophobicContact CB-CG2 3.94Å
397	I	95.8	Very high	85.8	Confident	79 Å²	79	55.5 Å²	55.5	41%	0.405	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	127.1	-176.8	-55.8	176.2	0	0	0	109.1	P395 R464 F465 I466	P395-I397 HydrophobicContact CB-CG1 4.46Å; I397-R464 HydrophobicContact CG2-CG 3.66Å; I397-F465 WeakPolarHBondContact CA-O 3.41Å; I397-I466 HydrophobicContact CG1-CG1 4.43Å; I397-I466 HydrophobicContact CG1-CG2 4.39Å
398	L	97.2	Very high	83.7	Confident	25 Å²	25	63.9 Å²	63.9	13%	0.131	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	144.5	175.8	-67.4	168.8	0	0	0	109.5	F465 Y467 M476 V479 R480 H483	L398-F465 PolarHBondContact N-O 3.48Å; L398-F465 PolarHBondContact O-N 2.94Å; L398-Y467 HydrophobicContact CD1-CE2 4.48Å; L398-M476 HydrophobicContact CD2-SD 4.2Å; L398-M476 HydrophobicContact CG-SD 4.44Å; L398-V479 HydrophobicContact CD1-CG1 3.85Å; L398-R480 HydrophobicContact CD1-CG 4.33Å; L398-H483 HydrophobicContact CD1-CB 3.65Å
399	D	97.2	Very high	81.5	Confident	72 Å²	72	59.4 Å²	59.4	39%	0.385	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	140.8	176.7	-67	-11.7	0	0	0	108.9	Y463 R464	D399-Y463 CarbonylContact C-O 3.48Å; D399-Y463 WeakPolarHBondContact CA-O 3.44Å; D399-R464 WeakPolarHBondContact OD1-CA 3.33Å; D399-R464 WeakPolarHBondContact OD1-CB 3.28Å; D399-R464 VanDerWaalsContact OD1-CG 3.25Å; D399-R464 WeakPolarHBondContact OD1-CG 3.38Å; D399-R464 IonicContact OD1-CZ 2.87Å; D399-R464 IonicContact OD1-NE 3.54Å; D399-R464 PolarHBondContact OD1-NE 3.08Å; D399-R464 IonicContact OD1-NH2 3.61Å; D399-R464 IonicContact OD2-CZ 2.91Å; D399-R464 IonicContact OD2-NE 2.84Å; D399-R464 IonicContact OD2-NH2 3.67Å; D399-R464 PolarHBondContact OD2-NH2 2.64Å
400	L	96.2	Very high	79.9	Confident	18 Å²	18	59 Å²	59	9%	0.094	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	126	175.7	-172.9	60.8	0	0	0	109.5	F402 Y463 F465 L490 I498	L400-F402 HydrophobicContact CB-CE1 4.23Å; L400-F402 HydrophobicContact CD2-CD1 4.23Å; L400-F402 HydrophobicContact CD2-CE1 3.52Å; L400-F402 HydrophobicContact CD2-CZ 4.49Å; L400-F402 HydrophobicContact CG-CD1 3.96Å; L400-F402 HydrophobicContact CG-CE1 3.52Å; L400-F402 HydrophobicContact CG-CZ 4.48Å; L400-Y463 PolarHBondContact N-O 2.94Å; L400-Y463 PolarHBondContact O-N 3.24Å; L400-F465 HydrophobicContact CB-CD2 4.25Å; L400-F465 HydrophobicContact CB-CE2 3.79Å; L400-F465 HydrophobicContact CD2-CE2 4.43Å; L400-F465 HydrophobicContact CD2-CZ 4.42Å; L400-L490 HydrophobicContact CD2-CD1 4.2Å; L400-I498 HydrophobicContact CD1-CG2 4.05Å
401	S	95.6	Very high	78.7	Confident	15 Å²	15	57 Å²	57	11%	0.105	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	143.3	178.8	-66.8	0	0	0	0	110.9	L461 C462 R499	S401-L461 WeakPolarHBondContact CA-O 3.41Å; S401-C462 WeakPolarHBondContact OG-CB 3.47Å; S401-C462 PolarHBondContact OG-SG 3.05Å; S401-R499 PolarHBondContact O-N 3.32Å
402	F	93.6	Very high	77.3	Confident	1 Å²	1	59.3 Å²	59.3	0%	0.004	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	155.3	173.1	2.3	-95.7	0	0	0	111.2	L400 I430 S460 L461 Y463 L490 L496 S497	L400-F402 HydrophobicContact CB-CE1 4.23Å; L400-F402 HydrophobicContact CD2-CD1 4.23Å; L400-F402 HydrophobicContact CD2-CE1 3.52Å; L400-F402 HydrophobicContact CD2-CZ 4.49Å; L400-F402 HydrophobicContact CG-CD1 3.96Å; L400-F402 HydrophobicContact CG-CE1 3.52Å; L400-F402 HydrophobicContact CG-CZ 4.48Å; F402-I430 HydrophobicContact CD2-CD1 4.44Å; F402-I430 HydrophobicContact CE2-CD1 3.5Å; F402-I430 VanDerWaalsContact CE2-CD1 3.5Å; F402-I430 HydrophobicContact CZ-CD1 3.79Å; F402-S460 CarbonylContact O-C 3.59Å; F402-S460 WeakPolarHBondContact O-CA 3.48Å; F402-S460 PolarHBondContact O-OG 3.07Å; F402-S460 VanDerWaalsContact O-OG 3.09Å; F402-L461 HydrophobicContact CD2-CB 4.28Å; F402-L461 PolarHBondContact N-O 2.83Å; F402-L461 PolarHBondContact O-N 2.98Å; F402-Y463 HydrophobicContact CD2-CD2 4.34Å; F402-Y463 HydrophobicContact CD2-CE2 4.44Å; F402-Y463 AromaticContact CE2-CD2 3.26Å; F402-Y463 HydrophobicContact CE2-CD2 3.26Å; F402-Y463 AromaticContact CE2-CE2 3.52Å; F402-Y463 HydrophobicContact CE2-CE2 3.52Å; F402-Y463 HydrophobicContact CE2-CG 4.41Å; F402-Y463 AromaticContact CZ-CD2 3.67Å; F402-Y463 HydrophobicContact CZ-CD2 3.67Å; F402-Y463 HydrophobicContact CZ-CE2 4.27Å; F402-Y463 HydrophobicContact CZ-CG 4.46Å; F402-L490 HydrophobicContact CE1-CD1 3.96Å; F402-L490 HydrophobicContact CZ-CD1 4.24Å; F402-L496 HydrophobicContact CB-CB 4.02Å; F402-L496 HydrophobicContact CB-CD1 4.31Å; F402-L496 HydrophobicContact CD2-CD1 4.16Å; F402-L496 HydrophobicContact CG-CD1 4.1Å; F402-S497 CarbonylContact C-O 3.52Å; F402-S497 VanDerWaalsContact CA-O 3.24Å; F402-S497 WeakPolarHBondContact CA-O 3.43Å
403	W	91.6	Very high	76.2	Confident	51 Å²	51	55.5 Å²	55.5	19%	0.193	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	135.3	163	-61.4	100.1	0	0	0	109.6	N405 Y451 D453 R458 Q459 S497 R499	W403-N405 PolarHBondContact O-N 3.21Å; W403-Y451 HydrophobicContact CH2-CD1 4.31Å; W403-Y451 HydrophobicContact CH2-CE1 4.25Å; W403-Y451 HydrophobicContact CZ3-CD1 4.5Å; W403-D453 HydrophobicContact CH2-CB 3.89Å; W403-D453 HydrophobicContact CZ3-CB 3.78Å; W403-R458 HydrophobicContact CE3-CB 3.78Å; W403-R458 HydrophobicContact CZ3-CB 4.17Å; W403-R458 WeakPolarHBondContact CZ3-O 3.49Å; W403-Q459 WeakPolarHBondContact CA-O 3.32Å; W403-S497 PolarHBondContact N-O 3.47Å; W403-S497 PolarHBondContact O-N 2.74Å; W403-S497 VanDerWaalsContact O-N 3.08Å; W403-R499 HydrophobicContact CZ2-CG 4.41Å
404	L	87.7	Confident	74.7	Confident	3 Å²	3	54.4 Å²	54.4	2%	0.016	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	119.2	165.9	-56.5	-172.6	0	0	0	108.4	V426 Q459 L461 L496	L404-V426 HydrophobicContact CD2-CG1 4.08Å; L404-V426 HydrophobicContact CD2-CG2 4.33Å; L404-Q459 HydrophobicContact CD1-CB 4.1Å; L404-Q459 HydrophobicContact CD1-CG 4.26Å; L404-Q459 HydrophobicContact CG-CB 4.36Å; L404-Q459 PolarHBondContact N-O 3.09Å; L404-L461 HydrophobicContact CD1-CD1 4.24Å; L404-L461 HydrophobicContact CD2-CD1 3.96Å; L404-L461 HydrophobicContact CG-CD1 4.31Å; L404-L496 HydrophobicContact CD2-CD2 3.56Å
405	N	80.1	Confident	73	Confident	22 Å²	22	56.3 Å²	56.3	12%	0.118	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-73	165.1	175.6	-66.9	-20.5	0	0	0	110.8	W403 R422 N495 S497	W403-N405 PolarHBondContact O-N 3.21Å; N405-R422 VanDerWaalsContact O-CZ 3.32Å; N405-R422 PolarHBondContact O-NH1 2.67Å; N405-R422 VanDerWaalsContact O-NH1 3.12Å; N405-R422 PolarHBondContact O-NH2 3.28Å; N405-N495 WeakPolarHBondContact CB-O 3.45Å; N405-N495 PolarHBondContact ND2-O 3.04Å; N405-N495 PolarHBondContact ND2-OD1 3.2Å; N405-S497 PolarHBondContact ND2-OG 2.61Å; N405-S497 PolarHBondContact OD1-OG 2.7Å
406	D	69.3	Low	71.4	Confident	106 Å²	106	57 Å²	57	57%	0.567	31%	0.313	S	S	*	.	P	Polyproline II helix	trans	-66.5	153.5	-174.7	-68.4	-48	0	0	0	113.6	E408 S409	D406-E408 VanDerWaalsContact C-N 3.27Å; D406-E408 PolarHBondContact O-N 2.99Å; D406-S409 PolarHBondContact O-OG 3.19Å
407	S	56.9	Low	69.5	Low	85 Å²	85	59.6 Å²	59.6	59%	0.594	33%	0.329	S	S	*	.	G	3₁₀ helix	trans	-60.6	-15.9	-157.8	59.4	0	0	0	0	117.8	S409	S407-S409 VanDerWaalsContact C-N 3.31Å; S407-S409 PolarHBondContact O-N 3.2Å
408	E	50.3	Low	67.7	Low	196 Å²	196	59.4 Å²	59.4	92%	0.916	33%	0.329	S	S	*	.	G	3₁₀ helix	trans	-80.5	-7.9	-171	-68.8	-170	162.1	0	0	114.6	D406	D406-E408 VanDerWaalsContact C-N 3.27Å; D406-E408 PolarHBondContact O-N 2.99Å
409	S	43.7	Very low	65.9	Low	62 Å²	62	61.5 Å²	61.5	43%	0.434	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-124.4	28.5	-167.2	52.7	0	0	0	0	114	D406 S407 S411 N495	D406-S409 PolarHBondContact O-OG 3.19Å; S407-S409 VanDerWaalsContact C-N 3.31Å; S407-S409 PolarHBondContact O-N 3.2Å; S409-S411 PolarHBondContact O-N 3.2Å; S409-N495 WeakPolarHBondContact CB-ND2 3.38Å; S409-N495 PolarHBondContact O-ND2 2.82Å; S409-N495 PolarHBondContact OG-ND2 3.07Å
410	I	48.2	Very low	64.2	Low	64 Å²	64	60.2 Å²	60.2	33%	0.328	35%	0.35	S	S	.	.			trans	-70.4	126.6	175.9	-63.4	178.7	0	0	0	108.7	S414	I410-S414 VanDerWaalsContact CG2-O 3.3Å; I410-S414 WeakPolarHBondContact CG2-O 3.39Å; I410-S414 WeakPolarHBondContact CG2-OG 3.29Å
411	S	45.8	Very low	63	Low	33 Å²	33	63.2 Å²	63.2	23%	0.231	37%	0.366	C	S	.	.			trans	-56.9	158	-179.9	62.4	0	0	0	0	111	S409 L413 S414 K493	S409-S411 PolarHBondContact O-N 3.2Å; S411-L413 PolarHBondContact O-N 2.86Å; S411-S414 PolarHBondContact O-N 3.46Å; S411-K493 WeakPolarHBondContact CB-O 3.4Å; S411-K493 PolarHBondContact OG-O 3.06Å
412	S	45.4	Very low	62	Low	112 Å²	112	65.9 Å²	65.9	78%	0.783	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-54	-15.7	-177.7	51.3	0	0	0	0	114.8	S414	S412-S414 VanDerWaalsContact C-N 3.3Å
413	L	49.6	Very low	61.3	Low	56 Å²	56	67.6 Å²	67.6	29%	0.293	38%	0.382	S	S	.	.	G	3₁₀ helix	trans	-65.1	-33.8	172.2	-72.9	163.7	0	0	0	112.1	R137 S411	R137-L413 PolarHBondContact NH1-O 3.44Å; R137-L413 PolarHBondContact NH2-O 3.06Å; S411-L413 PolarHBondContact O-N 2.86Å
414	S	51.4	Low	60.9	Low	12 Å²	12	70.7 Å²	70.7	8%	0.084	40%	0.397	C	S	.	.	G	3₁₀ helix	trans	-115.8	44.6	-169.5	13.3	0	0	0	0	113.7	I410 S411 S412 N416 I425 D429	I410-S414 VanDerWaalsContact CG2-O 3.3Å; I410-S414 WeakPolarHBondContact CG2-O 3.39Å; I410-S414 WeakPolarHBondContact CG2-OG 3.29Å; S411-S414 PolarHBondContact O-N 3.46Å; S412-S414 VanDerWaalsContact C-N 3.3Å; S414-N416 PolarHBondContact O-N 2.91Å; S414-I425 VanDerWaalsContact CB-CG2 3.46Å; S414-D429 PolarHBondContact OG-OD2 3.16Å; S414-D429 VanDerWaalsContact OG-OD2 3.14Å
415	F	51.6	Low	60.6	Low	115 Å²	115	71.3 Å²	71.3	50%	0.504	40%	0.4	S	S	.	.			trans	-54.2	119.5	154.1	-168.1	-110.8	0	0	0	108.9	R137 P417	R137-F415 PolarHBondContact NH1-O 2.77Å; F415-P417 HydrophobicContact CD1-CB 4.15Å; F415-P417 HydrophobicContact CD1-CG 3.83Å; F415-P417 HydrophobicContact CE1-CB 3.81Å; F415-P417 HydrophobicContact CE1-CG 3.98Å; F415-P417 WeakPolarHBondContact O-CD 3.29Å
416	N	58.7	Low	60.8	Low	63 Å²	63	70.8 Å²	70.8	34%	0.337	40%	0.398	S	S	.	.			trans	-110.3	70.3	-177.1	-171.9	7.5	0	0	0	111.4	S414 D418 G419 L420 I425	S414-N416 PolarHBondContact O-N 2.91Å; N416-D418 PolarHBondContact O-N 2.77Å; N416-G419 PolarHBondContact OD1-N 3.03Å; N416-L420 PolarHBondContact ND2-N 3.32Å; N416-L420 PolarHBondContact ND2-O 2.73Å; N416-L420 WeakPolarHBondContact OD1-CB 3.12Å; N416-L420 PolarHBondContact OD1-N 3.25Å; N416-I425 HydrophobicContact CB-CD1 3.83Å; N416-I425 VanDerWaalsContact CG-CD1 3.41Å
417	P	54.9	Low	61.8	Low	61 Å²	61	67.3 Å²	67.3	40%	0.396	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-21.8	178.6	27.9	-31.4	0	0	0	112.2	W54 F415	W54-P417 HydrophobicContact CZ2-CG 4.27Å; F415-P417 HydrophobicContact CD1-CB 4.15Å; F415-P417 HydrophobicContact CD1-CG 3.83Å; F415-P417 HydrophobicContact CE1-CB 3.81Å; F415-P417 HydrophobicContact CE1-CG 3.98Å; F415-P417 WeakPolarHBondContact O-CD 3.29Å
418	D	57	Low	63.4	Low	75 Å²	75	64.8 Å²	64.8	40%	0.401	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-1.7	-169.8	-55	-27.6	0	0	0	113.5	N416 L420	N416-D418 PolarHBondContact O-N 2.77Å; D418-L420 HydrophobicContact CB-CB 4.47Å; D418-L420 HydrophobicContact CB-CD1 4Å; D418-L420 PolarHBondContact O-N 3.36Å
419	G	58.7	Low	65.3	Low	69 Å²	69	55.7 Å²	55.7	71%	0.711	31%	0.314	S	S	*	.			trans	62.2	27.2	-173	0	0	0	0	0	113	N416	N416-G419 PolarHBondContact OD1-N 3.03Å
420	L	61.6	Low	67.7	Low	46 Å²	46	52.8 Å²	52.8	24%	0.241	29%	0.293	C	S	.	.			trans	-70.4	156.7	-172.8	-136.5	86.1	0	0	0	112.4	S136 T138 N416 D418 R422 I425	S136-L420 WeakPolarHBondContact OG-CD1 3.45Å; S136-L420 VanDerWaalsContact OG-CD2 3.23Å; S136-L420 WeakPolarHBondContact OG-CD2 3.38Å; T138-L420 HydrophobicContact CG2-CD2 3.25Å; T138-L420 WeakPolarHBondContact OG1-CD2 3.38Å; N416-L420 PolarHBondContact ND2-N 3.32Å; N416-L420 PolarHBondContact ND2-O 2.73Å; N416-L420 WeakPolarHBondContact OD1-CB 3.12Å; N416-L420 PolarHBondContact OD1-N 3.25Å; D418-L420 HydrophobicContact CB-CB 4.47Å; D418-L420 HydrophobicContact CB-CD1 4Å; D418-L420 PolarHBondContact O-N 3.36Å; L420-R422 PolarHBondContact O-N 3.06Å; L420-R422 VanDerWaalsContact O-N 3.07Å; L420-I425 HydrophobicContact CB-CD1 3.89Å; L420-I425 HydrophobicContact CB-CG1 4.19Å; L420-I425 HydrophobicContact CD2-CG1 4.03Å
421	D	71.6	Confident	69.9	Low	80 Å²	80	50 Å²	50	43%	0.428	28%	0.279	S	S	.	.			trans	-55.5	114.7	173.1	-175.6	-8.6	0	0	0	110.3	I423 K424 I425	D421-I423 PolarHBondContact O-N 3.04Å; D421-I423 VanDerWaalsContact O-N 3.17Å; D421-I423 WeakPolarHBondContact OD1-CB 3.42Å; D421-I423 PolarHBondContact OD1-N 3.13Å; D421-K424 HydrophobicContact CB-CB 4.32Å; D421-K424 HydrophobicContact CB-CD 4.29Å; D421-K424 HydrophobicContact CB-CG 4.12Å; D421-K424 PolarHBondContact O-N 3.07Å; D421-I425 PolarHBondContact O-N 3.23Å
422	R	74	Confident	72.1	Confident	72 Å²	72	49 Å²	49	27%	0.272	27%	0.27	S	S	.	.	H	α-helix	trans	-54.4	-35.7	-178.3	-174.2	-178.4	-179.1	-158.8	-3.4	111.8	N405 L420 I425 V426	N405-R422 VanDerWaalsContact O-CZ 3.32Å; N405-R422 PolarHBondContact O-NH1 2.67Å; N405-R422 VanDerWaalsContact O-NH1 3.12Å; N405-R422 PolarHBondContact O-NH2 3.28Å; L420-R422 PolarHBondContact O-N 3.06Å; L420-R422 VanDerWaalsContact O-N 3.07Å; R422-I425 PolarHBondContact O-N 3.46Å; R422-V426 WeakPolarHBondContact O-CG2 3.34Å; R422-V426 PolarHBondContact O-N 3.07Å; R422-V426 VanDerWaalsContact O-N 3.11Å
423	I	80.2	Confident	74.4	Confident	36 Å²	36	44.2 Å²	44.2	19%	0.185	24%	0.236	C	C	.	.	H	α-helix	trans	-64.5	-46.8	-179.8	-59.3	167.1	0	0	0	109.6	D421 I425 V426 E427 L461	D421-I423 PolarHBondContact O-N 3.04Å; D421-I423 VanDerWaalsContact O-N 3.17Å; D421-I423 WeakPolarHBondContact OD1-CB 3.42Å; D421-I423 PolarHBondContact OD1-N 3.13Å; I423-I425 VanDerWaalsContact C-N 3.34Å; I423-I425 PolarHBondContact O-N 3.27Å; I423-V426 PolarHBondContact O-N 3.32Å; I423-E427 VanDerWaalsContact O-CB 3.26Å; I423-E427 WeakPolarHBondContact O-CB 3.38Å; I423-E427 PolarHBondContact O-N 2.95Å; I423-L461 HydrophobicContact CG2-CD1 4.13Å; I423-L461 HydrophobicContact CG2-CD2 4.26Å
424	K	82.7	Confident	76.5	Confident	116 Å²	116	41.6 Å²	41.6	50%	0.504	22%	0.222	S	C	.	.	H	α-helix	trans	-63.1	-39.5	179.9	-70	-170.6	176	-171.4	0	112.6	D421 E427 R428	D421-K424 HydrophobicContact CB-CB 4.32Å; D421-K424 HydrophobicContact CB-CD 4.29Å; D421-K424 HydrophobicContact CB-CG 4.12Å; D421-K424 PolarHBondContact O-N 3.07Å; K424-E427 PolarHBondContact O-N 2.71Å; K424-R428 VanDerWaalsContact O-CG 3.27Å; K424-R428 WeakPolarHBondContact O-CG 3.32Å; K424-R428 PolarHBondContact O-N 3.29Å
425	I	80.5	Confident	78.5	Confident	16 Å²	16	41.2 Å²	41.2	8%	0.082	22%	0.219	C	C	.	.	H	α-helix	trans	-60.1	-52.8	175.5	-64.6	173.3	0	0	0	110.1	T138 S414 N416 L420 D421 R422 I423 E427 R428 D429	T138-I425 HydrophobicContact CG2-CB 4.18Å; T138-I425 HydrophobicContact CG2-CG1 3.58Å; S414-I425 VanDerWaalsContact CB-CG2 3.46Å; N416-I425 HydrophobicContact CB-CD1 3.83Å; N416-I425 VanDerWaalsContact CG-CD1 3.41Å; L420-I425 HydrophobicContact CB-CD1 3.89Å; L420-I425 HydrophobicContact CB-CG1 4.19Å; L420-I425 HydrophobicContact CD2-CG1 4.03Å; D421-I425 PolarHBondContact O-N 3.23Å; R422-I425 PolarHBondContact O-N 3.46Å; I423-I425 VanDerWaalsContact C-N 3.34Å; I423-I425 PolarHBondContact O-N 3.27Å; I425-E427 VanDerWaalsContact C-N 3.29Å; I425-E427 PolarHBondContact O-N 3.11Å; I425-R428 PolarHBondContact O-N 3.34Å; I425-D429 VanDerWaalsContact O-CG 3.28Å; I425-D429 PolarHBondContact O-N 3.26Å
426	V	84.8	Confident	80.5	Confident	11 Å²	11	37.7 Å²	37.7	7%	0.067	21%	0.209	C	C	.	.	H	α-helix	trans	-60.8	-41.1	179.6	172.6	0	0	0	0	110.9	L404 R422 I423 D429 I430 L496	L404-V426 HydrophobicContact CD2-CG1 4.08Å; L404-V426 HydrophobicContact CD2-CG2 4.33Å; R422-V426 WeakPolarHBondContact O-CG2 3.34Å; R422-V426 PolarHBondContact O-N 3.07Å; R422-V426 VanDerWaalsContact O-N 3.11Å; I423-V426 PolarHBondContact O-N 3.32Å; V426-D429 PolarHBondContact O-N 3.42Å; V426-I430 HydrophobicContact CG1-CD1 3.79Å; V426-I430 HydrophobicContact CG1-CG1 4.27Å; V426-I430 WeakPolarHBondContact O-CB 3.34Å; V426-I430 VanDerWaalsContact O-CG1 3.22Å; V426-I430 WeakPolarHBondContact O-CG1 3.5Å; V426-I430 PolarHBondContact O-N 2.79Å; V426-L496 HydrophobicContact CG1-CD1 4.25Å; V426-L496 HydrophobicContact CG1-CD2 4.38Å
427	E	90.2	Very high	82.2	Confident	34 Å²	34	38 Å²	38	16%	0.159	21%	0.208	C	C	.	.	H	α-helix	trans	-60.4	-47.9	178.3	-177.8	166.1	-99	0	0	112.5	I423 K424 I425 D429 I430 F431 Y463	I423-E427 VanDerWaalsContact O-CB 3.26Å; I423-E427 WeakPolarHBondContact O-CB 3.38Å; I423-E427 PolarHBondContact O-N 2.95Å; K424-E427 PolarHBondContact O-N 2.71Å; I425-E427 VanDerWaalsContact C-N 3.29Å; I425-E427 PolarHBondContact O-N 3.11Å; E427-D429 VanDerWaalsContact C-N 3.33Å; E427-D429 PolarHBondContact O-N 3.43Å; E427-I430 WeakPolarHBondContact O-CB 3.4Å; E427-I430 PolarHBondContact O-N 2.64Å; E427-F431 HydrophobicContact CG-CD1 4.49Å; E427-F431 HydrophobicContact CG-CD2 4.37Å; E427-F431 HydrophobicContact CG-CE1 3.8Å; E427-F431 HydrophobicContact CG-CE2 3.66Å; E427-F431 HydrophobicContact CG-CZ 3.33Å; E427-F431 VanDerWaalsContact O-CD1 3.31Å; E427-F431 WeakPolarHBondContact O-CD1 3.45Å; E427-F431 VanDerWaalsContact O-CG 3.27Å; E427-F431 WeakPolarHBondContact O-CG 3.38Å; E427-F431 PolarHBondContact O-N 2.93Å; E427-Y463 HydrophobicContact CG-CE1 4.12Å; E427-Y463 VanDerWaalsContact OE1-CE1 3.32Å; E427-Y463 WeakPolarHBondContact OE1-CE1 3.47Å; E427-Y463 PolarHBondContact OE1-OH 2.87Å; E427-Y463 VanDerWaalsContact OE1-OH 3.1Å
428	R	90.5	Very high	84.1	Confident	31 Å²	31	35.5 Å²	35.5	12%	0.117	19%	0.193	C	C	.	.	H	α-helix	trans	-64.7	-38.9	177.2	-66.9	-73.9	-174.9	-125.1	0.7	111.9	T138 R177 D178 D179 K424 I425 F431 D432	T138-R428 HydrophobicContact CG2-CG 4.36Å; T138-R428 WeakPolarHBondContact O-CD 3.36Å; T138-R428 VanDerWaalsContact O-CG 3.23Å; T138-R428 WeakPolarHBondContact O-CG 3.33Å; T138-R428 PolarHBondContact O-NE 2.91Å; R177-R428 PolarHBondContact NH2-O 3.33Å; R177-R428 PolarHBondContact O-NE 3.27Å; D178-R428 PolarHBondContact O-NH1 3.02Å; D179-R428 IonicContact OD1-CZ 3.18Å; D179-R428 IonicContact OD1-NH1 2.61Å; D179-R428 PolarHBondContact OD1-NH1 3.3Å; D179-R428 IonicContact OD1-NH2 2.69Å; D179-R428 PolarHBondContact OD1-NH2 3.21Å; K424-R428 VanDerWaalsContact O-CG 3.27Å; K424-R428 WeakPolarHBondContact O-CG 3.32Å; K424-R428 PolarHBondContact O-N 3.29Å; I425-R428 PolarHBondContact O-N 3.34Å; R428-F431 PolarHBondContact O-N 3.34Å; R428-D432 PolarHBondContact O-N 3.31Å
429	D	90.2	Very high	85.7	Confident	6 Å²	6	32.8 Å²	32.8	3%	0.032	18%	0.182	C	C	.	.	H	α-helix	trans	-66.2	-38.3	175	-67.7	-9.9	0	0	0	111.5	R177 S414 I425 V426 E427 L433 L494	R177-D429 IonicContact CZ-OD1 2.7Å; R177-D429 IonicContact NH1-OD1 2.98Å; R177-D429 PolarHBondContact NH1-OD1 3.04Å; R177-D429 IonicContact NH2-OD1 3.58Å; R177-D429 PolarHBondContact NH2-OD1 2.85Å; S414-D429 PolarHBondContact OG-OD2 3.16Å; S414-D429 VanDerWaalsContact OG-OD2 3.14Å; I425-D429 VanDerWaalsContact O-CG 3.28Å; I425-D429 PolarHBondContact O-N 3.26Å; V426-D429 PolarHBondContact O-N 3.42Å; E427-D429 VanDerWaalsContact C-N 3.33Å; E427-D429 PolarHBondContact O-N 3.43Å; D429-L433 WeakPolarHBondContact O-CB 3.17Å; D429-L433 VanDerWaalsContact O-CG 3.3Å; D429-L433 WeakPolarHBondContact O-CG 3.42Å; D429-L433 PolarHBondContact O-N 3.43Å; D429-L494 HydrophobicContact CB-CD1 4.03Å; D429-L494 HydrophobicContact CB-CD2 3.6Å; D429-L494 HydrophobicContact CB-CG 4.48Å
430	I	93.4	Very high	87.2	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-58.8	-50.5	171.4	-72.2	163.5	0	0	0	109.4	F402 V426 E427 D432 L433 V434 Y463 F465 L490 L494	F402-I430 HydrophobicContact CD2-CD1 4.44Å; F402-I430 HydrophobicContact CE2-CD1 3.5Å; F402-I430 VanDerWaalsContact CE2-CD1 3.5Å; F402-I430 HydrophobicContact CZ-CD1 3.79Å; V426-I430 HydrophobicContact CG1-CD1 3.79Å; V426-I430 HydrophobicContact CG1-CG1 4.27Å; V426-I430 WeakPolarHBondContact O-CB 3.34Å; V426-I430 VanDerWaalsContact O-CG1 3.22Å; V426-I430 WeakPolarHBondContact O-CG1 3.5Å; V426-I430 PolarHBondContact O-N 2.79Å; E427-I430 WeakPolarHBondContact O-CB 3.4Å; E427-I430 PolarHBondContact O-N 2.64Å; I430-D432 VanDerWaalsContact C-N 3.35Å; I430-D432 PolarHBondContact O-N 2.61Å; I430-L433 PolarHBondContact O-N 3.26Å; I430-V434 HydrophobicContact CG2-CG2 3.92Å; I430-V434 WeakPolarHBondContact O-CB 3.19Å; I430-V434 WeakPolarHBondContact O-CG2 3.46Å; I430-V434 PolarHBondContact O-N 2.99Å; I430-Y463 HydrophobicContact CD1-CD2 4.35Å; I430-Y463 HydrophobicContact CD1-CE2 3.84Å; I430-F465 HydrophobicContact CG2-CZ 4.49Å; I430-L490 HydrophobicContact CB-CD2 4.24Å; I430-L490 HydrophobicContact CG1-CD1 4.44Å; I430-L490 HydrophobicContact CG1-CD2 4.04Å; I430-L490 HydrophobicContact CG2-CD1 4.07Å; I430-L490 HydrophobicContact CG2-CD2 4.24Å; I430-L494 HydrophobicContact CG1-CD1 3.64Å
431	F	94.5	Very high	88.7	Confident	7 Å²	7	32.6 Å²	32.6	3%	0.031	17%	0.165	C	C	.	.	H	α-helix	trans	-60.2	-44.8	-176.8	-65.4	-6.3	0	0	0	111.8	D178 I180 E427 R428 V434 R435 I445 Y463	D178-F431 WeakPolarHBondContact O-CD2 3.35Å; I180-F431 HydrophobicContact CD1-CB 3.68Å; I180-F431 HydrophobicContact CD1-CD1 4.2Å; I180-F431 HydrophobicContact CD1-CG 4Å; I180-F431 HydrophobicContact CG1-CB 3.97Å; I180-F431 HydrophobicContact CG1-CD1 4.44Å; I180-F431 HydrophobicContact CG1-CD2 4.35Å; I180-F431 HydrophobicContact CG1-CG 4.01Å; E427-F431 HydrophobicContact CG-CD1 4.49Å; E427-F431 HydrophobicContact CG-CD2 4.37Å; E427-F431 HydrophobicContact CG-CE1 3.8Å; E427-F431 HydrophobicContact CG-CE2 3.66Å; E427-F431 HydrophobicContact CG-CZ 3.33Å; E427-F431 VanDerWaalsContact O-CD1 3.31Å; E427-F431 WeakPolarHBondContact O-CD1 3.45Å; E427-F431 VanDerWaalsContact O-CG 3.27Å; E427-F431 WeakPolarHBondContact O-CG 3.38Å; E427-F431 PolarHBondContact O-N 2.93Å; R428-F431 PolarHBondContact O-N 3.34Å; F431-V434 PolarHBondContact O-N 3.09Å; F431-R435 WeakPolarHBondContact O-CB 3.33Å; F431-R435 VanDerWaalsContact O-CG 3.26Å; F431-R435 WeakPolarHBondContact O-CG 3.39Å; F431-R435 PolarHBondContact O-N 3.48Å; F431-I445 HydrophobicContact CD1-CB 4.27Å; F431-I445 HydrophobicContact CD1-CD1 4.05Å; F431-I445 HydrophobicContact CD1-CG2 4.28Å; F431-I445 HydrophobicContact CE1-CB 3.87Å; F431-I445 HydrophobicContact CE1-CD1 4.45Å; F431-I445 HydrophobicContact CE1-CG2 3.69Å; F431-Y463 HydrophobicContact CE1-CE1 4.35Å
432	D	92.3	Very high	89.8	Confident	10 Å²	10	28.8 Å²	28.8	5%	0.053	15%	0.145	C	C	.	.	H	α-helix	trans	-63.4	-42.7	177.2	-83	-36.8	0	0	0	113.4	T58 Y141 R177 R428 I430 S436	T58-D432 HydrophobicContact CG2-CB 3.89Å; Y141-D432 WeakPolarHBondContact CE1-OD1 3.37Å; Y141-D432 PolarHBondContact OH-OD1 2.82Å; R177-D432 IonicContact CZ-OD2 2.87Å; R177-D432 IonicContact NE-OD2 3.55Å; R177-D432 PolarHBondContact NE-OD2 3.46Å; R177-D432 IonicContact NH2-OD2 3.18Å; R177-D432 PolarHBondContact NH2-OD2 3.01Å; R428-D432 PolarHBondContact O-N 3.31Å; I430-D432 VanDerWaalsContact C-N 3.35Å; I430-D432 PolarHBondContact O-N 2.61Å; D432-S436 WeakPolarHBondContact O-CB 3.15Å; D432-S436 PolarHBondContact O-N 3.03Å; D432-S436 PolarHBondContact O-OG 3.37Å
433	L	93.3	Very high	90.6	Very high	13 Å²	13	26.4 Å²	26.4	7%	0.068	14%	0.137	C	C	.	.	H	α-helix	trans	-67.3	-42.2	177.1	-73	177.5	0	0	0	111.1	D429 I430 R435 S436 E437 L490 K493 L494	D429-L433 WeakPolarHBondContact O-CB 3.17Å; D429-L433 VanDerWaalsContact O-CG 3.3Å; D429-L433 WeakPolarHBondContact O-CG 3.42Å; D429-L433 PolarHBondContact O-N 3.43Å; I430-L433 PolarHBondContact O-N 3.26Å; L433-R435 PolarHBondContact O-N 3.19Å; L433-S436 WeakPolarHBondContact O-CA 3.45Å; L433-S436 WeakPolarHBondContact O-CB 3.01Å; L433-S436 PolarHBondContact O-N 2.78Å; L433-E437 WeakPolarHBondContact O-CG 3.35Å; L433-E437 PolarHBondContact O-N 3.26Å; L433-L490 HydrophobicContact CB-CD2 3.72Å; L433-L490 HydrophobicContact CD1-CD2 3.81Å; L433-L490 HydrophobicContact CG-CD2 4.42Å; L433-K493 HydrophobicContact CD1-CB 3.87Å; L433-K493 HydrophobicContact CD1-CD 4.25Å; L433-K493 HydrophobicContact CD2-CD 3.61Å; L433-L494 HydrophobicContact CD1-CD1 3.98Å; L433-L494 HydrophobicContact CD1-CD2 3.71Å; L433-L494 HydrophobicContact CD1-CG 3.68Å
434	V	95.4	Very high	91.2	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-66.1	-40.1	178.5	178	0	0	0	0	111.1	I430 F431 S436 E437 A438 I442 I445 F465 I486 L490	I430-V434 HydrophobicContact CG2-CG2 3.92Å; I430-V434 WeakPolarHBondContact O-CB 3.19Å; I430-V434 WeakPolarHBondContact O-CG2 3.46Å; I430-V434 PolarHBondContact O-N 2.99Å; F431-V434 PolarHBondContact O-N 3.09Å; V434-S436 PolarHBondContact O-N 2.71Å; V434-E437 PolarHBondContact O-N 3.38Å; V434-A438 HydrophobicContact CG1-CB 4.28Å; V434-A438 VanDerWaalsContact O-CB 3.3Å; V434-A438 WeakPolarHBondContact O-CB 3.43Å; V434-A438 PolarHBondContact O-N 3.14Å; V434-I442 HydrophobicContact CG1-CB 4.25Å; V434-I442 HydrophobicContact CG1-CD1 4.49Å; V434-I442 HydrophobicContact CG1-CG1 4.08Å; V434-I442 HydrophobicContact CG1-CG2 4.21Å; V434-I445 HydrophobicContact CB-CD1 3.81Å; V434-I445 HydrophobicContact CG1-CD1 3.59Å; V434-I445 HydrophobicContact CG2-CD1 3.96Å; V434-F465 HydrophobicContact CB-CE1 4.41Å; V434-F465 HydrophobicContact CG1-CD1 4.26Å; V434-F465 HydrophobicContact CG1-CE1 3.96Å; V434-F465 HydrophobicContact CG2-CE1 3.59Å; V434-F465 HydrophobicContact CG2-CZ 4.23Å; V434-I486 HydrophobicContact CG1-CD1 4.43Å; V434-I486 HydrophobicContact CG2-CG2 3.84Å; V434-L490 HydrophobicContact CG2-CD1 4.19Å; V434-L490 HydrophobicContact CG2-CD2 4.39Å
435	R	92.9	Very high	91.7	Very high	4 Å²	4	21.8 Å²	21.8	2%	0.015	12%	0.116	C	C	.	.	H	α-helix	trans	-59.9	-37.2	171	-72.6	-73.5	-169.7	172.5	4.3	111.6	I180 H184 F431 L433 G439	I180-R435 HydrophobicContact CD1-CG 3.78Å; I180-R435 HydrophobicContact CG1-CG 4.48Å; H184-R435 PolarHBondContact O-NH2 3.07Å; F431-R435 WeakPolarHBondContact O-CB 3.33Å; F431-R435 VanDerWaalsContact O-CG 3.26Å; F431-R435 WeakPolarHBondContact O-CG 3.39Å; F431-R435 PolarHBondContact O-N 3.48Å; L433-R435 PolarHBondContact O-N 3.19Å; R435-G439 WeakPolarHBondContact O-CA 3.39Å; R435-G439 PolarHBondContact O-N 3.37Å
436	S	92.9	Very high	92.3	Very high	41 Å²	41	25.6 Å²	25.6	29%	0.287	13%	0.13	S	C	.	.	H	α-helix	trans	-67.5	-38	178.2	-57.1	0	0	0	0	112.9	T58 D432 L433 V434	T58-S436 WeakPolarHBondContact CB-OG 3.32Å; T58-S436 PolarHBondContact OG1-OG 3.05Å; D432-S436 WeakPolarHBondContact O-CB 3.15Å; D432-S436 PolarHBondContact O-N 3.03Å; D432-S436 PolarHBondContact O-OG 3.37Å; L433-S436 WeakPolarHBondContact O-CA 3.45Å; L433-S436 WeakPolarHBondContact O-CB 3.01Å; L433-S436 PolarHBondContact O-N 2.78Å; V434-S436 PolarHBondContact O-N 2.71Å
437	E	94.6	Very high	92.6	Very high	70 Å²	70	28.4 Å²	28.4	33%	0.327	14%	0.144	S	C	.	.	H	α-helix	trans	-87	-41.3	-178.2	-62.6	-59	136.6	0	0	113.2	L433 V434 N485 I486 V489	L433-E437 WeakPolarHBondContact O-CG 3.35Å; L433-E437 PolarHBondContact O-N 3.26Å; V434-E437 PolarHBondContact O-N 3.38Å; E437-N485 PolarHBondContact OE2-ND2 2.77Å; E437-I486 HydrophobicContact CB-CD1 4.45Å; E437-I486 HydrophobicContact CB-CG1 3.76Å; E437-I486 HydrophobicContact CG-CG1 4.37Å; E437-V489 HydrophobicContact CG-CB 4.48Å; E437-V489 HydrophobicContact CG-CG1 4.19Å; E437-V489 HydrophobicContact CG-CG2 4.43Å
438	A	93.8	Very high	92.7	Very high	8 Å²	8	29.6 Å²	29.6	7%	0.066	15%	0.154	C	C	.	.	H	α-helix	trans	-100.5	-18.6	-173.9	0	0	0	0	0	114.2	V434 D440 L441 I442 Y467 L482 I486	V434-A438 HydrophobicContact CG1-CB 4.28Å; V434-A438 VanDerWaalsContact O-CB 3.3Å; V434-A438 WeakPolarHBondContact O-CB 3.43Å; V434-A438 PolarHBondContact O-N 3.14Å; A438-D440 PolarHBondContact O-N 2.9Å; A438-L441 WeakPolarHBondContact O-CB 3.29Å; A438-L441 PolarHBondContact O-N 3Å; A438-L441 VanDerWaalsContact O-N 3.14Å; A438-I442 HydrophobicContact CB-CB 4.17Å; A438-I442 HydrophobicContact CB-CG2 4.38Å; A438-Y467 HydrophobicContact CB-CE1 4.34Å; A438-L482 HydrophobicContact CB-CD2 4.29Å; A438-I486 HydrophobicContact CB-CD1 4.04Å
439	G	91.8	Very high	92.8	Very high	18 Å²	18	32.2 Å²	32.2	19%	0.186	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	55.7	-128.4	-175.4	0	0	0	0	0	112.3	R435 L441 I442	R435-G439 WeakPolarHBondContact O-CA 3.39Å; R435-G439 PolarHBondContact O-N 3.37Å; G439-L441 VanDerWaalsContact C-N 3.32Å; G439-I442 WeakPolarHBondContact O-CG2 3.31Å
440	D	90.8	Very high	92.8	Very high	60 Å²	60	34.6 Å²	34.6	32%	0.321	19%	0.187	S	C	.	.	G	3₁₀ helix	trans	-83.6	-3.8	-179.1	-63.4	-42.7	0	0	0	114.1	Y185 R363 A438 I442	Y185-D440 WeakPolarHBondContact CE2-OD1 3.42Å; Y185-D440 PolarHBondContact OH-OD1 2.85Å; R363-D440 PolarHBondContact NH1-O 3.37Å; A438-D440 PolarHBondContact O-N 2.9Å; D440-I442 PolarHBondContact O-N 3.2Å
441	L	93.1	Very high	92.7	Very high	52 Å²	52	39.3 Å²	39.3	27%	0.272	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-66.5	-28.8	175.6	-66.8	177.3	0	0	0	112.1	A438 G439 E443 Y467 R468 D469 L474 L482	A438-L441 WeakPolarHBondContact O-CB 3.29Å; A438-L441 PolarHBondContact O-N 3Å; A438-L441 VanDerWaalsContact O-N 3.14Å; G439-L441 VanDerWaalsContact C-N 3.32Å; L441-E443 PolarHBondContact O-N 3.25Å; L441-Y467 CarbonylContact O-C 3.5Å; L441-Y467 VanDerWaalsContact O-CA 3.25Å; L441-Y467 WeakPolarHBondContact O-CA 3.27Å; L441-R468 PolarHBondContact O-N 2.9Å; L441-D469 HydrophobicContact CD2-CB 3.68Å; L441-D469 VanDerWaalsContact CD2-OD2 3.28Å; L441-D469 WeakPolarHBondContact CD2-OD2 3.33Å; L441-L474 HydrophobicContact CD2-CD1 4.37Å; L441-L474 HydrophobicContact CD2-CD2 4.23Å; L441-L482 HydrophobicContact CD1-CD2 3.91Å
442	I	94	Very high	92.4	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	119.8	173	-164.6	69.3	0	0	0	109.1	I180 R363 V434 A438 G439 D440 I445 F465 Y467	I180-I442 HydrophobicContact CD1-CG2 4.47Å; I180-I442 HydrophobicContact CG2-CG1 4.17Å; I180-I442 HydrophobicContact CG2-CG2 4.06Å; R363-I442 PolarHBondContact NH1-O 3.06Å; V434-I442 HydrophobicContact CG1-CB 4.25Å; V434-I442 HydrophobicContact CG1-CD1 4.49Å; V434-I442 HydrophobicContact CG1-CG1 4.08Å; V434-I442 HydrophobicContact CG1-CG2 4.21Å; A438-I442 HydrophobicContact CB-CB 4.17Å; A438-I442 HydrophobicContact CB-CG2 4.38Å; G439-I442 WeakPolarHBondContact O-CG2 3.31Å; D440-I442 PolarHBondContact O-N 3.2Å; I442-I445 HydrophobicContact CD1-CD1 4.42Å; I442-I445 HydrophobicContact CD1-CG1 3.89Å; I442-I445 HydrophobicContact CG1-CD1 4.01Å; I442-I445 HydrophobicContact CG1-CG1 3.62Å; I442-F465 HydrophobicContact CD1-CB 3.89Å; I442-F465 HydrophobicContact CD1-CD1 3.78Å; I442-F465 HydrophobicContact CD1-CG 4.29Å; I442-Y467 HydrophobicContact CD1-CD1 4.02Å; I442-Y467 HydrophobicContact CD1-CE1 3.83Å; I442-Y467 HydrophobicContact CD1-CE2 4.41Å; I442-Y467 HydrophobicContact CD1-CG 4.39Å
443	E	91.2	Very high	92.3	Very high	21 Å²	21	44.9 Å²	44.9	10%	0.098	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	-47.3	176.3	170.2	164.7	-81.3	0	0	111.2	D181 R363 L441 I466 R468	D181-E443 WeakPolarHBondContact CA-O 3.31Å; R363-E443 VanDerWaalsContact CZ-CB 3.48Å; R363-E443 IonicContact CZ-OE1 3.34Å; R363-E443 VanDerWaalsContact NH2-CB 3.32Å; R363-E443 IonicContact NH2-OE1 2.68Å; R363-E443 PolarHBondContact NH2-OE1 3.29Å; L441-E443 PolarHBondContact O-N 3.25Å; E443-I466 HydrophobicContact CB-CG2 4.36Å; E443-I466 WeakPolarHBondContact CB-O 3.48Å; E443-I466 PolarHBondContact N-O 2.91Å; E443-R468 HydrophobicContact CB-CB 4.14Å; E443-R468 VanDerWaalsContact CD-NE 3.27Å; E443-R468 WeakPolarHBondContact OE1-CD 3.32Å; E443-R468 IonicContact OE1-CZ 3.68Å; E443-R468 IonicContact OE1-NE 2.68Å; E443-R468 PolarHBondContact OE1-NE 2.97Å; E443-R468 IonicContact OE1-NH2 3.91Å; E443-R468 IonicContact OE2-CZ 3.3Å; E443-R468 VanDerWaalsContact OE2-CZ 3.3Å; E443-R468 IonicContact OE2-NE 2.73Å; E443-R468 PolarHBondContact OE2-NE 3.17Å; E443-R468 IonicContact OE2-NH2 2.86Å; E443-R468 PolarHBondContact OE2-NH2 3.08Å
444	Q	92.4	Very high	92.1	Very high	46 Å²	46	49.5 Å²	49.5	22%	0.215	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	142.6	-175.6	-166.2	175.5	25.6	0	0	110.6	I180 D181 I466	I180-Q444 VanDerWaalsContact O-CA 3.26Å; I180-Q444 WeakPolarHBondContact O-CA 3.38Å; I180-Q444 WeakPolarHBondContact O-CG 3.29Å; D181-Q444 HydrophobicContact CB-CG 4.23Å; Q444-I466 HydrophobicContact CB-CB 4.06Å; Q444-I466 HydrophobicContact CB-CD1 4.09Å; Q444-I466 HydrophobicContact CB-CG1 4.19Å; Q444-I466 PolarHBondContact N-O 2.79Å; Q444-I466 PolarHBondContact O-N 2.64Å
445	I	93.9	Very high	91.8	Very high	9 Å²	9	58.8 Å²	58.8	5%	0.046	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	134.1	163	-53.2	-179.2	0	0	0	107.9	I180 F431 V434 I442 Y463 R464 F465	I180-I445 HydrophobicContact CB-CB 4.39Å; I180-I445 HydrophobicContact CB-CG1 4.25Å; I180-I445 HydrophobicContact CD1-CD1 3.67Å; I180-I445 HydrophobicContact CD1-CG1 4.21Å; I180-I445 HydrophobicContact CG2-CG1 4.24Å; I180-I445 PolarHBondContact O-N 3.32Å; F431-I445 HydrophobicContact CD1-CB 4.27Å; F431-I445 HydrophobicContact CD1-CD1 4.05Å; F431-I445 HydrophobicContact CD1-CG2 4.28Å; F431-I445 HydrophobicContact CE1-CB 3.87Å; F431-I445 HydrophobicContact CE1-CD1 4.45Å; F431-I445 HydrophobicContact CE1-CG2 3.69Å; V434-I445 HydrophobicContact CB-CD1 3.81Å; V434-I445 HydrophobicContact CG1-CD1 3.59Å; V434-I445 HydrophobicContact CG2-CD1 3.96Å; I442-I445 HydrophobicContact CD1-CD1 4.42Å; I442-I445 HydrophobicContact CD1-CG1 3.89Å; I442-I445 HydrophobicContact CG1-CD1 4.01Å; I442-I445 HydrophobicContact CG1-CG1 3.62Å; I445-Y463 HydrophobicContact CG2-CD1 3.8Å; I445-Y463 HydrophobicContact CG2-CG 4.33Å; I445-R464 WeakPolarHBondContact CA-O 3.26Å; I445-F465 HydrophobicContact CD1-CD1 3.89Å; I445-F465 HydrophobicContact CD1-CE1 3.66Å; I445-F465 HydrophobicContact CD1-CZ 4.33Å; I445-F465 HydrophobicContact CG1-CD1 4.01Å; I445-F465 HydrophobicContact CG1-CE1 4.23Å; I445-F465 HydrophobicContact CG1-CG 4.5Å; I445-F465 HydrophobicContact CG2-CE2 4.41Å; I445-F465 HydrophobicContact CG2-CZ 4.37Å
446	R	91.9	Very high	91.6	Very high	97 Å²	97	62.6 Å²	62.6	37%	0.366	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	138	175.4	64.2	-171.7	-170.3	-152.8	9	111.4	V448 Y463 R464	R446-V448 HydrophobicContact CG-CG1 4.04Å; R446-V448 PolarHBondContact O-N 2.8Å; R446-Y463 CarbonylContact O-C 3.54Å; R446-Y463 WeakPolarHBondContact O-CA 3.15Å; R446-R464 HydrophobicContact CG-CB 3.97Å; R446-R464 PolarHBondContact N-O 3Å; R446-R464 PolarHBondContact O-N 2.74Å
447	L	90.8	Very high	91.2	Very high	69 Å²	69	63.1 Å²	63.1	36%	0.361	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	121.9	168.1	-175.4	70	0	0	0	108.4	D449 L461 Y463	L447-D449 WeakPolarHBondContact CD1-O 3.35Å; L447-L461 HydrophobicContact CD1-CB 3.99Å; L447-L461 HydrophobicContact CD1-CD2 4.06Å; L447-Y463 HydrophobicContact CB-CD1 4.13Å; L447-Y463 HydrophobicContact CB-CE1 3.79Å; L447-Y463 HydrophobicContact CD1-CD1 4.31Å; L447-Y463 HydrophobicContact CD1-CD2 4.15Å; L447-Y463 HydrophobicContact CD1-CE1 3.91Å; L447-Y463 HydrophobicContact CD1-CE2 3.74Å; L447-Y463 HydrophobicContact CD1-CG 4.44Å; L447-Y463 HydrophobicContact CG-CE1 4.44Å
448	V	93	Very high	90.8	Very high	60 Å²	60	64.3 Å²	64.3	36%	0.364	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	-25.6	179.6	-70	0	0	0	0	112.9	R446 C462 R464	R446-V448 HydrophobicContact CG-CG1 4.04Å; R446-V448 PolarHBondContact O-N 2.8Å; V448-C462 HydrophobicContact CG2-CB 3.89Å; V448-C462 WeakPolarHBondContact CG2-O 3.22Å; V448-C462 VanDerWaalsContact CG2-SG 3.52Å; V448-C462 PolarHBondContact N-O 2.72Å; V448-R464 HydrophobicContact CG1-CB 3.57Å; V448-R464 HydrophobicContact CG2-CB 4.47Å
449	D	92.8	Very high	90.6	Very high	86 Å²	86	65.8 Å²	65.8	46%	0.46	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	144.5	177.6	-174.1	48.2	0	0	0	111.3	L447 C462	L447-D449 WeakPolarHBondContact CD1-O 3.35Å; D449-C462 HydrophobicContact CB-CB 3.95Å; D449-C462 PolarHBondContact N-O 2.64Å; D449-C462 PolarHBondContact O-N 3.18Å
450	S	91	Very high	90.6	Very high	55 Å²	55	65 Å²	65	39%	0.385	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	118.1	171	166.4	0	0	0	0	108.7	Q459 S460	S450-Q459 PolarHBondContact OG-NE2 3.18Å; S450-Q459 VanDerWaalsContact OG-NE2 3.1Å; S450-S460 WeakPolarHBondContact CA-O 3.36Å
451	Y	89.4	Confident	90.7	Very high	99 Å²	99	62.2 Å²	62.2	39%	0.388	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	136.4	-172.2	166.6	-101.9	0	0	0	110.7	W403 D453 P454 Q459 S460	W403-Y451 HydrophobicContact CH2-CD1 4.31Å; W403-Y451 HydrophobicContact CH2-CE1 4.25Å; W403-Y451 HydrophobicContact CZ3-CD1 4.5Å; Y451-D453 VanDerWaalsContact CE1-CA 3.49Å; Y451-D453 HydrophobicContact CE1-CB 3.83Å; Y451-P454 WeakPolarHBondContact OH-CD 3.33Å; Y451-Q459 CarbonylContact O-C 3.51Å; Y451-Q459 WeakPolarHBondContact O-CA 3.41Å; Y451-S460 PolarHBondContact N-O 3.34Å; Y451-S460 PolarHBondContact O-N 2.83Å
452	I	89.6	Confident	90.8	Very high	103 Å²	103	60.4 Å²	60.4	53%	0.528	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	121.3	171	-61.4	175.4	0	0	0	108	P454 Q459	I452-P454 WeakPolarHBondContact O-CD 2.9Å; I452-Q459 HydrophobicContact CG1-CB 4.3Å; I452-Q459 HydrophobicContact CG1-CG 4.2Å
453	D	89.4	Confident	90.9	Very high	31 Å²	31	60.4 Å²	60.4	17%	0.166	32%	0.316	C	S	.	.			trans	-69.9	120	175.6	179.8	-86.5	0	0	0	110.3	W403 Y451 K455 T456 G457 R458	W403-D453 HydrophobicContact CH2-CB 3.89Å; W403-D453 HydrophobicContact CZ3-CB 3.78Å; Y451-D453 VanDerWaalsContact CE1-CA 3.49Å; Y451-D453 HydrophobicContact CE1-CB 3.83Å; D453-K455 PolarHBondContact O-N 3.16Å; D453-K455 WeakPolarHBondContact OD1-CA 3.38Å; D453-K455 WeakPolarHBondContact OD1-CB 3.46Å; D453-K455 PolarHBondContact OD1-N 2.86Å; D453-T456 WeakPolarHBondContact CB-OG1 3.38Å; D453-T456 PolarHBondContact OD1-N 2.93Å; D453-T456 PolarHBondContact OD1-OG1 3.18Å; D453-G457 VanDerWaalsContact O-CA 3.22Å; D453-G457 WeakPolarHBondContact O-CA 3.36Å; D453-G457 PolarHBondContact O-N 3.38Å; D453-R458 PolarHBondContact N-O 2.97Å
454	P	89.4	Confident	91.1	Very high	110 Å²	110	62.8 Å²	62.8	71%	0.714	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-15.2	-172.3	28.7	-34.8	0	0	0	113.3	Y451 I452	Y451-P454 WeakPolarHBondContact OH-CD 3.33Å; I452-P454 WeakPolarHBondContact O-CD 2.9Å
455	K	89.8	Confident	91.4	Very high	196 Å²	196	60.6 Å²	60.6	85%	0.852	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-39.9	179.9	-63.8	178.8	-179.1	175.6	0	111.7	D453	D453-K455 PolarHBondContact O-N 3.16Å; D453-K455 WeakPolarHBondContact OD1-CA 3.38Å; D453-K455 WeakPolarHBondContact OD1-CB 3.46Å; D453-K455 PolarHBondContact OD1-N 2.86Å
456	T	87.6	Confident	91.4	Very high	84 Å²	84	60.6 Å²	60.6	52%	0.515	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.9	-17.1	-175.1	61.5	0	0	0	0	112.9	D453 R458	D453-T456 WeakPolarHBondContact CB-OG1 3.38Å; D453-T456 PolarHBondContact OD1-N 2.93Å; D453-T456 PolarHBondContact OD1-OG1 3.18Å; T456-R458 PolarHBondContact O-N 3.04Å; T456-R458 WeakPolarHBondContact OG1-CB 3.34Å; T456-R458 PolarHBondContact OG1-N 2.85Å
457	G	84.7	Confident	91.6	Very high	52 Å²	52	56 Å²	56	54%	0.536	30%	0.297	S	S	.	.			trans	70	0.3	-170.7	0	0	0	0	0	113.8	D453	D453-G457 VanDerWaalsContact O-CA 3.22Å; D453-G457 WeakPolarHBondContact O-CA 3.36Å; D453-G457 PolarHBondContact O-N 3.38Å
458	R	86.5	Confident	91.6	Very high	95 Å²	95	54.8 Å²	54.8	36%	0.358	29%	0.288	S	S	.	.			trans	-73.2	137.3	-177	-69.4	-176.1	175.5	-173.2	-2.3	110.7	W403 D453 T456	W403-R458 HydrophobicContact CE3-CB 3.78Å; W403-R458 HydrophobicContact CZ3-CB 4.17Å; W403-R458 WeakPolarHBondContact CZ3-O 3.49Å; D453-R458 PolarHBondContact N-O 2.97Å; T456-R458 PolarHBondContact O-N 3.04Å; T456-R458 WeakPolarHBondContact OG1-CB 3.34Å; T456-R458 PolarHBondContact OG1-N 2.85Å
459	Q	89	Confident	91.4	Very high	39 Å²	39	53 Å²	53	18%	0.182	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	130.5	174.1	-172.2	170.3	15.3	0	0	110.2	W403 L404 S450 Y451 I452 L461	W403-Q459 WeakPolarHBondContact CA-O 3.32Å; L404-Q459 HydrophobicContact CD1-CB 4.1Å; L404-Q459 HydrophobicContact CD1-CG 4.26Å; L404-Q459 HydrophobicContact CG-CB 4.36Å; L404-Q459 PolarHBondContact N-O 3.09Å; S450-Q459 PolarHBondContact OG-NE2 3.18Å; S450-Q459 VanDerWaalsContact OG-NE2 3.1Å; Y451-Q459 CarbonylContact O-C 3.51Å; Y451-Q459 WeakPolarHBondContact O-CA 3.41Å; I452-Q459 HydrophobicContact CG1-CB 4.3Å; I452-Q459 HydrophobicContact CG1-CG 4.2Å; Q459-L461 HydrophobicContact CG-CD2 4.31Å
460	S	92.2	Very high	90.8	Very high	2 Å²	2	50.6 Å²	50.6	1%	0.014	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	139.9	168.5	-170.5	0	0	0	0	110	F402 S450 Y451	F402-S460 CarbonylContact O-C 3.59Å; F402-S460 WeakPolarHBondContact O-CA 3.48Å; F402-S460 PolarHBondContact O-OG 3.07Å; F402-S460 VanDerWaalsContact O-OG 3.09Å; S450-S460 WeakPolarHBondContact CA-O 3.36Å; Y451-S460 PolarHBondContact N-O 3.34Å; Y451-S460 PolarHBondContact O-N 2.83Å
461	L	93.1	Very high	90.4	Very high	0 Å²	0	52 Å²	52	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	135.6	171.5	-56.6	174.5	0	0	0	108.3	S401 F402 L404 I423 L447 Q459 Y463	S401-L461 WeakPolarHBondContact CA-O 3.41Å; F402-L461 HydrophobicContact CD2-CB 4.28Å; F402-L461 PolarHBondContact N-O 2.83Å; F402-L461 PolarHBondContact O-N 2.98Å; L404-L461 HydrophobicContact CD1-CD1 4.24Å; L404-L461 HydrophobicContact CD2-CD1 3.96Å; L404-L461 HydrophobicContact CG-CD1 4.31Å; I423-L461 HydrophobicContact CG2-CD1 4.13Å; I423-L461 HydrophobicContact CG2-CD2 4.26Å; L447-L461 HydrophobicContact CD1-CB 3.99Å; L447-L461 HydrophobicContact CD1-CD2 4.06Å; Q459-L461 HydrophobicContact CG-CD2 4.31Å; L461-Y463 HydrophobicContact CB-CD2 4.24Å; L461-Y463 HydrophobicContact CB-CE2 3.66Å; L461-Y463 HydrophobicContact CD1-CE2 4.08Å; L461-Y463 HydrophobicContact CG-CE2 4.49Å
462	C	95.3	Very high	90.3	Very high	14 Å²	14	53.1 Å²	53.1	10%	0.095	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	126	172.3	-175.3	0	0	0	0	109.4	S401 V448 D449	S401-C462 WeakPolarHBondContact OG-CB 3.47Å; S401-C462 PolarHBondContact OG-SG 3.05Å; V448-C462 HydrophobicContact CG2-CB 3.89Å; V448-C462 WeakPolarHBondContact CG2-O 3.22Å; V448-C462 VanDerWaalsContact CG2-SG 3.52Å; V448-C462 PolarHBondContact N-O 2.72Å; D449-C462 HydrophobicContact CB-CB 3.95Å; D449-C462 PolarHBondContact N-O 2.64Å; D449-C462 PolarHBondContact O-N 3.18Å
463	Y	95.5	Very high	90.3	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	137.6	178.3	-72.5	-92.6	0	0	0	110.3	D399 L400 F402 E427 I430 F431 I445 R446 L447 L461 F465	D399-Y463 CarbonylContact C-O 3.48Å; D399-Y463 WeakPolarHBondContact CA-O 3.44Å; L400-Y463 PolarHBondContact N-O 2.94Å; L400-Y463 PolarHBondContact O-N 3.24Å; F402-Y463 HydrophobicContact CD2-CD2 4.34Å; F402-Y463 HydrophobicContact CD2-CE2 4.44Å; F402-Y463 AromaticContact CE2-CD2 3.26Å; F402-Y463 HydrophobicContact CE2-CD2 3.26Å; F402-Y463 AromaticContact CE2-CE2 3.52Å; F402-Y463 HydrophobicContact CE2-CE2 3.52Å; F402-Y463 HydrophobicContact CE2-CG 4.41Å; F402-Y463 AromaticContact CZ-CD2 3.67Å; F402-Y463 HydrophobicContact CZ-CD2 3.67Å; F402-Y463 HydrophobicContact CZ-CE2 4.27Å; F402-Y463 HydrophobicContact CZ-CG 4.46Å; E427-Y463 HydrophobicContact CG-CE1 4.12Å; E427-Y463 VanDerWaalsContact OE1-CE1 3.32Å; E427-Y463 WeakPolarHBondContact OE1-CE1 3.47Å; E427-Y463 PolarHBondContact OE1-OH 2.87Å; E427-Y463 VanDerWaalsContact OE1-OH 3.1Å; I430-Y463 HydrophobicContact CD1-CD2 4.35Å; I430-Y463 HydrophobicContact CD1-CE2 3.84Å; F431-Y463 HydrophobicContact CE1-CE1 4.35Å; I445-Y463 HydrophobicContact CG2-CD1 3.8Å; I445-Y463 HydrophobicContact CG2-CG 4.33Å; R446-Y463 CarbonylContact O-C 3.54Å; R446-Y463 WeakPolarHBondContact O-CA 3.15Å; L447-Y463 HydrophobicContact CB-CD1 4.13Å; L447-Y463 HydrophobicContact CB-CE1 3.79Å; L447-Y463 HydrophobicContact CD1-CD1 4.31Å; L447-Y463 HydrophobicContact CD1-CD2 4.15Å; L447-Y463 HydrophobicContact CD1-CE1 3.91Å; L447-Y463 HydrophobicContact CD1-CE2 3.74Å; L447-Y463 HydrophobicContact CD1-CG 4.44Å; L447-Y463 HydrophobicContact CG-CE1 4.44Å; L461-Y463 HydrophobicContact CB-CD2 4.24Å; L461-Y463 HydrophobicContact CB-CE2 3.66Å; L461-Y463 HydrophobicContact CD1-CE2 4.08Å; L461-Y463 HydrophobicContact CG-CE2 4.49Å; Y463-F465 WeakPolarHBondContact O-CD2 3.28Å
464	R	96.7	Very high	90.5	Very high	71 Å²	71	51.3 Å²	51.3	27%	0.268	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	124.1	170.1	176.5	161.5	-66.1	158.9	13.7	110	I397 D399 I445 R446 V448 I466	I397-R464 HydrophobicContact CG2-CG 3.66Å; D399-R464 WeakPolarHBondContact OD1-CA 3.33Å; D399-R464 WeakPolarHBondContact OD1-CB 3.28Å; D399-R464 VanDerWaalsContact OD1-CG 3.25Å; D399-R464 WeakPolarHBondContact OD1-CG 3.38Å; D399-R464 IonicContact OD1-CZ 2.87Å; D399-R464 IonicContact OD1-NE 3.54Å; D399-R464 PolarHBondContact OD1-NE 3.08Å; D399-R464 IonicContact OD1-NH2 3.61Å; D399-R464 IonicContact OD2-CZ 2.91Å; D399-R464 IonicContact OD2-NE 2.84Å; D399-R464 IonicContact OD2-NH2 3.67Å; D399-R464 PolarHBondContact OD2-NH2 2.64Å; I445-R464 WeakPolarHBondContact CA-O 3.26Å; R446-R464 HydrophobicContact CG-CB 3.97Å; R446-R464 PolarHBondContact N-O 3Å; R446-R464 PolarHBondContact O-N 2.74Å; V448-R464 HydrophobicContact CG1-CB 3.57Å; V448-R464 HydrophobicContact CG2-CB 4.47Å; R464-I466 HydrophobicContact CG-CG1 4.31Å
465	F	97	Very high	90.7	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	122.7	177.3	-67.3	-114.9	0	0	0	108.6	I397 L398 L400 I430 V434 I442 I445 Y463 Y467 H483 I486 L490	I397-F465 WeakPolarHBondContact CA-O 3.41Å; L398-F465 PolarHBondContact N-O 3.48Å; L398-F465 PolarHBondContact O-N 2.94Å; L400-F465 HydrophobicContact CB-CD2 4.25Å; L400-F465 HydrophobicContact CB-CE2 3.79Å; L400-F465 HydrophobicContact CD2-CE2 4.43Å; L400-F465 HydrophobicContact CD2-CZ 4.42Å; I430-F465 HydrophobicContact CG2-CZ 4.49Å; V434-F465 HydrophobicContact CB-CE1 4.41Å; V434-F465 HydrophobicContact CG1-CD1 4.26Å; V434-F465 HydrophobicContact CG1-CE1 3.96Å; V434-F465 HydrophobicContact CG2-CE1 3.59Å; V434-F465 HydrophobicContact CG2-CZ 4.23Å; I442-F465 HydrophobicContact CD1-CB 3.89Å; I442-F465 HydrophobicContact CD1-CD1 3.78Å; I442-F465 HydrophobicContact CD1-CG 4.29Å; I445-F465 HydrophobicContact CD1-CD1 3.89Å; I445-F465 HydrophobicContact CD1-CE1 3.66Å; I445-F465 HydrophobicContact CD1-CZ 4.33Å; I445-F465 HydrophobicContact CG1-CD1 4.01Å; I445-F465 HydrophobicContact CG1-CE1 4.23Å; I445-F465 HydrophobicContact CG1-CG 4.5Å; I445-F465 HydrophobicContact CG2-CE2 4.41Å; I445-F465 HydrophobicContact CG2-CZ 4.37Å; Y463-F465 WeakPolarHBondContact O-CD2 3.28Å; F465-Y467 HydrophobicContact CB-CD2 4.22Å; F465-Y467 HydrophobicContact CB-CE2 3.5Å; F465-Y467 HydrophobicContact CG-CE2 4.4Å; F465-H483 AromaticContact CD2-CE1 3.69Å; F465-H483 AromaticContact CG-CE1 3.72Å; F465-I486 HydrophobicContact CE1-CG2 4.19Å; F465-L490 HydrophobicContact CZ-CD1 4.41Å
466	I	94.5	Very high	91	Very high	10 Å²	10	42.9 Å²	42.9	5%	0.051	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	108.9	174.7	-52.6	-172.1	0	0	0	107.1	P395 I397 E443 Q444 R464	P395-I466 HydrophobicContact CB-CG2 3.69Å; I397-I466 HydrophobicContact CG1-CG1 4.43Å; I397-I466 HydrophobicContact CG1-CG2 4.39Å; E443-I466 HydrophobicContact CB-CG2 4.36Å; E443-I466 WeakPolarHBondContact CB-O 3.48Å; E443-I466 PolarHBondContact N-O 2.91Å; Q444-I466 HydrophobicContact CB-CB 4.06Å; Q444-I466 HydrophobicContact CB-CD1 4.09Å; Q444-I466 HydrophobicContact CB-CG1 4.19Å; Q444-I466 PolarHBondContact N-O 2.79Å; Q444-I466 PolarHBondContact O-N 2.64Å; R464-I466 HydrophobicContact CG-CG1 4.31Å
467	Y	95.3	Very high	91.3	Very high	1 Å²	1	45.2 Å²	45.2	0%	0.004	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	127.8	175.4	-62.6	-88.1	0	0	0	109.7	P395 C396 L398 A438 L441 I442 F465 V479 L482 H483 I486	P395-Y467 CarbonylContact C-O 3.54Å; P395-Y467 VanDerWaalsContact CA-O 3.25Å; P395-Y467 WeakPolarHBondContact CA-O 3.32Å; C396-Y467 PolarHBondContact N-O 3.31Å; C396-Y467 PolarHBondContact O-N 2.92Å; L398-Y467 HydrophobicContact CD1-CE2 4.48Å; A438-Y467 HydrophobicContact CB-CE1 4.34Å; L441-Y467 CarbonylContact O-C 3.5Å; L441-Y467 VanDerWaalsContact O-CA 3.25Å; L441-Y467 WeakPolarHBondContact O-CA 3.27Å; I442-Y467 HydrophobicContact CD1-CD1 4.02Å; I442-Y467 HydrophobicContact CD1-CE1 3.83Å; I442-Y467 HydrophobicContact CD1-CE2 4.41Å; I442-Y467 HydrophobicContact CD1-CG 4.39Å; F465-Y467 HydrophobicContact CB-CD2 4.22Å; F465-Y467 HydrophobicContact CB-CE2 3.5Å; F465-Y467 HydrophobicContact CG-CE2 4.4Å; Y467-V479 HydrophobicContact CD1-CG1 4.19Å; Y467-V479 HydrophobicContact CD2-CG1 3.39Å; Y467-V479 HydrophobicContact CE2-CG1 3.84Å; Y467-V479 HydrophobicContact CG-CG1 3.58Å; Y467-L482 HydrophobicContact CE1-CD2 4.27Å; Y467-H483 HydrophobicContact CE2-CB 4.38Å; Y467-H483 AromaticContact CE2-ND1 3.45Å; Y467-H483 WeakPolarHBondContact CE2-ND1 3.32Å; Y467-H483 AromaticContact CZ-ND1 3.56Å; Y467-H483 PolarHBondContact OH-ND1 2.75Å; Y467-I486 HydrophobicContact CE1-CD1 4.22Å; Y467-I486 WeakPolarHBondContact OH-CD1 3.46Å
468	R	91.4	Very high	91.7	Very high	42 Å²	42	46.8 Å²	46.8	16%	0.158	23%	0.232	C	C	.	.			trans	-150.7	123.3	172.7	-166.4	-170.8	-52.9	-134.2	12.1	109.6	R363 F393 P395 L441 E443	R363-R468 PolarHBondContact NH1-O 3.37Å; R363-R468 VanDerWaalsContact NH1-O 3.09Å; F393-R468 VanDerWaalsContact O-CD 3.25Å; F393-R468 WeakPolarHBondContact O-CD 3.37Å; F393-R468 WeakPolarHBondContact O-CG 3.36Å; F393-R468 PolarHBondContact O-NH1 3.19Å; P395-R468 HydrophobicContact CB-CB 4.49Å; L441-R468 PolarHBondContact O-N 2.9Å; E443-R468 HydrophobicContact CB-CB 4.14Å; E443-R468 VanDerWaalsContact CD-NE 3.27Å; E443-R468 WeakPolarHBondContact OE1-CD 3.32Å; E443-R468 IonicContact OE1-CZ 3.68Å; E443-R468 IonicContact OE1-NE 2.68Å; E443-R468 PolarHBondContact OE1-NE 2.97Å; E443-R468 IonicContact OE1-NH2 3.91Å; E443-R468 IonicContact OE2-CZ 3.3Å; E443-R468 VanDerWaalsContact OE2-CZ 3.3Å; E443-R468 IonicContact OE2-NE 2.73Å; E443-R468 PolarHBondContact OE2-NE 3.17Å; E443-R468 IonicContact OE2-NH2 2.86Å; E443-R468 PolarHBondContact OE2-NH2 3.08Å
469	D	88.5	Confident	92.1	Very high	22 Å²	22	42.4 Å²	42.4	12%	0.118	22%	0.216	C	C	.	.			trans	-88.2	136.3	172	-171.8	-48.2	0	0	0	108.8	F393 L441 H471 K472 L474	F393-D469 VanDerWaalsContact CD2-O 3.3Å; F393-D469 WeakPolarHBondContact CD2-O 3.36Å; L441-D469 HydrophobicContact CD2-CB 3.68Å; L441-D469 VanDerWaalsContact CD2-OD2 3.28Å; L441-D469 WeakPolarHBondContact CD2-OD2 3.33Å; D469-H471 PolarHBondContact O-N 2.6Å; D469-H471 WeakPolarHBondContact OD1-CA 3.26Å; D469-H471 WeakPolarHBondContact OD1-CB 3.41Å; D469-H471 IonicContact OD1-CD2 3.63Å; D469-H471 IonicContact OD1-CG 3.71Å; D469-H471 PolarHBondContact OD1-N 3.35Å; D469-K472 HydrophobicContact CB-CG 4.13Å; D469-K472 WeakPolarHBondContact CB-O 3.48Å; D469-K472 PolarHBondContact OD1-N 2.87Å; D469-K472 WeakPolarHBondContact OD2-CE 3.32Å; D469-L474 HydrophobicContact CB-CD1 4.06Å; D469-L474 HydrophobicContact CB-CD2 3.8Å; D469-L474 HydrophobicContact CB-CG 3.79Å
470	Q	81.6	Confident	92.5	Very high	37 Å²	37	46.2 Å²	46.2	17%	0.173	23%	0.228	C	C	.	.	S	Bend	trans	-78.3	-3.9	-178.8	-64.7	-66.6	-27.3	0	0	112.8	L364 F393	L364-Q470 HydrophobicContact CD2-CB 4.1Å; L364-Q470 HydrophobicContact CD2-CG 4.02Å; F393-Q470 WeakPolarHBondContact CE2-O 3.48Å
471	H	82.7	Confident	92.8	Very high	83 Å²	83	49.7 Å²	49.7	38%	0.384	25%	0.251	S	S	.	.	S	Bend	trans	-128.2	-17	-169.4	-50.9	-49.1	0	0	0	114.3	S367 D369 F393 D469	S367-H471 PolarHBondContact OG-CE1 3.32Å; S367-H471 PolarHBondContact OG-NE2 2.93Å; D369-H471 WeakPolarHBondContact CB-CE1 3.16Å; D369-H471 WeakPolarHBondContact CB-ND1 3.23Å; D369-H471 IonicContact OD2-ND1 3.14Å; F393-H471 VanDerWaalsContact CE2-CA 3.45Å; F393-H471 VanDerWaalsContact CZ-O 3.27Å; F393-H471 WeakPolarHBondContact CZ-O 3.32Å; D469-H471 PolarHBondContact O-N 2.6Å; D469-H471 WeakPolarHBondContact OD1-CA 3.26Å; D469-H471 WeakPolarHBondContact OD1-CB 3.41Å; D469-H471 IonicContact OD1-CD2 3.63Å; D469-H471 IonicContact OD1-CG 3.71Å; D469-H471 PolarHBondContact OD1-N 3.35Å
472	K	86.9	Confident	92.9	Very high	124 Å²	124	51.5 Å²	51.5	54%	0.539	26%	0.26	S	S	.	.	S	Bend	trans	-152.5	157.4	178	60.8	-179.9	178.4	-178.3	0	112.7	F393 D469 L474	F393-K472 VanDerWaalsContact CE2-N 3.29Å; F393-K472 WeakPolarHBondContact CG-O 3.39Å; D469-K472 HydrophobicContact CB-CG 4.13Å; D469-K472 WeakPolarHBondContact CB-O 3.48Å; D469-K472 PolarHBondContact OD1-N 2.87Å; D469-K472 WeakPolarHBondContact OD2-CE 3.32Å; K472-L474 PolarHBondContact O-N 3.44Å
473	T	90.4	Very high	93	Very high	82 Å²	82	51.5 Å²	51.5	50%	0.503	26%	0.259	S	S	.	.			trans	-67.2	126.6	167.7	-58.4	0	0	0	0	109.8	F393 P394	F393-T473 WeakPolarHBondContact CD1-OG1 3.42Å; P394-T473 HydrophobicContact CG-CG2 3.9Å
474	L	92	Very high	93.1	Very high	14 Å²	14	57.3 Å²	57.3	7%	0.073	29%	0.286	C	S	.	.			trans	-83.8	144.8	169.3	-64	179.2	0	0	0	110.1	L441 D469 K472 V479	L441-L474 HydrophobicContact CD2-CD1 4.37Å; L441-L474 HydrophobicContact CD2-CD2 4.23Å; D469-L474 HydrophobicContact CB-CD1 4.06Å; D469-L474 HydrophobicContact CB-CD2 3.8Å; D469-L474 HydrophobicContact CB-CG 3.79Å; K472-L474 PolarHBondContact O-N 3.44Å; L474-V479 HydrophobicContact CB-CG2 3.84Å; L474-V479 HydrophobicContact CD1-CG2 3.99Å; L474-V479 HydrophobicContact CG-CG2 4.37Å
475	T	93.9	Very high	93.1	Very high	69 Å²	69	57 Å²	57	42%	0.423	29%	0.29	S	S	.	.			trans	-111.3	152.8	170.7	68.6	0	0	0	0	110	D477 T478 V479	T475-D477 PolarHBondContact O-N 2.92Å; T475-D477 VanDerWaalsContact O-N 3.17Å; T475-T478 PolarHBondContact N-OG1 2.96Å; T475-T478 PolarHBondContact O-N 2.84Å; T475-T478 PolarHBondContact O-OG1 2.91Å; T475-T478 PolarHBondContact OG1-N 3.36Å; T475-T478 PolarHBondContact OG1-OG1 3.4Å; T475-V479 WeakPolarHBondContact O-CG2 3.42Å; T475-V479 PolarHBondContact O-N 3.23Å
476	M	95.4	Very high	93.1	Very high	60 Å²	60	57 Å²	57	30%	0.296	29%	0.29	S	S	.	.	H	α-helix	trans	-57.1	-31.8	176.4	-75.6	-67.2	171.4	0	0	112.7	C396 L398 T478 V479 R480	C396-M476 HydrophobicContact CB-CE 3.79Å; C396-M476 HydrophobicContact CB-SD 4.23Å; L398-M476 HydrophobicContact CD2-SD 4.2Å; L398-M476 HydrophobicContact CG-SD 4.44Å; M476-T478 VanDerWaalsContact C-N 3.26Å; M476-T478 PolarHBondContact O-N 3.39Å; M476-V479 PolarHBondContact O-N 3.09Å; M476-R480 WeakPolarHBondContact O-CB 3.26Å; M476-R480 WeakPolarHBondContact O-CG 3.42Å; M476-R480 PolarHBondContact O-N 3.09Å
477	D	95.1	Very high	93.2	Very high	133 Å²	133	56.6 Å²	56.6	71%	0.711	29%	0.288	S	S	*	.	H	α-helix	trans	-66.1	-29.8	177.1	-60	-22.8	0	0	0	112.5	T475 P481	T475-D477 PolarHBondContact O-N 2.92Å; T475-D477 VanDerWaalsContact O-N 3.17Å; D477-P481 WeakPolarHBondContact O-CD 3.12Å; D477-P481 WeakPolarHBondContact O-CG 3.41Å
478	T	92	Very high	93.3	Very high	84 Å²	84	62.5 Å²	62.5	52%	0.515	32%	0.316	S	S	.	.	H	α-helix	trans	-83.4	-33.3	174.2	58.8	0	0	0	0	112.8	T475 M476	T475-T478 PolarHBondContact N-OG1 2.96Å; T475-T478 PolarHBondContact O-N 2.84Å; T475-T478 PolarHBondContact O-OG1 2.91Å; T475-T478 PolarHBondContact OG1-N 3.36Å; T475-T478 PolarHBondContact OG1-OG1 3.4Å; M476-T478 VanDerWaalsContact C-N 3.26Å; M476-T478 PolarHBondContact O-N 3.39Å
479	V	96.2	Very high	93.4	Very high	4 Å²	4	61.4 Å²	61.4	2%	0.024	31%	0.313	C	S	.	.	H	α-helix	trans	-86.5	-37.4	-173	177.9	0	0	0	0	112.6	C396 L398 Y467 L474 T475 M476 L482 H483	C396-V479 HydrophobicContact CB-CB 4.23Å; C396-V479 HydrophobicContact CB-CG1 4.13Å; C396-V479 HydrophobicContact CB-CG2 3.94Å; L398-V479 HydrophobicContact CD1-CG1 3.85Å; Y467-V479 HydrophobicContact CD1-CG1 4.19Å; Y467-V479 HydrophobicContact CD2-CG1 3.39Å; Y467-V479 HydrophobicContact CE2-CG1 3.84Å; Y467-V479 HydrophobicContact CG-CG1 3.58Å; L474-V479 HydrophobicContact CB-CG2 3.84Å; L474-V479 HydrophobicContact CD1-CG2 3.99Å; L474-V479 HydrophobicContact CG-CG2 4.37Å; T475-V479 WeakPolarHBondContact O-CG2 3.42Å; T475-V479 PolarHBondContact O-N 3.23Å; M476-V479 PolarHBondContact O-N 3.09Å; V479-L482 PolarHBondContact O-N 3.09Å; V479-H483 WeakPolarHBondContact O-CB 3.18Å; V479-H483 PolarHBondContact O-N 3.24Å
480	R	97	Very high	93.7	Very high	118 Å²	118	60.3 Å²	60.3	45%	0.445	31%	0.308	S	S	.	.	H	α-helix	trans	-57.4	-47.4	-179.3	-76.6	-177.6	-143.3	-77.2	-2.5	113.3	L398 M476 L482 H483 E484	L398-R480 HydrophobicContact CD1-CG 4.33Å; M476-R480 WeakPolarHBondContact O-CB 3.26Å; M476-R480 WeakPolarHBondContact O-CG 3.42Å; M476-R480 PolarHBondContact O-N 3.09Å; R480-L482 VanDerWaalsContact C-N 3.3Å; R480-L482 PolarHBondContact O-N 2.97Å; R480-H483 PolarHBondContact O-N 3.35Å; R480-H483 VanDerWaalsContact O-N 3.12Å; R480-E484 WeakPolarHBondContact O-CB 3.36Å; R480-E484 WeakPolarHBondContact O-CG 3.46Å; R480-E484 PolarHBondContact O-N 2.96Å
481	P	97.5	Very high	94.2	Very high	75 Å²	75	59.6 Å²	59.6	49%	0.487	31%	0.308	S	S	.	.	H	α-helix	trans	-61.4	-38.7	179.3	-23.9	35.1	0	0	0	112.8	D477 N485	D477-P481 WeakPolarHBondContact O-CD 3.12Å; D477-P481 WeakPolarHBondContact O-CG 3.41Å; P481-N485 WeakPolarHBondContact O-CB 3.2Å; P481-N485 PolarHBondContact O-N 3.3Å
482	L	96.6	Very high	94.6	Very high	38 Å²	38	63.2 Å²	63.2	20%	0.199	33%	0.325	C	S	.	.	H	α-helix	trans	-64.3	-44.8	174.4	174.5	62.4	0	0	0	111.2	A438 L441 Y467 V479 R480 N485 I486	A438-L482 HydrophobicContact CB-CD2 4.29Å; L441-L482 HydrophobicContact CD1-CD2 3.91Å; Y467-L482 HydrophobicContact CE1-CD2 4.27Å; V479-L482 PolarHBondContact O-N 3.09Å; R480-L482 VanDerWaalsContact C-N 3.3Å; R480-L482 PolarHBondContact O-N 2.97Å; L482-N485 PolarHBondContact O-N 2.97Å; L482-I486 HydrophobicContact CD1-CD1 4.05Å; L482-I486 HydrophobicContact CD1-CG1 4.36Å; L482-I486 HydrophobicContact CG-CD1 3.89Å; L482-I486 WeakPolarHBondContact O-CD1 3.18Å; L482-I486 VanDerWaalsContact O-CG1 3.27Å; L482-I486 WeakPolarHBondContact O-CG1 3.25Å; L482-I486 PolarHBondContact O-N 3.3Å
483	H	97.7	Very high	94.7	Very high	14 Å²	14	61.9 Å²	61.9	7%	0.065	32%	0.319	C	S	.	.	H	α-helix	trans	-65.1	-40.2	-179.9	-169.4	73.9	0	0	0	112.5	L398 F465 Y467 V479 R480 I486 G487	L398-H483 HydrophobicContact CD1-CB 3.65Å; F465-H483 AromaticContact CD2-CE1 3.69Å; F465-H483 AromaticContact CG-CE1 3.72Å; Y467-H483 HydrophobicContact CE2-CB 4.38Å; Y467-H483 AromaticContact CE2-ND1 3.45Å; Y467-H483 WeakPolarHBondContact CE2-ND1 3.32Å; Y467-H483 AromaticContact CZ-ND1 3.56Å; Y467-H483 PolarHBondContact OH-ND1 2.75Å; V479-H483 WeakPolarHBondContact O-CB 3.18Å; V479-H483 PolarHBondContact O-N 3.24Å; R480-H483 PolarHBondContact O-N 3.35Å; R480-H483 VanDerWaalsContact O-N 3.12Å; H483-I486 WeakPolarHBondContact O-CB 3.21Å; H483-I486 PolarHBondContact O-N 3.21Å; H483-G487 PolarHBondContact O-N 2.99Å
484	E	97.2	Very high	94.6	Very high	122 Å²	122	58.5 Å²	58.5	57%	0.57	30%	0.298	S	S	*	.	H	α-helix	trans	-64	-44.2	173.8	-73.1	170.4	-169.6	0	0	111.5	R480 I486 G487 Q488	R480-E484 WeakPolarHBondContact O-CB 3.36Å; R480-E484 WeakPolarHBondContact O-CG 3.46Å; R480-E484 PolarHBondContact O-N 2.96Å; E484-I486 PolarHBondContact O-N 3.23Å; E484-G487 PolarHBondContact O-N 3.29Å; E484-Q488 WeakPolarHBondContact O-CG 3.45Å; E484-Q488 PolarHBondContact O-N 3.25Å
485	N	96.8	Very high	94.4	Very high	65 Å²	65	60.3 Å²	60.3	35%	0.348	31%	0.308	S	S	.	.	H	α-helix	trans	-60.7	-44.6	174.4	-178.1	68.4	0	0	0	111.6	E437 P481 L482 G487 Q488 V489	E437-N485 PolarHBondContact OE2-ND2 2.77Å; P481-N485 WeakPolarHBondContact O-CB 3.2Å; P481-N485 PolarHBondContact O-N 3.3Å; L482-N485 PolarHBondContact O-N 2.97Å; N485-G487 VanDerWaalsContact C-N 3.3Å; N485-G487 PolarHBondContact O-N 3.14Å; N485-Q488 PolarHBondContact O-N 3.06Å; N485-V489 WeakPolarHBondContact O-CG2 3.47Å; N485-V489 PolarHBondContact O-N 2.86Å
486	I	96.6	Very high	94.2	Very high	1 Å²	1	57.5 Å²	57.5	1%	0.005	29%	0.29	C	S	.	.	H	α-helix	trans	-56.2	-46.7	173.8	-74.2	162.7	0	0	0	110.3	V434 E437 A438 F465 Y467 L482 H483 E484 Q488 V489 L490	V434-I486 HydrophobicContact CG1-CD1 4.43Å; V434-I486 HydrophobicContact CG2-CG2 3.84Å; E437-I486 HydrophobicContact CB-CD1 4.45Å; E437-I486 HydrophobicContact CB-CG1 3.76Å; E437-I486 HydrophobicContact CG-CG1 4.37Å; A438-I486 HydrophobicContact CB-CD1 4.04Å; F465-I486 HydrophobicContact CE1-CG2 4.19Å; Y467-I486 HydrophobicContact CE1-CD1 4.22Å; Y467-I486 WeakPolarHBondContact OH-CD1 3.46Å; L482-I486 HydrophobicContact CD1-CD1 4.05Å; L482-I486 HydrophobicContact CD1-CG1 4.36Å; L482-I486 HydrophobicContact CG-CD1 3.89Å; L482-I486 WeakPolarHBondContact O-CD1 3.18Å; L482-I486 VanDerWaalsContact O-CG1 3.27Å; L482-I486 WeakPolarHBondContact O-CG1 3.25Å; L482-I486 PolarHBondContact O-N 3.3Å; H483-I486 WeakPolarHBondContact O-CB 3.21Å; H483-I486 PolarHBondContact O-N 3.21Å; E484-I486 PolarHBondContact O-N 3.23Å; I486-Q488 VanDerWaalsContact C-N 3.32Å; I486-Q488 PolarHBondContact O-N 3.42Å; I486-V489 PolarHBondContact O-N 3.21Å; I486-L490 HydrophobicContact CG2-CD1 3.77Å; I486-L490 HydrophobicContact CG2-CG 4.15Å; I486-L490 WeakPolarHBondContact O-CB 3.2Å; I486-L490 VanDerWaalsContact O-CG 3.22Å; I486-L490 WeakPolarHBondContact O-CG 3.38Å; I486-L490 PolarHBondContact O-N 2.99Å
487	G	96.8	Very high	94.1	Very high	1 Å²	1	56.7 Å²	56.7	1%	0.01	29%	0.29	C	S	.	.	H	α-helix	trans	-58.6	-42.7	177.4	0	0	0	0	0	113.2	H483 E484 N485 A491 I498	H483-G487 PolarHBondContact O-N 2.99Å; E484-G487 PolarHBondContact O-N 3.29Å; N485-G487 VanDerWaalsContact C-N 3.3Å; N485-G487 PolarHBondContact O-N 3.14Å; G487-A491 VanDerWaalsContact O-CB 3.29Å; G487-A491 WeakPolarHBondContact O-CB 3.39Å; G487-A491 PolarHBondContact O-N 3.4Å; G487-I498 WeakPolarHBondContact O-CD1 3.08Å
488	Q	96.5	Very high	93.9	Very high	125 Å²	125	54.3 Å²	54.3	58%	0.584	28%	0.277	S	S	*	.	H	α-helix	trans	-64.3	-46.1	175.8	-68.8	176.5	3.8	0	0	112.1	E484 N485 I486 L490 A491 E492	E484-Q488 WeakPolarHBondContact O-CG 3.45Å; E484-Q488 PolarHBondContact O-N 3.25Å; N485-Q488 PolarHBondContact O-N 3.06Å; I486-Q488 VanDerWaalsContact C-N 3.32Å; I486-Q488 PolarHBondContact O-N 3.42Å; Q488-L490 PolarHBondContact O-N 2.98Å; Q488-A491 PolarHBondContact O-N 3.5Å; Q488-E492 WeakPolarHBondContact O-CB 3.02Å; Q488-E492 PolarHBondContact O-N 3.49Å
489	V	94.7	Very high	93.9	Very high	18 Å²	18	59 Å²	59	11%	0.109	29%	0.285	C	S	.	.	H	α-helix	trans	-61.8	-43.1	178.5	171.1	0	0	0	0	111.3	E437 N485 I486 K493	E437-V489 HydrophobicContact CG-CB 4.48Å; E437-V489 HydrophobicContact CG-CG1 4.19Å; E437-V489 HydrophobicContact CG-CG2 4.43Å; N485-V489 WeakPolarHBondContact O-CG2 3.47Å; N485-V489 PolarHBondContact O-N 2.86Å; I486-V489 PolarHBondContact O-N 3.21Å; V489-K493 HydrophobicContact CG1-CD 3.88Å; V489-K493 HydrophobicContact CG1-CG 4.35Å; V489-K493 VanDerWaalsContact O-CB 3.3Å; V489-K493 WeakPolarHBondContact O-CB 3.41Å; V489-K493 WeakPolarHBondContact O-CG 3.44Å; V489-K493 PolarHBondContact O-N 2.87Å
490	L	93.6	Very high	93.8	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-64	-46.2	176.5	-68.8	177.8	0	0	0	111.2	L400 F402 I430 L433 V434 F465 I486 Q488 E492 L494	L400-L490 HydrophobicContact CD2-CD1 4.2Å; F402-L490 HydrophobicContact CE1-CD1 3.96Å; F402-L490 HydrophobicContact CZ-CD1 4.24Å; I430-L490 HydrophobicContact CB-CD2 4.24Å; I430-L490 HydrophobicContact CG1-CD1 4.44Å; I430-L490 HydrophobicContact CG1-CD2 4.04Å; I430-L490 HydrophobicContact CG2-CD1 4.07Å; I430-L490 HydrophobicContact CG2-CD2 4.24Å; L433-L490 HydrophobicContact CB-CD2 3.72Å; L433-L490 HydrophobicContact CD1-CD2 3.81Å; L433-L490 HydrophobicContact CG-CD2 4.42Å; V434-L490 HydrophobicContact CG2-CD1 4.19Å; V434-L490 HydrophobicContact CG2-CD2 4.39Å; F465-L490 HydrophobicContact CZ-CD1 4.41Å; I486-L490 HydrophobicContact CG2-CD1 3.77Å; I486-L490 HydrophobicContact CG2-CG 4.15Å; I486-L490 WeakPolarHBondContact O-CB 3.2Å; I486-L490 VanDerWaalsContact O-CG 3.22Å; I486-L490 WeakPolarHBondContact O-CG 3.38Å; I486-L490 PolarHBondContact O-N 2.99Å; Q488-L490 PolarHBondContact O-N 2.98Å; L490-E492 PolarHBondContact O-N 3.22Å; L490-L494 HydrophobicContact CD2-CD1 4.01Å; L490-L494 VanDerWaalsContact O-CB 3.28Å; L490-L494 WeakPolarHBondContact O-CB 3.34Å; L490-L494 PolarHBondContact O-N 2.84Å
491	A	92.8	Very high	93.6	Very high	21 Å²	21	58.8 Å²	58.8	17%	0.174	29%	0.291	C	S	.	.	H	α-helix	trans	-58.7	-45.8	177.7	0	0	0	0	0	112.1	G487 Q488 N495 L496 I498	G487-A491 VanDerWaalsContact O-CB 3.29Å; G487-A491 WeakPolarHBondContact O-CB 3.39Å; G487-A491 PolarHBondContact O-N 3.4Å; Q488-A491 PolarHBondContact O-N 3.5Å; A491-N495 CarbonylContact O-C 3.57Å; A491-N495 WeakPolarHBondContact O-CA 3.41Å; A491-N495 PolarHBondContact O-N 2.71Å; A491-N495 VanDerWaalsContact O-N 3.13Å; A491-L496 WeakPolarHBondContact CA-O 3.32Å; A491-L496 WeakPolarHBondContact CB-O 3.49Å; A491-L496 PolarHBondContact O-N 3.16Å; A491-I498 HydrophobicContact CB-CD1 4.12Å; A491-I498 HydrophobicContact CB-CG1 3.85Å
492	E	91.9	Very high	93.4	Very high	160 Å²	160	57.9 Å²	57.9	75%	0.748	28%	0.28	S	S	*	.	H	α-helix	trans	-69.7	-53.7	-179.9	-173.7	-177.5	180	0	0	112.1	Q488 L490	Q488-E492 WeakPolarHBondContact O-CB 3.02Å; Q488-E492 PolarHBondContact O-N 3.49Å; L490-E492 PolarHBondContact O-N 3.22Å
493	K	89	Confident	93.2	Very high	95 Å²	95	59.1 Å²	59.1	41%	0.413	28%	0.284	S	S	.	.	H	α-helix	trans	-76	-29.2	-171	-69.3	-170.9	176.1	177.3	0	113.9	S411 L433 V489	S411-K493 WeakPolarHBondContact CB-O 3.4Å; S411-K493 PolarHBondContact OG-O 3.06Å; L433-K493 HydrophobicContact CD1-CB 3.87Å; L433-K493 HydrophobicContact CD1-CD 4.25Å; L433-K493 HydrophobicContact CD2-CD 3.61Å; V489-K493 HydrophobicContact CG1-CD 3.88Å; V489-K493 HydrophobicContact CG1-CG 4.35Å; V489-K493 VanDerWaalsContact O-CB 3.3Å; V489-K493 WeakPolarHBondContact O-CB 3.41Å; V489-K493 WeakPolarHBondContact O-CG 3.44Å; V489-K493 PolarHBondContact O-N 2.87Å
494	L	87.6	Confident	92.9	Very high	12 Å²	12	61.9 Å²	61.9	6%	0.063	30%	0.298	C	S	.	.	H	α-helix	trans	-104.5	3.1	-179.7	-52.7	-176.6	0	0	0	112.6	D429 I430 L433 L490 L496	D429-L494 HydrophobicContact CB-CD1 4.03Å; D429-L494 HydrophobicContact CB-CD2 3.6Å; D429-L494 HydrophobicContact CB-CG 4.48Å; I430-L494 HydrophobicContact CG1-CD1 3.64Å; L433-L494 HydrophobicContact CD1-CD1 3.98Å; L433-L494 HydrophobicContact CD1-CD2 3.71Å; L433-L494 HydrophobicContact CD1-CG 3.68Å; L490-L494 HydrophobicContact CD2-CD1 4.01Å; L490-L494 VanDerWaalsContact O-CB 3.28Å; L490-L494 WeakPolarHBondContact O-CB 3.34Å; L490-L494 PolarHBondContact O-N 2.84Å; L494-L496 HydrophobicContact CB-CD1 3.85Å; L494-L496 HydrophobicContact CB-CG 3.78Å; L494-L496 HydrophobicContact CD1-CD1 4.14Å; L494-L496 PolarHBondContact O-N 3.26Å
495	N	88.5	Confident	92.6	Very high	51 Å²	51	57.9 Å²	57.9	27%	0.273	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.3	57.1	-176.9	-177.4	23.2	0	0	0	111.7	N405 S409 A491	N405-N495 WeakPolarHBondContact CB-O 3.45Å; N405-N495 PolarHBondContact ND2-O 3.04Å; N405-N495 PolarHBondContact ND2-OD1 3.2Å; S409-N495 WeakPolarHBondContact CB-ND2 3.38Å; S409-N495 PolarHBondContact O-ND2 2.82Å; S409-N495 PolarHBondContact OG-ND2 3.07Å; A491-N495 CarbonylContact O-C 3.57Å; A491-N495 WeakPolarHBondContact O-CA 3.41Å; A491-N495 PolarHBondContact O-N 2.71Å; A491-N495 VanDerWaalsContact O-N 3.13Å
496	L	89.7	Confident	92.3	Very high	10 Å²	10	57.4 Å²	57.4	5%	0.052	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	154.6	177.4	-55.1	175	0	0	0	109.5	F402 L404 V426 A491 L494	F402-L496 HydrophobicContact CB-CB 4.02Å; F402-L496 HydrophobicContact CB-CD1 4.31Å; F402-L496 HydrophobicContact CD2-CD1 4.16Å; F402-L496 HydrophobicContact CG-CD1 4.1Å; L404-L496 HydrophobicContact CD2-CD2 3.56Å; V426-L496 HydrophobicContact CG1-CD1 4.25Å; V426-L496 HydrophobicContact CG1-CD2 4.38Å; A491-L496 WeakPolarHBondContact CA-O 3.32Å; A491-L496 WeakPolarHBondContact CB-O 3.49Å; A491-L496 PolarHBondContact O-N 3.16Å; L494-L496 HydrophobicContact CB-CD1 3.85Å; L494-L496 HydrophobicContact CB-CG 3.78Å; L494-L496 HydrophobicContact CD1-CD1 4.14Å; L494-L496 PolarHBondContact O-N 3.26Å
497	S	91.5	Very high	92	Very high	43 Å²	43	61.8 Å²	61.8	30%	0.301	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	118.3	171.4	-55	0	0	0	0	110	F402 W403 N405	F402-S497 CarbonylContact C-O 3.52Å; F402-S497 VanDerWaalsContact CA-O 3.24Å; F402-S497 WeakPolarHBondContact CA-O 3.43Å; W403-S497 PolarHBondContact N-O 3.47Å; W403-S497 PolarHBondContact O-N 2.74Å; W403-S497 VanDerWaalsContact O-N 3.08Å; N405-S497 PolarHBondContact ND2-OG 2.61Å; N405-S497 PolarHBondContact OD1-OG 2.7Å
498	I	92.8	Very high	91.6	Very high	83 Å²	83	66.8 Å²	66.8	43%	0.426	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	138.1	176.3	-53.5	176.9	0	0	0	109.5	L400 G487 A491	L400-I498 HydrophobicContact CD1-CG2 4.05Å; G487-I498 WeakPolarHBondContact O-CD1 3.08Å; A491-I498 HydrophobicContact CB-CD1 4.12Å; A491-I498 HydrophobicContact CB-CG1 3.85Å
499	R	90.4	Very high	91.1	Very high	184 Å²	184	61.5 Å²	61.5	69%	0.694	30%	0.296	S	S	*	.			trans	-111.2	0	-178.1	175.8	-179.2	170.4	-90.6	1.4	112.5	S401 W403	S401-R499 PolarHBondContact O-N 3.32Å; W403-R499 HydrophobicContact CZ2-CG 4.41Å

Retrieved 499 of 499 residues in 296.3 ms (Link to these results)

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