A0A3B3VX51_9TELE Loading...

non-specific serine/threonine protein kinase

AlphaFold DB , UniProt , Accession A0A3B3VX51, Species 9TELE (Poecilia latipinna, sailfin molly), Gene n/a, Length 604 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.2	Very low	31.5	Very low	248 Å²	248	132.1 Å²	132.1	100%	1.222	83%	0.825	S	S	*	*				0	145.4	0	-78.2	-176.6	150.2	0	0	108.6
2	S	31.8	Very low	31.4	Very low	110 Å²	110	137.3 Å²	137.3	77%	0.769	83%	0.833	S	S	*	*			trans	-80.3	163.6	-156.2	-40	0	0	0	0	116.2
3	S	32.4	Very low	31.3	Very low	106 Å²	106	137.3 Å²	137.3	74%	0.741	83%	0.833	S	S	*	*			trans	67.7	143.5	143.6	43.7	0	0	0	0	118.6
4	T	35.3	Very low	31.8	Very low	125 Å²	125	136.4 Å²	136.4	77%	0.767	84%	0.836	S	S	*	*			cis	-173.4	150.3	23.4	-1.8	0	0	0	0	111.2
5	S	34.7	Very low	32.3	Very low	102 Å²	102	134.8 Å²	134.8	71%	0.713	83%	0.829	S	S	*	*			trans	32	145.4	145.3	58.6	0	0	0	0	122.6
6	S	30.9	Very low	32.3	Very low	116 Å²	116	137.7 Å²	137.7	81%	0.811	83%	0.83	S	S	*	*			cis	-170	154.1	40.7	-8.9	0	0	0	0	112.8
7	Y	30.2	Very low	32.6	Very low	226 Å²	226	139.5 Å²	139.5	89%	0.886	83%	0.834	S	S	*	*			trans	-91.2	135.3	179.1	-122.7	-117.6	0	0	0	110.9
8	S	31.9	Very low	33	Very low	103 Å²	103	138.4 Å²	138.4	72%	0.72	83%	0.828	S	S	*	*				85.6	121.2	67.8	-52.8	0	0	0	0	115.8
9	S	27.1	Very low	33.3	Very low	125 Å²	125	137.2 Å²	137.2	87%	0.874	82%	0.824	S	S	*	*			trans	-127.2	127.1	168.6	157.5	0	0	0	0	108.2
10	S	32.7	Very low	33.9	Very low	122 Å²	122	143.1 Å²	143.1	85%	0.853	83%	0.831	S	S	*	*			trans	-137.4	123.3	174.5	53	0	0	0	0	109.2
11	G	28.2	Very low	34.5	Very low	70 Å²	70	139.4 Å²	139.4	72%	0.722	82%	0.823	S	S	*	*			trans	-96.8	156.8	174.6	0	0	0	0	0	113.1
12	E	30.1	Very low	35.8	Very low	195 Å²	195	130.5 Å²	130.5	91%	0.911	80%	0.795	S	S	*	*			trans	75.8	99.2	149.3	-59.9	-172.1	152.5	0	0	120
13	T	30.7	Very low	38	Very low	137 Å²	137	126 Å²	126	84%	0.84	77%	0.766	S	S	*	*			trans	-134.6	128.4	138.7	47	0	0	0	0	108.9
14	S	38.5	Very low	40.5	Very low	125 Å²	125	124.2 Å²	124.2	87%	0.874	75%	0.751	S	S	*	*			trans	-74.6	146.2	166.3	-71.2	0	0	0	0	110
15	P	38.3	Very low	43	Very low	112 Å²	112	118.2 Å²	118.2	73%	0.727	71%	0.714	S	S	*	*			trans	-143.2	147.5	131.9	26.8	-6.6	0	0	0	115.3
16	E	32.8	Very low	45.5	Very low	181 Å²	181	120.7 Å²	120.7	85%	0.846	71%	0.708	S	S	*	*			trans	79.3	109.2	146.3	-68.1	-173.3	-179.8	0	0	121.6	V18	E16-V18 PolarHBondContact O-N 2.71Å
17	D	38.2	Very low	48.2	Very low	169 Å²	169	115.2 Å²	115.2	90%	0.904	67%	0.67	S	S	*	*			trans	-49.3	107	153.8	-86.1	-48.6	0	0	0	111.4
18	V	39.3	Very low	50.9	Low	120 Å²	120	106.9 Å²	106.9	73%	0.727	64%	0.637	S	S	*	*			trans	-72.6	128.8	167.4	-179.1	0	0	0	0	108.7	E16 R20	E16-V18 PolarHBondContact O-N 2.71Å; V18-R20 PolarHBondContact O-N 2.94Å
19	P	38.4	Very low	53.2	Low	114 Å²	114	102.2 Å²	102.2	74%	0.74	60%	0.604	S	S	*	*			trans	-62.9	124.6	178.3	-13	25.4	0	0	0	109.6	G21	P19-G21 PolarHBondContact O-N 3.11Å
20	R	45.5	Very low	55.2	Low	255 Å²	255	97.3 Å²	97.3	96%	0.962	57%	0.569	S	S	*	*			trans	-69.8	61.6	163.8	-72.7	-177.2	179.4	-177.2	1.3	110.2	V18 G22	V18-R20 PolarHBondContact O-N 2.94Å; R20-G22 VanDerWaalsContact C-N 3.34Å; R20-G22 PolarHBondContact O-N 3.01Å
21	G	45.8	Very low	56.4	Low	66 Å²	66	97 Å²	97	68%	0.68	56%	0.558	S	S	*	*			trans	-82.7	79.6	166.7	0	0	0	0	0	109.1	P19 G23	P19-G21 PolarHBondContact O-N 3.11Å; G21-G23 PolarHBondContact O-N 3.38Å
22	G	59.5	Low	58.2	Low	61 Å²	61	103.6 Å²	103.6	63%	0.629	57%	0.567	S	S	*	*			trans	-66	98.7	171.5	0	0	0	0	0	109.6	R20	R20-G22 VanDerWaalsContact C-N 3.34Å; R20-G22 PolarHBondContact O-N 3.01Å
23	G	77.3	Confident	60.2	Low	15 Å²	15	98.3 Å²	98.3	16%	0.155	54%	0.542	C	S	.	.			trans	-63.8	149.2	175.1	0	0	0	0	0	111.7	G21 V39	G21-G23 PolarHBondContact O-N 3.38Å; G23-V39 WeakPolarHBondContact O-CB 3.23Å; G23-V39 PolarHBondContact O-N 3.47Å
24	T	85.4	Confident	62.6	Low	69 Å²	69	100.7 Å²	100.7	42%	0.423	54%	0.536	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	146.4	174.8	62.4	0	0	0	0	111.1	V36 V37 N38 G87	T24-V36 HydrophobicContact CG2-CG1 4.16Å; T24-V37 WeakPolarHBondContact CA-O 3.25Å; T24-N38 WeakPolarHBondContact CG2-OD1 3.39Å; T24-G87 PolarHBondContact O-N 3.17Å
25	I	87.4	Confident	64.8	Low	0 Å²	0	96.6 Å²	96.6	0%	0	51%	0.505	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	135.9	177	-63.3	173.7	0	0	0	108.9	V27 V36 V37 V39 I82 L85 L90	I25-V27 HydrophobicContact CG2-CG2 4.1Å; I25-V36 WeakPolarHBondContact O-CA 3.32Å; I25-V37 PolarHBondContact N-O 3.04Å; I25-V37 PolarHBondContact O-N 2.8Å; I25-V39 HydrophobicContact CD1-CG2 3.41Å; I25-V39 VanDerWaalsContact CD1-CG2 3.41Å; I25-V39 HydrophobicContact CG1-CG2 3.59Å; I25-I82 HydrophobicContact CD1-CD1 3.8Å; I25-I82 HydrophobicContact CD1-CG1 3.36Å; I25-L85 HydrophobicContact CD1-CB 3.52Å; I25-L85 WeakPolarHBondContact CD1-O 3.42Å; I25-L85 VanDerWaalsContact CG1-O 3.28Å; I25-L85 WeakPolarHBondContact CG1-O 3.32Å; I25-L90 HydrophobicContact CG2-CB 4.49Å; I25-L90 HydrophobicContact CG2-CD1 3.89Å; I25-L90 HydrophobicContact CG2-CG 3.83Å
26	R	87.1	Confident	67.1	Low	153 Å²	153	95.4 Å²	95.4	58%	0.577	50%	0.496	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.1	128.9	172.3	-63.5	-179.7	-167.2	157.7	4.2	108.9	V36 E89 L90	R26-V36 HydrophobicContact CG-CG2 4.49Å; R26-E89 HydrophobicContact CB-CG 4.35Å; R26-E89 IonicContact NH1-OE1 3.65Å; R26-E89 WeakPolarHBondContact O-CA 3.38Å; R26-L90 PolarHBondContact O-N 3.45Å
27	V	88.3	Confident	69.7	Low	2 Å²	2	87.6 Å²	87.6	1%	0.012	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	115.8	-177.5	-171.8	0	0	0	0	108.7	I25 L29 R34 T35 V37 L49 L90 V92	I25-V27 HydrophobicContact CG2-CG2 4.1Å; V27-L29 HydrophobicContact CG1-CD2 4.06Å; V27-L29 HydrophobicContact CG1-CG 4.38Å; V27-R34 CarbonylContact O-C 3.59Å; V27-R34 WeakPolarHBondContact O-CA 3.42Å; V27-T35 HydrophobicContact CB-CG2 3.86Å; V27-T35 HydrophobicContact CG1-CG2 4.5Å; V27-T35 PolarHBondContact N-O 3.31Å; V27-T35 PolarHBondContact O-N 3.47Å; V27-V37 HydrophobicContact CG2-CG2 3.89Å; V27-L49 HydrophobicContact CB-CD2 4.3Å; V27-L49 HydrophobicContact CG1-CD2 3.82Å; V27-L49 HydrophobicContact CG2-CD2 3.77Å; V27-L90 CarbonylContact C-O 3.53Å; V27-L90 WeakPolarHBondContact CA-O 3.39Å; V27-L90 HydrophobicContact CG1-CB 4.27Å; V27-L90 HydrophobicContact CG2-CB 4.32Å; V27-V92 HydrophobicContact CG1-CG2 3.8Å
28	Y	86.7	Confident	72	Confident	51 Å²	51	84.7 Å²	84.7	20%	0.2	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	117.4	168.5	-62.7	-90.1	0	0	0	108.1	R34 L68 E89 L90 L91 V92	Y28-R34 HydrophobicContact CD1-CG 3.82Å; Y28-R34 HydrophobicContact CE1-CG 4.03Å; Y28-L68 HydrophobicContact CD2-CD1 4.04Å; Y28-L68 HydrophobicContact CE2-CD1 4.32Å; Y28-E89 HydrophobicContact CD2-CB 4.44Å; Y28-E89 HydrophobicContact CE2-CB 3.95Å; Y28-E89 VanDerWaalsContact CE2-CD 3.46Å; Y28-E89 HydrophobicContact CE2-CG 4.07Å; Y28-E89 WeakPolarHBondContact CE2-OE2 3.42Å; Y28-E89 PolarHBondContact OH-OE1 3.4Å; Y28-E89 PolarHBondContact OH-OE2 3.44Å; Y28-L90 PolarHBondContact N-O 3.43Å; Y28-L91 CarbonylContact O-C 3.58Å; Y28-L91 WeakPolarHBondContact O-CA 3.31Å; Y28-V92 PolarHBondContact O-N 2.81Å
29	L	80.4	Confident	74.1	Confident	4 Å²	4	79.9 Å²	79.9	2%	0.021	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	164.1	179.3	-68.4	171.8	0	0	0	109.9	V27 Q33 T35 L53 V92	V27-L29 HydrophobicContact CG1-CD2 4.06Å; V27-L29 HydrophobicContact CG1-CG 4.38Å; L29-Q33 HydrophobicContact CB-CB 4.13Å; L29-Q33 PolarHBondContact N-O 2.72Å; L29-Q33 PolarHBondContact O-N 2.66Å; L29-T35 HydrophobicContact CD1-CG2 3.68Å; L29-T35 HydrophobicContact CG-CG2 4.16Å; L29-L53 HydrophobicContact CD2-CD2 4.26Å; L29-V92 HydrophobicContact CD2-CB 4.09Å; L29-V92 HydrophobicContact CD2-CG2 3.93Å
30	P	68.4	Low	76.3	Confident	22 Å²	22	83 Å²	83	14%	0.143	41%	0.413	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.5	154.4	175.2	-25.6	34.9	0	0	0	112.4	L58 V92 V94	P30-L58 HydrophobicContact CG-CD1 3.95Å; P30-V92 VanDerWaalsContact CD-O 3.25Å; P30-V92 WeakPolarHBondContact CD-O 3.39Å; P30-V92 HydrophobicContact CG-CG1 4.49Å; P30-V92 WeakPolarHBondContact CG-O 3.37Å; P30-V94 HydrophobicContact CB-CG2 3.78Å; P30-V94 HydrophobicContact CG-CG2 3.5Å; P30-V94 VanDerWaalsContact CG-CG2 3.5Å
31	N	58.8	Low	77.8	Confident	117 Å²	117	79.4 Å²	79.4	63%	0.626	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.3	36.7	-176.5	-58.5	-34.1	0	0	0	115.1	Q33	N31-Q33 PolarHBondContact O-N 2.95Å; N31-Q33 VanDerWaalsContact O-N 3.15Å
32	K	66.2	Low	79.4	Confident	207 Å²	207	79.2 Å²	79.2	90%	0.9	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.5	22	177.9	-55.6	-178.1	179	-179.4	0	114.1
33	Q	71.4	Confident	80.7	Confident	85 Å²	85	77.9 Å²	77.9	40%	0.397	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	157.3	177.8	-64.2	-172.9	6.6	0	0	111.1	L29 N31	L29-Q33 HydrophobicContact CB-CB 4.13Å; L29-Q33 PolarHBondContact N-O 2.72Å; L29-Q33 PolarHBondContact O-N 2.66Å; N31-Q33 PolarHBondContact O-N 2.95Å; N31-Q33 VanDerWaalsContact O-N 3.15Å
34	R	81.2	Confident	81.3	Confident	187 Å²	187	78.6 Å²	78.6	71%	0.706	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.5	142	-179.9	-52.4	-176.3	-169	-171.6	-1.2	110	V27 Y28	V27-R34 CarbonylContact O-C 3.59Å; V27-R34 WeakPolarHBondContact O-CA 3.42Å; Y28-R34 HydrophobicContact CD1-CG 3.82Å; Y28-R34 HydrophobicContact CE1-CG 4.03Å
35	T	85.4	Confident	81.4	Confident	39 Å²	39	75.3 Å²	75.3	24%	0.239	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	158.2	170.8	-167.2	0	0	0	0	109.7	V27 L29 V37 A52	V27-T35 HydrophobicContact CB-CG2 3.86Å; V27-T35 HydrophobicContact CG1-CG2 4.5Å; V27-T35 PolarHBondContact N-O 3.31Å; V27-T35 PolarHBondContact O-N 3.47Å; L29-T35 HydrophobicContact CD1-CG2 3.68Å; L29-T35 HydrophobicContact CG-CG2 4.16Å; T35-V37 HydrophobicContact CG2-CG2 4.18Å; T35-A52 HydrophobicContact CG2-CB 4.4Å
36	V	86	Confident	81.3	Confident	86 Å²	86	78.7 Å²	78.7	52%	0.521	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	134.2	171.4	-178	0	0	0	0	107.9	T24 I25 R26	T24-V36 HydrophobicContact CG2-CG1 4.16Å; I25-V36 WeakPolarHBondContact O-CA 3.32Å; R26-V36 HydrophobicContact CG-CG2 4.49Å
37	V	86.8	Confident	81.3	Confident	18 Å²	18	76.5 Å²	76.5	11%	0.109	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	131.3	-179.4	-174.2	0	0	0	0	109	T24 I25 V27 T35 L49	T24-V37 WeakPolarHBondContact CA-O 3.25Å; I25-V37 PolarHBondContact N-O 3.04Å; I25-V37 PolarHBondContact O-N 2.8Å; V27-V37 HydrophobicContact CG2-CG2 3.89Å; T35-V37 HydrophobicContact CG2-CG2 4.18Å; V37-L49 HydrophobicContact CG2-CD2 4.09Å
38	N	86.4	Confident	81.2	Confident	108 Å²	108	76.9 Å²	76.9	58%	0.578	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.5	129.1	175.9	-64.5	-15.2	0	0	0	109	T24	T24-N38 WeakPolarHBondContact CG2-OD1 3.39Å
39	V	84.2	Confident	81.1	Confident	18 Å²	18	74.5 Å²	74.5	11%	0.109	37%	0.366	C	S	.	.			trans	-81.4	132.9	179.9	174.8	0	0	0	0	109.8	G23 I25 I82 V86	G23-V39 WeakPolarHBondContact O-CB 3.23Å; G23-V39 PolarHBondContact O-N 3.47Å; I25-V39 HydrophobicContact CD1-CG2 3.41Å; I25-V39 VanDerWaalsContact CD1-CG2 3.41Å; I25-V39 HydrophobicContact CG1-CG2 3.59Å; V39-I82 HydrophobicContact CG1-CG2 3.97Å; V39-I82 HydrophobicContact CG2-CG1 4.24Å; V39-V86 HydrophobicContact CB-CG2 3.81Å; V39-V86 HydrophobicContact CG1-CG2 3.71Å; V39-V86 HydrophobicContact CG2-CG2 3.68Å
40	R	84.4	Confident	81.2	Confident	181 Å²	181	75.7 Å²	75.7	68%	0.683	37%	0.373	S	S	*	.			trans	-119.8	141	171.3	-59.5	178.9	176.9	-171	-3.3	108.6	G42 Q43	R40-G42 PolarHBondContact O-N 3.48Å; R40-Q43 HydrophobicContact CB-CB 4.23Å; R40-Q43 VanDerWaalsContact O-CB 3.27Å; R40-Q43 WeakPolarHBondContact O-CB 3.49Å; R40-Q43 PolarHBondContact O-N 2.9Å
41	Q	76.9	Confident	81.7	Confident	178 Å²	178	82.8 Å²	82.8	83%	0.832	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	131.5	-178.7	-161.2	171.1	11.2	0	0	110.4	Q43	Q41-Q43 VanDerWaalsContact C-N 3.33Å
42	G	78.8	Confident	82.5	Confident	62 Å²	62	77.9 Å²	77.9	64%	0.639	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.1	9	-178.1	0	0	0	0	0	115.3	R40	R40-G42 PolarHBondContact O-N 3.48Å
43	Q	87.4	Confident	82.9	Confident	34 Å²	34	68.2 Å²	68.2	16%	0.159	34%	0.335	C	S	.	.			trans	-91.7	138	177.2	-166.4	176.8	3.7	0	0	110.7	R40 Q41 E47 S48 I82	R40-Q43 HydrophobicContact CB-CB 4.23Å; R40-Q43 VanDerWaalsContact O-CB 3.27Å; R40-Q43 WeakPolarHBondContact O-CB 3.49Å; R40-Q43 PolarHBondContact O-N 2.9Å; Q41-Q43 VanDerWaalsContact C-N 3.33Å; Q43-E47 HydrophobicContact CG-CB 3.59Å; Q43-E47 WeakPolarHBondContact CG-OE2 3.5Å; Q43-E47 VanDerWaalsContact NE2-C 3.27Å; Q43-E47 PolarHBondContact NE2-O 2.77Å; Q43-S48 VanDerWaalsContact CG-OG 3.29Å; Q43-S48 WeakPolarHBondContact CG-OG 3.46Å; Q43-S48 VanDerWaalsContact NE2-CA 3.33Å; Q43-S48 PolarHBondContact NE2-OG 2.9Å; Q43-I82 HydrophobicContact CB-CG2 3.98Å; Q43-I82 WeakPolarHBondContact O-CG2 3.19Å; Q43-I82 PolarHBondContact O-N 2.94Å
44	T	90.1	Very high	82.8	Confident	30 Å²	30	70.6 Å²	70.6	18%	0.184	34%	0.344	C	S	.	.	B	Isolated β-bridge	trans	-82.3	165	175.5	66.2	0	0	0	0	112.2	Y46 E47 S48 T80	T44-Y46 PolarHBondContact O-N 2.97Å; T44-E47 PolarHBondContact O-N 3.23Å; T44-E47 WeakPolarHBondContact OG1-CG 3.14Å; T44-E47 PolarHBondContact OG1-N 3.3Å; T44-S48 WeakPolarHBondContact O-CB 3.42Å; T44-S48 PolarHBondContact O-N 3Å; T44-S48 VanDerWaalsContact O-N 3.11Å; T44-S48 PolarHBondContact O-OG 3.27Å; T44-T80 CarbonylContact C-O 3.48Å; T44-T80 WeakPolarHBondContact CA-O 3.43Å
45	V	87.1	Confident	82.1	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-55.6	-42.2	169.7	172	0	0	0	0	110.6	S48 L49 V65 T76 W78 T80 L85	V45-S48 PolarHBondContact O-N 2.72Å; V45-L49 HydrophobicContact CG1-CD1 3.71Å; V45-L49 HydrophobicContact CG1-CG 4.34Å; V45-L49 WeakPolarHBondContact O-CB 3.3Å; V45-L49 WeakPolarHBondContact O-CG 3.27Å; V45-L49 PolarHBondContact O-N 2.84Å; V45-V65 HydrophobicContact CG1-CB 4.44Å; V45-V65 HydrophobicContact CG1-CG1 4.15Å; V45-V65 HydrophobicContact CG1-CG2 4.16Å; V45-T76 HydrophobicContact CG2-CG2 4.24Å; V45-W78 HydrophobicContact CG1-CE3 4.19Å; V45-W78 HydrophobicContact CG1-CZ3 4.44Å; V45-T80 WeakPolarHBondContact CG2-O 3.24Å; V45-T80 PolarHBondContact N-O 3.47Å; V45-L85 HydrophobicContact CG2-CD1 3.64Å
46	Y	85.6	Confident	81	Confident	71 Å²	71	68.7 Å²	68.7	28%	0.278	34%	0.344	S	S	.	.	H	α-helix	trans	-56.3	-57.6	174.9	171.2	-110.8	0	0	0	111.9	T44 S48 L49 N50 Q60 W78	T44-Y46 PolarHBondContact O-N 2.97Å; Y46-S48 PolarHBondContact O-N 2.7Å; Y46-L49 PolarHBondContact O-N 3.45Å; Y46-N50 HydrophobicContact CE2-CB 4.26Å; Y46-N50 WeakPolarHBondContact O-CA 3.37Å; Y46-N50 WeakPolarHBondContact O-CB 3.4Å; Y46-N50 PolarHBondContact O-N 3.23Å; Y46-N50 PolarHBondContact OH-ND2 3.45Å; Y46-N50 VanDerWaalsContact OH-ND2 3.15Å; Y46-Q60 HydrophobicContact CD2-CB 4.06Å; Y46-Q60 HydrophobicContact CE2-CB 4.15Å; Y46-Q60 HydrophobicContact CE2-CG 4.37Å; Y46-W78 HydrophobicContact CD2-CE3 4.45Å; Y46-W78 PolarHBondContact N-O 2.89Å
47	E	86.4	Confident	79.5	Confident	107 Å²	107	66.4 Å²	66.4	50%	0.5	34%	0.338	S	S	.	.	H	α-helix	trans	-59.4	-34.9	-175.5	-71.9	179.6	162	0	0	112.4	Q43 T44	Q43-E47 HydrophobicContact CG-CB 3.59Å; Q43-E47 WeakPolarHBondContact CG-OE2 3.5Å; Q43-E47 VanDerWaalsContact NE2-C 3.27Å; Q43-E47 PolarHBondContact NE2-O 2.77Å; T44-E47 PolarHBondContact O-N 3.23Å; T44-E47 WeakPolarHBondContact OG1-CG 3.14Å; T44-E47 PolarHBondContact OG1-N 3.3Å
48	S	86.3	Confident	78.7	Confident	10 Å²	10	66.1 Å²	66.1	7%	0.07	34%	0.336	C	S	.	.	H	α-helix	trans	-73.2	-38.2	-179.1	-57.9	0	0	0	0	112.8	Q43 T44 V45 Y46 I82	Q43-S48 VanDerWaalsContact CG-OG 3.29Å; Q43-S48 WeakPolarHBondContact CG-OG 3.46Å; Q43-S48 VanDerWaalsContact NE2-CA 3.33Å; Q43-S48 PolarHBondContact NE2-OG 2.9Å; T44-S48 WeakPolarHBondContact O-CB 3.42Å; T44-S48 PolarHBondContact O-N 3Å; T44-S48 VanDerWaalsContact O-N 3.11Å; T44-S48 PolarHBondContact O-OG 3.27Å; V45-S48 PolarHBondContact O-N 2.72Å; Y46-S48 PolarHBondContact O-N 2.7Å; S48-I82 WeakPolarHBondContact OG-CD1 3.46Å; S48-I82 WeakPolarHBondContact OG-CG2 3.39Å
49	L	85.9	Confident	78	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-91.3	-20.5	-179	-63.2	-177.5	0	0	0	113.4	V27 V37 V45 Y46 K51 A52 L53 V65 W78 V92	V27-L49 HydrophobicContact CB-CD2 4.3Å; V27-L49 HydrophobicContact CG1-CD2 3.82Å; V27-L49 HydrophobicContact CG2-CD2 3.77Å; V37-L49 HydrophobicContact CG2-CD2 4.09Å; V45-L49 HydrophobicContact CG1-CD1 3.71Å; V45-L49 HydrophobicContact CG1-CG 4.34Å; V45-L49 WeakPolarHBondContact O-CB 3.3Å; V45-L49 WeakPolarHBondContact O-CG 3.27Å; V45-L49 PolarHBondContact O-N 2.84Å; Y46-L49 PolarHBondContact O-N 3.45Å; L49-K51 VanDerWaalsContact C-N 3.28Å; L49-K51 PolarHBondContact O-N 3.49Å; L49-K51 VanDerWaalsContact O-N 3.15Å; L49-A52 WeakPolarHBondContact O-CA 3.24Å; L49-A52 WeakPolarHBondContact O-CB 3.46Å; L49-A52 PolarHBondContact O-N 3.3Å; L49-L53 HydrophobicContact CB-CD1 3.98Å; L49-L53 HydrophobicContact CB-CG 4.33Å; L49-L53 WeakPolarHBondContact O-CG 3.42Å; L49-L53 PolarHBondContact O-N 3.07Å; L49-V65 HydrophobicContact CD1-CG1 4.25Å; L49-V65 HydrophobicContact CD1-CG2 3.92Å; L49-W78 HydrophobicContact CB-CZ3 4.31Å; L49-W78 HydrophobicContact CD1-CZ3 4.08Å; L49-V92 HydrophobicContact CD1-CG2 4.06Å
50	N	81.6	Confident	77.5	Confident	30 Å²	30	66 Å²	66	16%	0.16	34%	0.336	C	S	.	.	H	α-helix	trans	-52.6	-44.3	-172.4	-168.2	4.4	0	0	0	112.5	Y46 L53 K54	Y46-N50 HydrophobicContact CE2-CB 4.26Å; Y46-N50 WeakPolarHBondContact O-CA 3.37Å; Y46-N50 WeakPolarHBondContact O-CB 3.4Å; Y46-N50 PolarHBondContact O-N 3.23Å; Y46-N50 PolarHBondContact OH-ND2 3.45Å; Y46-N50 VanDerWaalsContact OH-ND2 3.15Å; N50-L53 PolarHBondContact O-N 2.95Å; N50-K54 PolarHBondContact ND2-NZ 3.47Å; N50-K54 VanDerWaalsContact ND2-NZ 3.1Å; N50-K54 VanDerWaalsContact O-CB 3.25Å; N50-K54 WeakPolarHBondContact O-CB 2.91Å; N50-K54 WeakPolarHBondContact O-CG 3.47Å; N50-K54 PolarHBondContact O-N 2.84Å; N50-K54 WeakPolarHBondContact OD1-CD 3.32Å; N50-K54 WeakPolarHBondContact OD1-CE 3.46Å; N50-K54 WeakPolarHBondContact OD1-CG 3.11Å; N50-K54 PolarHBondContact OD1-NZ 2.67Å
51	K	78.1	Confident	76.6	Confident	171 Å²	171	63.2 Å²	63.2	74%	0.743	34%	0.335	S	S	*	.	H	α-helix	trans	-65.1	-42.1	178.2	-169	177	-178.9	-179.8	0	111.8	L49 L53 V55	L49-K51 VanDerWaalsContact C-N 3.28Å; L49-K51 PolarHBondContact O-N 3.49Å; L49-K51 VanDerWaalsContact O-N 3.15Å; K51-L53 VanDerWaalsContact C-N 3.34Å; K51-V55 WeakPolarHBondContact O-CG2 3.48Å; K51-V55 PolarHBondContact O-N 2.64Å; K51-V55 VanDerWaalsContact O-N 3.14Å
52	A	76.9	Confident	76.2	Confident	14 Å²	14	55.5 Å²	55.5	12%	0.116	30%	0.301	C	S	.	.	H	α-helix	trans	-67.7	-35.4	179.5	0	0	0	0	0	112.3	T35 L49 R56	T35-A52 HydrophobicContact CG2-CB 4.4Å; L49-A52 WeakPolarHBondContact O-CA 3.24Å; L49-A52 WeakPolarHBondContact O-CB 3.46Å; L49-A52 PolarHBondContact O-N 3.3Å; A52-R56 WeakPolarHBondContact O-CD 3.35Å; A52-R56 WeakPolarHBondContact O-CG 3.48Å; A52-R56 PolarHBondContact O-NH1 3.49Å
53	L	74.4	Confident	76.2	Confident	3 Å²	3	52.8 Å²	52.8	2%	0.016	27%	0.272	C	S	.	.	H	α-helix	trans	-74	-46.5	176.4	-64.3	172.5	0	0	0	111.9	L29 L49 N50 K51 V55 R56 G57 L58 W78 V92	L29-L53 HydrophobicContact CD2-CD2 4.26Å; L49-L53 HydrophobicContact CB-CD1 3.98Å; L49-L53 HydrophobicContact CB-CG 4.33Å; L49-L53 WeakPolarHBondContact O-CG 3.42Å; L49-L53 PolarHBondContact O-N 3.07Å; N50-L53 PolarHBondContact O-N 2.95Å; K51-L53 VanDerWaalsContact C-N 3.34Å; L53-V55 VanDerWaalsContact C-N 3.35Å; L53-V55 PolarHBondContact O-N 3.04Å; L53-R56 CarbonylContact O-C 3.54Å; L53-R56 WeakPolarHBondContact O-CA 3.33Å; L53-R56 PolarHBondContact O-N 3.27Å; L53-G57 PolarHBondContact O-N 3.04Å; L53-L58 CarbonylContact C-O 3.46Å; L53-L58 HydrophobicContact CB-CB 4.09Å; L53-L58 WeakPolarHBondContact CB-O 3.31Å; L53-L58 HydrophobicContact CD2-CB 3.96Å; L53-L58 HydrophobicContact CD2-CD1 4Å; L53-L58 PolarHBondContact O-N 2.84Å; L53-W78 HydrophobicContact CD1-CH2 3.55Å; L53-W78 HydrophobicContact CD1-CZ3 3.83Å; L53-V92 HydrophobicContact CD2-CG1 4.1Å
54	K	69	Low	76.1	Confident	135 Å²	135	51.6 Å²	51.6	59%	0.587	27%	0.268	S	S	*	.	H	α-helix	trans	-59.1	-41.6	177.2	-82.2	175.7	172.6	159.7	0	113.1	N50 R56 G57	N50-K54 PolarHBondContact ND2-NZ 3.47Å; N50-K54 VanDerWaalsContact ND2-NZ 3.1Å; N50-K54 VanDerWaalsContact O-CB 3.25Å; N50-K54 WeakPolarHBondContact O-CB 2.91Å; N50-K54 WeakPolarHBondContact O-CG 3.47Å; N50-K54 PolarHBondContact O-N 2.84Å; N50-K54 WeakPolarHBondContact OD1-CD 3.32Å; N50-K54 WeakPolarHBondContact OD1-CE 3.46Å; N50-K54 WeakPolarHBondContact OD1-CG 3.11Å; N50-K54 PolarHBondContact OD1-NZ 2.67Å; K54-R56 PolarHBondContact O-N 3.38Å; K54-R56 VanDerWaalsContact O-N 3.14Å; K54-G57 PolarHBondContact O-N 3.26Å; K54-G57 VanDerWaalsContact O-N 3.13Å
55	V	66	Low	76	Confident	104 Å²	104	50.2 Å²	50.2	63%	0.63	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-24.1	174.7	169.4	0	0	0	0	111.7	K51 L53	K51-V55 WeakPolarHBondContact O-CG2 3.48Å; K51-V55 PolarHBondContact O-N 2.64Å; K51-V55 VanDerWaalsContact O-N 3.14Å; L53-V55 VanDerWaalsContact C-N 3.35Å; L53-V55 PolarHBondContact O-N 3.04Å
56	R	62.2	Low	76.1	Confident	83 Å²	83	52.2 Å²	52.2	31%	0.313	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105	4.1	-178.2	-67	172.9	175.5	76.9	-0.3	113.4	A52 L53 K54 L58	A52-R56 WeakPolarHBondContact O-CD 3.35Å; A52-R56 WeakPolarHBondContact O-CG 3.48Å; A52-R56 PolarHBondContact O-NH1 3.49Å; L53-R56 CarbonylContact O-C 3.54Å; L53-R56 WeakPolarHBondContact O-CA 3.33Å; L53-R56 PolarHBondContact O-N 3.27Å; K54-R56 PolarHBondContact O-N 3.38Å; K54-R56 VanDerWaalsContact O-N 3.14Å; R56-L58 VanDerWaalsContact C-N 3.27Å; R56-L58 HydrophobicContact CB-CD1 4.34Å; R56-L58 HydrophobicContact CB-CG 4.34Å; R56-L58 PolarHBondContact O-N 2.95Å
57	G	55.9	Low	76.2	Confident	38 Å²	38	50.8 Å²	50.8	39%	0.392	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.7	23	-178.7	0	0	0	0	0	114.3	L53 K54	L53-G57 PolarHBondContact O-N 3.04Å; K54-G57 PolarHBondContact O-N 3.26Å; K54-G57 VanDerWaalsContact O-N 3.13Å
58	L	69.6	Low	75.9	Confident	12 Å²	12	48 Å²	48	6%	0.063	25%	0.25	C	S	.	.			trans	-99.7	139.3	176.2	-60.3	174.4	0	0	0	109.7	P30 L53 R56 V94 L100	P30-L58 HydrophobicContact CG-CD1 3.95Å; L53-L58 CarbonylContact C-O 3.46Å; L53-L58 HydrophobicContact CB-CB 4.09Å; L53-L58 WeakPolarHBondContact CB-O 3.31Å; L53-L58 HydrophobicContact CD2-CB 3.96Å; L53-L58 HydrophobicContact CD2-CD1 4Å; L53-L58 PolarHBondContact O-N 2.84Å; R56-L58 VanDerWaalsContact C-N 3.27Å; R56-L58 HydrophobicContact CB-CD1 4.34Å; R56-L58 HydrophobicContact CB-CG 4.34Å; R56-L58 PolarHBondContact O-N 2.95Å; L58-V94 HydrophobicContact CD2-CG2 4.15Å; L58-L100 HydrophobicContact CD2-CD1 3.53Å; L58-L100 HydrophobicContact CD2-CD2 4.22Å
59	S	71.2	Confident	75.5	Confident	53 Å²	53	50.8 Å²	50.8	37%	0.371	26%	0.264	S	S	.	.			trans	-108.5	163.8	168.6	74.1	0	0	0	0	111.1	D61 C62	S59-D61 PolarHBondContact O-N 3.17Å; S59-D61 PolarHBondContact OG-OD2 3.48Å; S59-D61 VanDerWaalsContact OG-OD2 3.1Å; S59-C62 PolarHBondContact N-SG 3.27Å; S59-C62 PolarHBondContact O-N 3.36Å; S59-C62 PolarHBondContact O-SG 3.41Å
60	Q	72.8	Confident	74.6	Confident	69 Å²	69	60.6 Å²	60.6	32%	0.322	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-59.2	-33.5	176	70.1	-175.2	3.4	0	0	112.3	Y46 C62 C63 W78	Y46-Q60 HydrophobicContact CD2-CB 4.06Å; Y46-Q60 HydrophobicContact CE2-CB 4.15Å; Y46-Q60 HydrophobicContact CE2-CG 4.37Å; Q60-C62 PolarHBondContact O-N 3.4Å; Q60-C63 PolarHBondContact O-N 2.84Å; Q60-W78 HydrophobicContact CB-CD2 4.06Å; Q60-W78 HydrophobicContact CB-CE3 4.49Å; Q60-W78 HydrophobicContact CB-CG 4.45Å; Q60-W78 HydrophobicContact CB-CZ2 4.09Å; Q60-W78 PolarHBondContact O-NE1 3.26Å
61	D	66.7	Low	73.7	Confident	124 Å²	124	62.7 Å²	62.7	66%	0.663	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-70.2	-9.5	-176.6	-33.2	-61.4	0	0	0	112.4	S59	S59-D61 PolarHBondContact O-N 3.17Å; S59-D61 PolarHBondContact OG-OD2 3.48Å; S59-D61 VanDerWaalsContact OG-OD2 3.1Å
62	C	68	Low	73.4	Confident	16 Å²	16	64.3 Å²	64.3	11%	0.108	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-118	-3.2	-167.1	103.6	0	0	0	0	111.3	S59 Q60 L95 I98	S59-C62 PolarHBondContact N-SG 3.27Å; S59-C62 PolarHBondContact O-N 3.36Å; S59-C62 PolarHBondContact O-SG 3.41Å; Q60-C62 PolarHBondContact O-N 3.4Å; C62-L95 PolarHBondContact O-N 2.88Å; C62-I98 HydrophobicContact CB-CD1 3.3Å
63	C	79.7	Confident	73.7	Confident	4 Å²	4	68.8 Å²	68.8	3%	0.027	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	149.7	-173.9	-69	0	0	0	0	110.8	Q60 W78 V92 E93	Q60-C63 PolarHBondContact O-N 2.84Å; C63-W78 HydrophobicContact CB-CH2 4.35Å; C63-W78 HydrophobicContact CB-CZ2 3.98Å; C63-W78 WeakPolarHBondContact O-CZ2 3.22Å; C63-V92 HydrophobicContact CB-CG1 3.75Å; C63-E93 CarbonylContact C-O 3.6Å; C63-E93 VanDerWaalsContact CA-O 3.25Å; C63-E93 WeakPolarHBondContact CA-O 3.32Å
64	A	84.8	Confident	74.1	Confident	10 Å²	10	76.3 Å²	76.3	8%	0.083	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	141.2	166.9	0	0	0	0	0	109.6	F66 L75 V92 E93 L95	A64-F66 HydrophobicContact CB-CD2 4.47Å; A64-F66 HydrophobicContact CB-CE2 3.61Å; A64-F66 HydrophobicContact CB-CZ 3.85Å; A64-L75 HydrophobicContact CB-CD1 4Å; A64-V92 WeakPolarHBondContact O-CA 3.46Å; A64-E93 PolarHBondContact N-O 2.7Å; A64-E93 PolarHBondContact O-N 3.46Å; A64-L95 HydrophobicContact CB-CD2 3.92Å
65	V	88.1	Confident	74.9	Confident	1 Å²	1	75.6 Å²	75.6	1%	0.006	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	126.9	177.3	-171.6	0	0	0	0	109	V45 L49 T76 W78 L90 V92	V45-V65 HydrophobicContact CG1-CB 4.44Å; V45-V65 HydrophobicContact CG1-CG1 4.15Å; V45-V65 HydrophobicContact CG1-CG2 4.16Å; L49-V65 HydrophobicContact CD1-CG1 4.25Å; L49-V65 HydrophobicContact CD1-CG2 3.92Å; V65-T76 PolarHBondContact O-N 3.4Å; V65-W78 HydrophobicContact CG2-CD2 4.25Å; V65-W78 HydrophobicContact CG2-CE3 3.96Å; V65-W78 HydrophobicContact CG2-CH2 3.3Å; V65-W78 HydrophobicContact CG2-CZ2 3.63Å; V65-W78 HydrophobicContact CG2-CZ3 3.49Å; V65-W78 VanDerWaalsContact CG2-CZ3 3.49Å; V65-L90 HydrophobicContact CG1-CB 4.25Å; V65-L90 HydrophobicContact CG1-CD1 4.29Å; V65-L90 HydrophobicContact CG1-CD2 4.3Å; V65-V92 HydrophobicContact CG2-CG2 4.28Å
66	F	88.4	Confident	75.9	Confident	41 Å²	41	71 Å²	71	18%	0.18	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	137.8	177.1	-59.8	-87.8	0	0	0	109.9	A64 K73 R74 L75 L90 L91 E93	A64-F66 HydrophobicContact CB-CD2 4.47Å; A64-F66 HydrophobicContact CB-CE2 3.61Å; A64-F66 HydrophobicContact CB-CZ 3.85Å; F66-K73 HydrophobicContact CB-CB 4.16Å; F66-K73 HydrophobicContact CD1-CB 4.09Å; F66-K73 HydrophobicContact CG-CB 4.33Å; F66-R74 CarbonylContact C-O 3.56Å; F66-R74 VanDerWaalsContact CA-O 3.28Å; F66-R74 WeakPolarHBondContact CA-O 3.46Å; F66-L75 HydrophobicContact CD1-CB 4.33Å; F66-L75 HydrophobicContact CD1-CD1 4.33Å; F66-L75 HydrophobicContact CE1-CB 4.21Å; F66-L75 HydrophobicContact CE1-CD1 3.89Å; F66-L75 HydrophobicContact CZ-CD1 4.14Å; F66-L90 CarbonylContact O-C 3.49Å; F66-L90 WeakPolarHBondContact O-CA 3.25Å; F66-L91 HydrophobicContact CB-CB 4.38Å; F66-L91 PolarHBondContact N-O 3.25Å; F66-L91 PolarHBondContact O-N 3.34Å; F66-E93 HydrophobicContact CD2-CB 4.43Å; F66-E93 HydrophobicContact CD2-CG 4.08Å; F66-E93 HydrophobicContact CE2-CB 4.05Å; F66-E93 HydrophobicContact CE2-CG 4.1Å
67	R	88.1	Confident	77	Confident	41 Å²	41	72.1 Å²	72.1	16%	0.155	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	134.2	166.4	-170.5	-167.5	-62.7	-151.7	10	109.3	L69 K73 R74 E88 L90	R67-L69 HydrophobicContact CG-CD1 4.47Å; R67-L69 HydrophobicContact CG-CD2 4.21Å; R67-L69 HydrophobicContact CG-CG 3.94Å; R67-K73 WeakPolarHBondContact O-CA 3.14Å; R67-R74 PolarHBondContact N-O 3.15Å; R67-R74 PolarHBondContact O-N 2.87Å; R67-E88 WeakPolarHBondContact CD-OE2 3.34Å; R67-E88 WeakPolarHBondContact CG-OE2 3.47Å; R67-E88 IonicContact CZ-OE1 2.76Å; R67-E88 IonicContact CZ-OE2 2.69Å; R67-E88 IonicContact NE-OE1 3.49Å; R67-E88 IonicContact NE-OE2 2.8Å; R67-E88 PolarHBondContact NE-OE2 3.48Å; R67-E88 IonicContact NH1-OE1 2.77Å; R67-E88 PolarHBondContact NH1-OE1 3.23Å; R67-E88 IonicContact NH1-OE2 3.49Å; R67-E88 PolarHBondContact NH1-OE2 2.89Å; R67-E88 VanDerWaalsContact NH1-OE2 3.09Å; R67-L90 HydrophobicContact CB-CD2 4.21Å; R67-L90 HydrophobicContact CG-CD2 4.4Å
68	L	80.9	Confident	78.4	Confident	48 Å²	48	72 Å²	72	25%	0.251	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	100.9	174.2	-74.3	152.6	0	0	0	108.8	Y28 K73 E89 L91	Y28-L68 HydrophobicContact CD2-CD1 4.04Å; Y28-L68 HydrophobicContact CE2-CD1 4.32Å; L68-K73 HydrophobicContact CD2-CG 4.36Å; L68-E89 HydrophobicContact CB-CB 4.12Å; L68-E89 WeakPolarHBondContact CB-O 3.24Å; L68-E89 HydrophobicContact CD1-CB 4.01Å; L68-E89 PolarHBondContact N-O 3.06Å; L68-L91 HydrophobicContact CD1-CB 3.92Å; L68-L91 HydrophobicContact CG-CB 4.33Å
69	L	76.9	Confident	79.3	Confident	70 Å²	70	77.6 Å²	77.6	37%	0.366	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	115.8	174	-66.8	173.8	0	0	0	108.4	R67 G71 R72	R67-L69 HydrophobicContact CG-CD1 4.47Å; R67-L69 HydrophobicContact CG-CD2 4.21Å; R67-L69 HydrophobicContact CG-CG 3.94Å; L69-G71 PolarHBondContact O-N 2.69Å; L69-R72 PolarHBondContact N-O 3.44Å; L69-R72 PolarHBondContact O-N 2.75Å
70	E	67.9	Low	80.1	Confident	206 Å²	206	77.1 Å²	77.1	96%	0.963	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.8	39.3	175.2	-61.5	179.9	167.8	0	0	114.1	R72	E70-R72 PolarHBondContact O-N 2.92Å
71	G	61.8	Low	80.8	Confident	74 Å²	74	77.1 Å²	77.1	76%	0.763	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.9	0.6	179.6	0	0	0	0	0	115.9	L69	L69-G71 PolarHBondContact O-N 2.69Å
72	R	71.9	Confident	81.8	Confident	204 Å²	204	71.2 Å²	71.2	77%	0.77	36%	0.355	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.8	138.5	172.9	-65.5	-177.6	-178.4	172.4	1.7	111.2	L69 E70	L69-R72 PolarHBondContact N-O 3.44Å; L69-R72 PolarHBondContact O-N 2.75Å; E70-R72 PolarHBondContact O-N 2.92Å
73	K	83.1	Confident	82.6	Confident	109 Å²	109	72.8 Å²	72.8	47%	0.474	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	125.6	174.6	-62.7	-177.1	-175.9	-178.5	0	109.8	F66 R67 L68 L91 E93	F66-K73 HydrophobicContact CB-CB 4.16Å; F66-K73 HydrophobicContact CD1-CB 4.09Å; F66-K73 HydrophobicContact CG-CB 4.33Å; R67-K73 WeakPolarHBondContact O-CA 3.14Å; L68-K73 HydrophobicContact CD2-CG 4.36Å; K73-L91 HydrophobicContact CD-CD2 4.03Å; K73-L91 VanDerWaalsContact CE-CD2 3.45Å; K73-E93 IonicContact NZ-OE1 3.53Å; K73-E93 PolarHBondContact NZ-OE1 3.17Å; K73-E93 IonicContact NZ-OE2 3.6Å; K73-E93 PolarHBondContact NZ-OE2 3.3Å
74	R	83.6	Confident	82.8	Confident	161 Å²	161	76.6 Å²	76.6	61%	0.608	39%	0.389	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.1	123.4	172.5	-178	178.1	167.4	-179.2	-2.9	110.4	F66 R67 T76	F66-R74 CarbonylContact C-O 3.56Å; F66-R74 VanDerWaalsContact CA-O 3.28Å; F66-R74 WeakPolarHBondContact CA-O 3.46Å; R67-R74 PolarHBondContact N-O 3.15Å; R67-R74 PolarHBondContact O-N 2.87Å; R74-T76 PolarHBondContact O-N 3.03Å; R74-T76 PolarHBondContact O-OG1 3.48Å
75	L	85.3	Confident	82.7	Confident	119 Å²	119	76.1 Å²	76.1	62%	0.623	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.1	133.5	177.3	-174.7	66.3	0	0	0	110.3	A64 F66	A64-L75 HydrophobicContact CB-CD1 4Å; F66-L75 HydrophobicContact CD1-CB 4.33Å; F66-L75 HydrophobicContact CD1-CD1 4.33Å; F66-L75 HydrophobicContact CE1-CB 4.21Å; F66-L75 HydrophobicContact CE1-CD1 3.89Å; F66-L75 HydrophobicContact CZ-CD1 4.14Å
76	T	87.4	Confident	82.5	Confident	9 Å²	9	79.4 Å²	79.4	6%	0.055	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	130.1	179.4	-57	0	0	0	0	108.8	V45 V65 R74 T80	V45-T76 HydrophobicContact CG2-CG2 4.24Å; V65-T76 PolarHBondContact O-N 3.4Å; R74-T76 PolarHBondContact O-N 3.03Å; R74-T76 PolarHBondContact O-OG1 3.48Å; T76-T80 HydrophobicContact CG2-CG2 4.28Å
77	D	85.4	Confident	81.9	Confident	105 Å²	105	80.7 Å²	80.7	56%	0.561	43%	0.43	S	S	*	.			trans	-70.6	145.6	178.5	-153.7	-41.3	0	0	0	110.7	D79 T80	D77-D79 PolarHBondContact O-N 2.95Å; D77-D79 PolarHBondContact OD1-N 3.41Å; D77-T80 PolarHBondContact N-OG1 3.21Å; D77-T80 VanDerWaalsContact O-CB 3.25Å; D77-T80 WeakPolarHBondContact O-CB 3.46Å; D77-T80 PolarHBondContact O-N 2.81Å; D77-T80 VanDerWaalsContact O-N 3.13Å; D77-T80 PolarHBondContact O-OG1 3.45Å
78	W	85.9	Confident	81.8	Confident	36 Å²	36	80.7 Å²	80.7	14%	0.136	43%	0.432	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-29.5	179.5	-73.9	109.7	0	0	0	112.7	V45 Y46 L49 L53 Q60 C63 V65 T80	V45-W78 HydrophobicContact CG1-CE3 4.19Å; V45-W78 HydrophobicContact CG1-CZ3 4.44Å; Y46-W78 HydrophobicContact CD2-CE3 4.45Å; Y46-W78 PolarHBondContact N-O 2.89Å; L49-W78 HydrophobicContact CB-CZ3 4.31Å; L49-W78 HydrophobicContact CD1-CZ3 4.08Å; L53-W78 HydrophobicContact CD1-CH2 3.55Å; L53-W78 HydrophobicContact CD1-CZ3 3.83Å; Q60-W78 HydrophobicContact CB-CD2 4.06Å; Q60-W78 HydrophobicContact CB-CE3 4.49Å; Q60-W78 HydrophobicContact CB-CG 4.45Å; Q60-W78 HydrophobicContact CB-CZ2 4.09Å; Q60-W78 PolarHBondContact O-NE1 3.26Å; C63-W78 HydrophobicContact CB-CH2 4.35Å; C63-W78 HydrophobicContact CB-CZ2 3.98Å; C63-W78 WeakPolarHBondContact O-CZ2 3.22Å; V65-W78 HydrophobicContact CG2-CD2 4.25Å; V65-W78 HydrophobicContact CG2-CE3 3.96Å; V65-W78 HydrophobicContact CG2-CH2 3.3Å; V65-W78 HydrophobicContact CG2-CZ2 3.63Å; V65-W78 HydrophobicContact CG2-CZ3 3.49Å; V65-W78 VanDerWaalsContact CG2-CZ3 3.49Å; W78-T80 VanDerWaalsContact C-N 3.3Å
79	D	88.2	Confident	82.2	Confident	129 Å²	129	81.2 Å²	81.2	69%	0.69	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-1.1	178.9	-66.2	-33.1	0	0	0	113.5	D77 D81	D77-D79 PolarHBondContact O-N 2.95Å; D77-D79 PolarHBondContact OD1-N 3.41Å; D79-D81 PolarHBondContact O-N 3.34Å
80	T	87.8	Confident	82.7	Confident	44 Å²	44	77.9 Å²	77.9	27%	0.27	42%	0.415	S	S	.	.	S	Bend	trans	-63.9	136.6	176.9	-48.8	0	0	0	0	110.3	T44 V45 T76 D77 W78 I82	T44-T80 CarbonylContact C-O 3.48Å; T44-T80 WeakPolarHBondContact CA-O 3.43Å; V45-T80 WeakPolarHBondContact CG2-O 3.24Å; V45-T80 PolarHBondContact N-O 3.47Å; T76-T80 HydrophobicContact CG2-CG2 4.28Å; D77-T80 PolarHBondContact N-OG1 3.21Å; D77-T80 VanDerWaalsContact O-CB 3.25Å; D77-T80 WeakPolarHBondContact O-CB 3.46Å; D77-T80 PolarHBondContact O-N 2.81Å; D77-T80 VanDerWaalsContact O-N 3.13Å; D77-T80 PolarHBondContact O-OG1 3.45Å; W78-T80 VanDerWaalsContact C-N 3.3Å; T80-I82 PolarHBondContact O-N 3.12Å
81	D	87.4	Confident	83.6	Confident	68 Å²	68	69.4 Å²	69.4	36%	0.364	38%	0.376	S	S	.	.	B	Isolated β-bridge	trans	-60.7	132.5	170.2	-175.1	-2.8	0	0	0	110	D79 T83 P84	D79-D81 PolarHBondContact O-N 3.34Å; D81-T83 VanDerWaalsContact OD1-CB 3.27Å; D81-T83 WeakPolarHBondContact OD1-CB 3.38Å; D81-T83 PolarHBondContact OD1-N 3.42Å; D81-T83 PolarHBondContact OD1-OG1 2.96Å; D81-T83 PolarHBondContact OD2-OG1 3.42Å; D81-P84 VanDerWaalsContact O-CD 3.3Å; D81-P84 WeakPolarHBondContact O-CD 3.46Å; D81-P84 WeakPolarHBondContact O-CG 3.38Å
82	I	87.2	Confident	84.6	Confident	1 Å²	1	66 Å²	66	1%	0.005	34%	0.34	C	S	.	.	S	Bend	trans	-81.9	-17.5	-179.8	-162.1	167.6	0	0	0	113	I25 V39 Q43 S48 T80 L85	I25-I82 HydrophobicContact CD1-CD1 3.8Å; I25-I82 HydrophobicContact CD1-CG1 3.36Å; V39-I82 HydrophobicContact CG1-CG2 3.97Å; V39-I82 HydrophobicContact CG2-CG1 4.24Å; Q43-I82 HydrophobicContact CB-CG2 3.98Å; Q43-I82 WeakPolarHBondContact O-CG2 3.19Å; Q43-I82 PolarHBondContact O-N 2.94Å; S48-I82 WeakPolarHBondContact OG-CD1 3.46Å; S48-I82 WeakPolarHBondContact OG-CG2 3.39Å; T80-I82 PolarHBondContact O-N 3.12Å; I82-L85 HydrophobicContact CG1-CB 4.49Å; I82-L85 HydrophobicContact CG1-CD1 4.3Å; I82-L85 WeakPolarHBondContact O-CB 3.07Å; I82-L85 PolarHBondContact O-N 2.81Å
83	T	85.2	Confident	85.1	Confident	49 Å²	49	59.6 Å²	59.6	30%	0.301	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-53	-47.6	178.9	-46.8	0	0	0	0	114	D81 L85 V86	D81-T83 VanDerWaalsContact OD1-CB 3.27Å; D81-T83 WeakPolarHBondContact OD1-CB 3.38Å; D81-T83 PolarHBondContact OD1-N 3.42Å; D81-T83 PolarHBondContact OD1-OG1 2.96Å; D81-T83 PolarHBondContact OD2-OG1 3.42Å; T83-L85 PolarHBondContact O-N 3.24Å; T83-V86 VanDerWaalsContact O-CG2 3.32Å; T83-V86 WeakPolarHBondContact O-CG2 3.33Å
84	P	83.6	Confident	84.6	Confident	84 Å²	84	56 Å²	56	55%	0.545	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	-71.9	-4.1	177.3	28.7	-37.6	0	0	0	114.7	D81	D81-P84 VanDerWaalsContact O-CD 3.3Å; D81-P84 WeakPolarHBondContact O-CD 3.46Å; D81-P84 WeakPolarHBondContact O-CG 3.38Å
85	L	82.8	Confident	84.1	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-96.9	1.7	-175.5	-47.6	-174.8	0	0	0	112.7	I25 V45 I82 T83 G87 E88 L90	I25-L85 HydrophobicContact CD1-CB 3.52Å; I25-L85 WeakPolarHBondContact CD1-O 3.42Å; I25-L85 VanDerWaalsContact CG1-O 3.28Å; I25-L85 WeakPolarHBondContact CG1-O 3.32Å; V45-L85 HydrophobicContact CG2-CD1 3.64Å; I82-L85 HydrophobicContact CG1-CB 4.49Å; I82-L85 HydrophobicContact CG1-CD1 4.3Å; I82-L85 WeakPolarHBondContact O-CB 3.07Å; I82-L85 PolarHBondContact O-N 2.81Å; T83-L85 PolarHBondContact O-N 3.24Å; L85-G87 PolarHBondContact O-N 3.4Å; L85-E88 WeakPolarHBondContact CD2-OE2 3.42Å; L85-E88 WeakPolarHBondContact O-CB 3.45Å; L85-E88 PolarHBondContact O-N 3Å; L85-L90 HydrophobicContact CD1-CD1 4.36Å; L85-L90 HydrophobicContact CD1-CD2 4.39Å
86	V	83.1	Confident	82.3	Confident	70 Å²	70	54.8 Å²	54.8	42%	0.424	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	125.5	-179.8	172.2	0	0	0	0	110.6	V39 T83 E88	V39-V86 HydrophobicContact CB-CG2 3.81Å; V39-V86 HydrophobicContact CG1-CG2 3.71Å; V39-V86 HydrophobicContact CG2-CG2 3.68Å; T83-V86 VanDerWaalsContact O-CG2 3.32Å; T83-V86 WeakPolarHBondContact O-CG2 3.33Å; V86-E88 VanDerWaalsContact C-N 3.31Å
87	G	77.3	Confident	80.5	Confident	68 Å²	68	60.7 Å²	60.7	70%	0.701	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.9	-8.6	-179	0	0	0	0	0	115	T24 L85	T24-G87 PolarHBondContact O-N 3.17Å; L85-G87 PolarHBondContact O-N 3.4Å
88	E	86.1	Confident	78.7	Confident	41 Å²	41	57.4 Å²	57.4	19%	0.192	33%	0.326	C	S	.	.			trans	-82.9	167.5	173.1	-59.3	-175.3	158.5	0	0	112.2	R67 L85 V86	R67-E88 WeakPolarHBondContact CD-OE2 3.34Å; R67-E88 WeakPolarHBondContact CG-OE2 3.47Å; R67-E88 IonicContact CZ-OE1 2.76Å; R67-E88 IonicContact CZ-OE2 2.69Å; R67-E88 IonicContact NE-OE1 3.49Å; R67-E88 IonicContact NE-OE2 2.8Å; R67-E88 PolarHBondContact NE-OE2 3.48Å; R67-E88 IonicContact NH1-OE1 2.77Å; R67-E88 PolarHBondContact NH1-OE1 3.23Å; R67-E88 IonicContact NH1-OE2 3.49Å; R67-E88 PolarHBondContact NH1-OE2 2.89Å; R67-E88 VanDerWaalsContact NH1-OE2 3.09Å; L85-E88 WeakPolarHBondContact CD2-OE2 3.42Å; L85-E88 WeakPolarHBondContact O-CB 3.45Å; L85-E88 PolarHBondContact O-N 3Å; V86-E88 VanDerWaalsContact C-N 3.31Å
89	E	87.8	Confident	76.8	Confident	58 Å²	58	58.5 Å²	58.5	27%	0.271	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	125	173.1	-63.9	-164.6	141.5	0	0	110.4	R26 Y28 L68	R26-E89 HydrophobicContact CB-CG 4.35Å; R26-E89 IonicContact NH1-OE1 3.65Å; R26-E89 WeakPolarHBondContact O-CA 3.38Å; Y28-E89 HydrophobicContact CD2-CB 4.44Å; Y28-E89 HydrophobicContact CE2-CB 3.95Å; Y28-E89 VanDerWaalsContact CE2-CD 3.46Å; Y28-E89 HydrophobicContact CE2-CG 4.07Å; Y28-E89 WeakPolarHBondContact CE2-OE2 3.42Å; Y28-E89 PolarHBondContact OH-OE1 3.4Å; Y28-E89 PolarHBondContact OH-OE2 3.44Å; L68-E89 HydrophobicContact CB-CB 4.12Å; L68-E89 WeakPolarHBondContact CB-O 3.24Å; L68-E89 HydrophobicContact CD1-CB 4.01Å; L68-E89 PolarHBondContact N-O 3.06Å
90	L	88.3	Confident	74.9	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	141.5	173.9	-61.9	-179.8	0	0	0	110.2	I25 R26 V27 Y28 V65 F66 R67 L85	I25-L90 HydrophobicContact CG2-CB 4.49Å; I25-L90 HydrophobicContact CG2-CD1 3.89Å; I25-L90 HydrophobicContact CG2-CG 3.83Å; R26-L90 PolarHBondContact O-N 3.45Å; V27-L90 CarbonylContact C-O 3.53Å; V27-L90 WeakPolarHBondContact CA-O 3.39Å; V27-L90 HydrophobicContact CG1-CB 4.27Å; V27-L90 HydrophobicContact CG2-CB 4.32Å; Y28-L90 PolarHBondContact N-O 3.43Å; V65-L90 HydrophobicContact CG1-CB 4.25Å; V65-L90 HydrophobicContact CG1-CD1 4.29Å; V65-L90 HydrophobicContact CG1-CD2 4.3Å; F66-L90 CarbonylContact O-C 3.49Å; F66-L90 WeakPolarHBondContact O-CA 3.25Å; R67-L90 HydrophobicContact CB-CD2 4.21Å; R67-L90 HydrophobicContact CG-CD2 4.4Å; L85-L90 HydrophobicContact CD1-CD1 4.36Å; L85-L90 HydrophobicContact CD1-CD2 4.39Å
91	L	85.9	Confident	73.5	Confident	29 Å²	29	55 Å²	55	15%	0.152	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	121.1	174.4	175.7	66.3	0	0	0	108.9	Y28 F66 L68 K73 E93	Y28-L91 CarbonylContact O-C 3.58Å; Y28-L91 WeakPolarHBondContact O-CA 3.31Å; F66-L91 HydrophobicContact CB-CB 4.38Å; F66-L91 PolarHBondContact N-O 3.25Å; F66-L91 PolarHBondContact O-N 3.34Å; L68-L91 HydrophobicContact CD1-CB 3.92Å; L68-L91 HydrophobicContact CG-CB 4.33Å; K73-L91 HydrophobicContact CD-CD2 4.03Å; K73-L91 VanDerWaalsContact CE-CD2 3.45Å; L91-E93 HydrophobicContact CD1-CG 4.39Å; L91-E93 HydrophobicContact CD2-CG 3.95Å; L91-E93 WeakPolarHBondContact CD2-OE1 3.45Å; L91-E93 HydrophobicContact CG-CG 3.81Å
92	V	84	Confident	72.2	Confident	1 Å²	1	58 Å²	58	1%	0.006	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	117	174	-175.1	0	0	0	0	108.1	V27 Y28 L29 P30 L49 L53 C63 A64 V65	V27-V92 HydrophobicContact CG1-CG2 3.8Å; Y28-V92 PolarHBondContact O-N 2.81Å; L29-V92 HydrophobicContact CD2-CB 4.09Å; L29-V92 HydrophobicContact CD2-CG2 3.93Å; P30-V92 VanDerWaalsContact CD-O 3.25Å; P30-V92 WeakPolarHBondContact CD-O 3.39Å; P30-V92 HydrophobicContact CG-CG1 4.49Å; P30-V92 WeakPolarHBondContact CG-O 3.37Å; L49-V92 HydrophobicContact CD1-CG2 4.06Å; L53-V92 HydrophobicContact CD2-CG1 4.1Å; C63-V92 HydrophobicContact CB-CG1 3.75Å; A64-V92 WeakPolarHBondContact O-CA 3.46Å; V65-V92 HydrophobicContact CG2-CG2 4.28Å
93	E	81.8	Confident	71.4	Confident	71 Å²	71	59.2 Å²	59.2	33%	0.332	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	143.6	174.7	-54.7	-165.8	131.2	0	0	109.6	C63 A64 F66 K73 L91	C63-E93 CarbonylContact C-O 3.6Å; C63-E93 VanDerWaalsContact CA-O 3.25Å; C63-E93 WeakPolarHBondContact CA-O 3.32Å; A64-E93 PolarHBondContact N-O 2.7Å; A64-E93 PolarHBondContact O-N 3.46Å; F66-E93 HydrophobicContact CD2-CB 4.43Å; F66-E93 HydrophobicContact CD2-CG 4.08Å; F66-E93 HydrophobicContact CE2-CB 4.05Å; F66-E93 HydrophobicContact CE2-CG 4.1Å; K73-E93 IonicContact NZ-OE1 3.53Å; K73-E93 PolarHBondContact NZ-OE1 3.17Å; K73-E93 IonicContact NZ-OE2 3.6Å; K73-E93 PolarHBondContact NZ-OE2 3.3Å; L91-E93 HydrophobicContact CD1-CG 4.39Å; L91-E93 HydrophobicContact CD2-CG 3.95Å; L91-E93 WeakPolarHBondContact CD2-OE1 3.45Å; L91-E93 HydrophobicContact CG-CG 3.81Å
94	V	72.8	Confident	71.1	Confident	32 Å²	32	61 Å²	61	19%	0.194	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	131.7	173.2	175.9	0	0	0	0	106.8	P30 L58 D96 I98 L100	P30-V94 HydrophobicContact CB-CG2 3.78Å; P30-V94 HydrophobicContact CG-CG2 3.5Å; P30-V94 VanDerWaalsContact CG-CG2 3.5Å; L58-V94 HydrophobicContact CD2-CG2 4.15Å; V94-D96 PolarHBondContact O-N 3.42Å; V94-I98 HydrophobicContact CG1-CB 3.86Å; V94-I98 HydrophobicContact CG1-CD1 4.18Å; V94-I98 HydrophobicContact CG1-CG1 3.81Å; V94-L100 HydrophobicContact CB-CD1 4.39Å; V94-L100 HydrophobicContact CG1-CD1 3.95Å; V94-L100 HydrophobicContact CG2-CD1 3.66Å
95	L	72.5	Confident	71.1	Confident	86 Å²	86	60.1 Å²	60.1	45%	0.45	33%	0.333	S	S	.	.			trans	-64.2	135	175.3	-62.2	172.2	0	0	0	108.5	C62 A64 D97 I98	C62-L95 PolarHBondContact O-N 2.88Å; A64-L95 HydrophobicContact CB-CD2 3.92Å; L95-D97 PolarHBondContact O-N 2.88Å; L95-I98 PolarHBondContact O-N 3.32Å
96	D	48.6	Very low	71.1	Confident	169 Å²	169	63.1 Å²	63.1	90%	0.904	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-7.5	-163.2	-74.6	-48.2	0	0	0	116.2	V94 I98	V94-D96 PolarHBondContact O-N 3.42Å; D96-I98 PolarHBondContact O-N 3.14Å
97	D	48.7	Very low	71.3	Confident	134 Å²	134	68 Å²	68	72%	0.717	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	15.3	-179	-63.7	-44.1	0	0	0	115.1	L95 R157	L95-D97 PolarHBondContact O-N 2.88Å; D97-R157 PolarHBondContact O-NE 3.36Å; D97-R157 PolarHBondContact O-NH2 3.14Å
98	I	47	Very low	71.8	Confident	36 Å²	36	69 Å²	69	19%	0.185	35%	0.347	C	S	.	.			trans	-125.8	100.5	179.1	-26.9	-156.2	0	0	0	111.5	C62 V94 L95 D96 L100	C62-I98 HydrophobicContact CB-CD1 3.3Å; V94-I98 HydrophobicContact CG1-CB 3.86Å; V94-I98 HydrophobicContact CG1-CD1 4.18Å; V94-I98 HydrophobicContact CG1-CG1 3.81Å; L95-I98 PolarHBondContact O-N 3.32Å; D96-I98 PolarHBondContact O-N 3.14Å; I98-L100 HydrophobicContact CB-CG 4.38Å; I98-L100 HydrophobicContact CG2-CD2 3.9Å; I98-L100 HydrophobicContact CG2-CG 3.91Å; I98-L100 PolarHBondContact O-N 3.41Å
99	P	47.4	Very low	71.9	Confident	59 Å²	59	69.9 Å²	69.9	38%	0.383	36%	0.355	S	S	.	.			trans	-73.4	87.7	165.7	29.3	-27.8	0	0	0	108	T101 T153	P99-T101 PolarHBondContact O-N 3.49Å; P99-T153 VanDerWaalsContact CD-CG2 3.42Å; P99-T153 HydrophobicContact CG-CG2 3.27Å; P99-T153 WeakPolarHBondContact CG-OG1 3.37Å
100	L	47.8	Very low	71.7	Confident	47 Å²	47	67.9 Å²	67.9	25%	0.246	35%	0.346	C	S	.	.			trans	-71	72.6	166.6	-66.4	166.9	0	0	0	108.4	L58 V94 I98 M102 V147	L58-L100 HydrophobicContact CD2-CD1 3.53Å; L58-L100 HydrophobicContact CD2-CD2 4.22Å; V94-L100 HydrophobicContact CB-CD1 4.39Å; V94-L100 HydrophobicContact CG1-CD1 3.95Å; V94-L100 HydrophobicContact CG2-CD1 3.66Å; I98-L100 HydrophobicContact CB-CG 4.38Å; I98-L100 HydrophobicContact CG2-CD2 3.9Å; I98-L100 HydrophobicContact CG2-CG 3.91Å; I98-L100 PolarHBondContact O-N 3.41Å; L100-M102 PolarHBondContact O-N 3.19Å; L100-V147 HydrophobicContact CD2-CG1 3.85Å; L100-V147 HydrophobicContact CD2-CG2 3.97Å
101	T	58	Low	71.4	Confident	51 Å²	51	75.6 Å²	75.6	31%	0.313	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	128.4	166.5	70.7	0	0	0	0	107.3	P99 C148	P99-T101 PolarHBondContact O-N 3.49Å; T101-C148 WeakPolarHBondContact O-CA 3.37Å; T101-C148 WeakPolarHBondContact O-CB 3.45Å; T101-C148 PolarHBondContact O-N 2.86Å; T101-C148 WeakPolarHBondContact OG1-CB 3.46Å; T101-C148 PolarHBondContact OG1-O 3.05Å
102	M	60.7	Low	71.2	Confident	132 Å²	132	79.8 Å²	79.8	65%	0.65	40%	0.396	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.1	145	171.3	-69	-64.5	-61.7	0	0	108.4	L100 N104	L100-M102 PolarHBondContact O-N 3.19Å; M102-N104 PolarHBondContact O-N 2.87Å
103	H	70.4	Confident	71.2	Confident	26 Å²	26	83.2 Å²	83.2	12%	0.12	41%	0.414	C	S	.	.	P	Polyproline II helix	trans	-64.5	125.9	176.8	-76.6	-82.6	0	0	0	111.4	F105 C129 C132 P145 V147 C148	H103-F105 HydrophobicContact CB-CD1 4.31Å; H103-F105 HydrophobicContact CB-CD2 3.74Å; H103-F105 HydrophobicContact CB-CE1 3.82Å; H103-F105 HydrophobicContact CB-CE2 3.17Å; H103-F105 HydrophobicContact CB-CG 4.27Å; H103-F105 HydrophobicContact CB-CZ 3.2Å; H103-F105 AromaticContact CD2-CZ 3.73Å; H103-F105 AromaticContact CG-CE1 3.89Å; H103-F105 AromaticContact CG-CE2 3.73Å; H103-F105 AromaticContact CG-CZ 3.25Å; H103-F105 AromaticContact ND1-CE1 3.78Å; H103-F105 AromaticContact ND1-CZ 3.57Å; H103-C129 PolarHBondContact ND1-SG 2.96Å; H103-C132 PolarHBondContact CE1-SG 2.9Å; H103-C132 PolarHBondContact ND1-SG 2.88Å; H103-C132 VanDerWaalsContact ND1-SG 3.44Å; H103-P145 PolarHBondContact CD2-O 3.42Å; H103-P145 PolarHBondContact NE2-O 3.03Å; H103-V147 PolarHBondContact NE2-O 3.07Å; H103-V147 VanDerWaalsContact NE2-O 3.15Å; H103-C148 HydrophobicContact CB-CB 4.23Å
104	N	79.1	Confident	71.4	Confident	86 Å²	86	79.9 Å²	79.9	46%	0.46	40%	0.399	S	S	.	.			trans	-92.5	97.9	165.9	-176.1	3.9	0	0	0	109.8	M102 C129 Q130	M102-N104 PolarHBondContact O-N 2.87Å; N104-C129 CarbonylContact O-C 3.58Å; N104-C129 VanDerWaalsContact O-CA 3.31Å; N104-C129 WeakPolarHBondContact O-CA 3.18Å; N104-Q130 PolarHBondContact ND2-OE1 2.91Å; N104-Q130 PolarHBondContact O-N 3.41Å
105	F	83.7	Confident	72.1	Confident	67 Å²	67	80.6 Å²	80.6	29%	0.294	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	131.4	-177.4	-66.9	-61.4	0	0	0	112.3	H103 F127 C129 F136 V144	H103-F105 HydrophobicContact CB-CD1 4.31Å; H103-F105 HydrophobicContact CB-CD2 3.74Å; H103-F105 HydrophobicContact CB-CE1 3.82Å; H103-F105 HydrophobicContact CB-CE2 3.17Å; H103-F105 HydrophobicContact CB-CG 4.27Å; H103-F105 HydrophobicContact CB-CZ 3.2Å; H103-F105 AromaticContact CD2-CZ 3.73Å; H103-F105 AromaticContact CG-CE1 3.89Å; H103-F105 AromaticContact CG-CE2 3.73Å; H103-F105 AromaticContact CG-CZ 3.25Å; H103-F105 AromaticContact ND1-CE1 3.78Å; H103-F105 AromaticContact ND1-CZ 3.57Å; F105-F127 HydrophobicContact CB-CB 4.42Å; F105-C129 HydrophobicContact CD1-CB 3.73Å; F105-C129 HydrophobicContact CE1-CB 3.58Å; F105-F136 AromaticContact CD1-CE1 3.62Å; F105-F136 HydrophobicContact CD1-CE1 3.62Å; F105-F136 HydrophobicContact CD1-CZ 4.45Å; F105-F136 HydrophobicContact CD2-CE1 4.3Å; F105-F136 HydrophobicContact CD2-CZ 4.46Å; F105-F136 HydrophobicContact CE1-CD1 4.19Å; F105-F136 AromaticContact CE1-CE1 3.53Å; F105-F136 HydrophobicContact CE1-CE1 3.53Å; F105-F136 HydrophobicContact CE2-CE1 4.21Å; F105-F136 HydrophobicContact CG-CE1 4.02Å; F105-F136 HydrophobicContact CG-CZ 4.42Å; F105-F136 AromaticContact CZ-CE1 3.86Å; F105-F136 HydrophobicContact CZ-CE1 3.86Å; F105-V144 HydrophobicContact CE1-CG1 4.31Å; F105-V144 HydrophobicContact CE2-CG1 4.13Å; F105-V144 HydrophobicContact CZ-CG1 3.49Å; F105-V144 VanDerWaalsContact CZ-CG1 3.49Å
106	V	82.8	Confident	72.9	Confident	63 Å²	63	76.5 Å²	76.5	38%	0.382	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	138.9	172.6	179	0	0	0	0	109.8	K108 F127 R128 Q130	V106-K108 PolarHBondContact O-N 3.29Å; V106-F127 WeakPolarHBondContact O-CA 3.44Å; V106-R128 PolarHBondContact N-O 3.15Å; V106-R128 PolarHBondContact O-N 3.26Å; V106-Q130 HydrophobicContact CB-CG 4.46Å; V106-Q130 HydrophobicContact CG2-CG 3.78Å
107	R	87.6	Confident	74.6	Confident	172 Å²	172	70.6 Å²	70.6	65%	0.649	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.9	129.7	174.8	-151.3	178.4	-145.4	-179	4.5	109.1	G126 F127	R107-G126 CarbonylContact C-O 3.56Å; R107-G126 WeakPolarHBondContact CA-O 3.38Å; R107-F127 HydrophobicContact CB-CD1 4.25Å; R107-F127 HydrophobicContact CB-CE1 4.1Å; R107-F127 HydrophobicContact CG-CD1 4.33Å; R107-F127 HydrophobicContact CG-CE1 3.98Å; R107-F127 HydrophobicContact CG-CZ 4.36Å
108	K	86.6	Confident	76.3	Confident	90 Å²	90	68.3 Å²	68.3	39%	0.391	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	136.6	-175.4	-171.5	168.5	-179.5	172.3	0	111.1	V106 F110 G126 R128	V106-K108 PolarHBondContact O-N 3.29Å; K108-F110 HydrophobicContact CB-CE2 4.06Å; K108-F110 HydrophobicContact CB-CZ 4.09Å; K108-F110 HydrophobicContact CD-CD1 4.36Å; K108-F110 HydrophobicContact CD-CE1 3.88Å; K108-F110 HydrophobicContact CD-CZ 4.08Å; K108-F110 HydrophobicContact CG-CE1 4.27Å; K108-F110 HydrophobicContact CG-CE2 4.29Å; K108-F110 HydrophobicContact CG-CZ 4.16Å; K108-G126 PolarHBondContact N-O 2.85Å; K108-G126 PolarHBondContact O-N 3.29Å; K108-R128 HydrophobicContact CD-CB 4.46Å
109	T	87.9	Confident	78.2	Confident	58 Å²	58	68.2 Å²	68.2	36%	0.356	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	129.3	164.2	-60.2	0	0	0	0	108.4	F111 F124 N125	T109-F111 HydrophobicContact CG2-CE1 4.14Å; T109-F111 HydrophobicContact CG2-CE2 4.23Å; T109-F111 HydrophobicContact CG2-CZ 3.96Å; T109-F124 CarbonylContact C-O 3.51Å; T109-F124 WeakPolarHBondContact CA-O 3.49Å; T109-F124 HydrophobicContact CG2-CE1 4.3Å; T109-F124 HydrophobicContact CG2-CE2 4.42Å; T109-F124 HydrophobicContact CG2-CZ 4.12Å; T109-N125 WeakPolarHBondContact CB-OD1 3.42Å; T109-N125 VanDerWaalsContact CG2-OD1 3.23Å; T109-N125 WeakPolarHBondContact CG2-OD1 3.35Å; T109-N125 PolarHBondContact OG1-OD1 3.23Å
110	F	84.3	Confident	79.9	Confident	17 Å²	17	68.4 Å²	68.4	8%	0.075	33%	0.327	C	S	.	.			trans	-103.4	102.6	-177.4	-61.4	-94	0	0	0	108.8	K108 K112 A114 L123 F124 R128 K135	K108-F110 HydrophobicContact CB-CE2 4.06Å; K108-F110 HydrophobicContact CB-CZ 4.09Å; K108-F110 HydrophobicContact CD-CD1 4.36Å; K108-F110 HydrophobicContact CD-CE1 3.88Å; K108-F110 HydrophobicContact CD-CZ 4.08Å; K108-F110 HydrophobicContact CG-CE1 4.27Å; K108-F110 HydrophobicContact CG-CE2 4.29Å; K108-F110 HydrophobicContact CG-CZ 4.16Å; F110-K112 VanDerWaalsContact C-N 3.3Å; F110-A114 HydrophobicContact CB-CB 3.9Å; F110-A114 HydrophobicContact CD1-CB 3.74Å; F110-A114 HydrophobicContact CE1-CB 4.44Å; F110-A114 HydrophobicContact CG-CB 3.87Å; F110-L123 WeakPolarHBondContact CB-O 3.48Å; F110-L123 HydrophobicContact CD2-CD2 4.06Å; F110-L123 HydrophobicContact CD2-CG 3.91Å; F110-L123 HydrophobicContact CE2-CD2 3.56Å; F110-L123 HydrophobicContact CE2-CG 3.86Å; F110-L123 HydrophobicContact CZ-CD2 3.95Å; F110-F124 PolarHBondContact N-O 3.44Å; F110-R128 HydrophobicContact CZ-CB 4.18Å; F110-K135 HydrophobicContact CE1-CD 3.66Å; F110-K135 HydrophobicContact CE1-CG 4.15Å; F110-K135 HydrophobicContact CZ-CB 4.27Å; F110-K135 HydrophobicContact CZ-CD 3.98Å; F110-K135 HydrophobicContact CZ-CG 3.98Å
111	F	81.3	Confident	81.7	Confident	161 Å²	161	73.2 Å²	73.2	71%	0.706	35%	0.346	S	S	*	.	S	Bend	trans	-77.7	-17.9	176	-64.6	-74.1	0	0	0	113.2	T109	T109-F111 HydrophobicContact CG2-CE1 4.14Å; T109-F111 HydrophobicContact CG2-CE2 4.23Å; T109-F111 HydrophobicContact CG2-CZ 3.96Å
112	K	82.4	Confident	83.2	Confident	117 Å²	117	73.3 Å²	73.3	51%	0.509	34%	0.342	S	S	.	.	S	Bend	trans	-99.6	158.1	170.3	-64.1	-170.7	-179.1	-175.4	0	110.1	F110 A114 E568	F110-K112 VanDerWaalsContact C-N 3.3Å; K112-A114 PolarHBondContact O-N 3.21Å; K112-E568 IonicContact NZ-OE1 2.64Å; K112-E568 PolarHBondContact NZ-OE1 2.9Å; K112-E568 IonicContact NZ-OE2 2.67Å; K112-E568 PolarHBondContact NZ-OE2 3.15Å
113	L	84.2	Confident	84.5	Confident	74 Å²	74	67 Å²	67	39%	0.387	31%	0.311	S	S	.	.			trans	-54.5	125.3	177.1	-166.8	64.2	0	0	0	109.7	Y115 F122 V561 Q565	L113-Y115 HydrophobicContact CD2-CE2 4.39Å; L113-Y115 HydrophobicContact CG-CE2 4.21Å; L113-F122 HydrophobicContact CD1-CD2 3.61Å; L113-F122 HydrophobicContact CD1-CE2 3.66Å; L113-V561 HydrophobicContact CB-CG2 4.19Å; L113-V561 HydrophobicContact CD2-CG2 3.48Å; L113-V561 VanDerWaalsContact CD2-CG2 3.48Å; L113-V561 HydrophobicContact CG-CG2 3.81Å; L113-V561 WeakPolarHBondContact O-CG1 3.32Å; L113-Q565 PolarHBondContact O-NE2 2.73Å
114	A	85.9	Confident	85.4	Confident	0 Å²	0	70.6 Å²	70.6	0%	0	33%	0.326	C	S	.	.			trans	-146.5	151.6	179.7	0	0	0	0	0	109.3	F110 K112 F122 L123	F110-A114 HydrophobicContact CB-CB 3.9Å; F110-A114 HydrophobicContact CD1-CB 3.74Å; F110-A114 HydrophobicContact CE1-CB 4.44Å; F110-A114 HydrophobicContact CG-CB 3.87Å; K112-A114 PolarHBondContact O-N 3.21Å; A114-F122 WeakPolarHBondContact O-CD2 3.45Å; A114-L123 HydrophobicContact CB-CB 4.47Å; A114-L123 PolarHBondContact O-N 2.75Å
115	Y	88.1	Confident	85.9	Confident	48 Å²	48	70.8 Å²	70.8	19%	0.188	33%	0.327	C	S	.	.	B	Isolated β-bridge	trans	-122.3	153.1	177.4	-61.8	-83.5	0	0	0	110.1	L113 K121 Q558 V561	L113-Y115 HydrophobicContact CD2-CE2 4.39Å; L113-Y115 HydrophobicContact CG-CE2 4.21Å; Y115-K121 WeakPolarHBondContact CA-O 3.18Å; Y115-Q558 HydrophobicContact CD1-CG 4.09Å; Y115-Q558 HydrophobicContact CD2-CB 4.19Å; Y115-Q558 HydrophobicContact CD2-CG 3.74Å; Y115-Q558 HydrophobicContact CE1-CG 4.43Å; Y115-Q558 HydrophobicContact CE2-CG 4.06Å; Y115-Q558 HydrophobicContact CG-CG 3.75Å; Y115-V561 HydrophobicContact CD2-CB 4.22Å; Y115-V561 HydrophobicContact CD2-CG1 4.22Å; Y115-V561 HydrophobicContact CD2-CG2 4.37Å; Y115-V561 HydrophobicContact CE2-CB 4Å; Y115-V561 HydrophobicContact CE2-CG1 4.33Å; Y115-V561 HydrophobicContact CE2-CG2 3.68Å
116	C	88.4	Confident	86.2	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	32%	0.316	C	S	.	.			trans	-73	129.9	169.2	170.7	0	0	0	0	109.7	F118 C119 H120 K121 F136 H137	C116-F118 PolarHBondContact O-N 2.87Å; C116-F118 VanDerWaalsContact O-N 3.11Å; C116-F118 PolarHBondContact SG-N 2.84Å; C116-F118 VanDerWaalsContact SG-N 3.36Å; C116-C119 VanDerWaalsContact CB-SG 3.57Å; C116-C119 PolarHBondContact SG-N 3.25Å; C116-C119 VanDerWaalsContact SG-N 3.42Å; C116-C119 VanDerWaalsContact SG-SG 3.69Å; C116-H120 WeakPolarHBondContact O-CA 3.41Å; C116-H120 PolarHBondContact O-N 3.48Å; C116-K121 PolarHBondContact N-O 3.12Å; C116-F136 VanDerWaalsContact SG-CA 3.54Å; C116-H137 WeakPolarHBondContact CB-CE1 3.43Å; C116-H137 WeakPolarHBondContact CB-ND1 3.46Å
117	D	84.8	Confident	86.5	Confident	45 Å²	45	67 Å²	67	24%	0.241	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	5.6	-179.3	-58.3	-30	0	0	0	112.6	Y134 K135	D117-Y134 HydrophobicContact CB-CD2 3.82Å; D117-Y134 HydrophobicContact CB-CE1 4.29Å; D117-Y134 HydrophobicContact CB-CE2 3.47Å; D117-Y134 VanDerWaalsContact CB-CE2 3.47Å; D117-Y134 HydrophobicContact CB-CG 4.37Å; D117-Y134 PolarHBondContact O-OH 2.91Å; D117-Y134 VanDerWaalsContact O-OH 3.08Å; D117-Y134 WeakPolarHBondContact OD2-CA 3.46Å; D117-K135 WeakPolarHBondContact CB-O 3.2Å; D117-K135 VanDerWaalsContact CG-NZ 3.27Å; D117-K135 PolarHBondContact N-O 3.5Å; D117-K135 IonicContact OD1-NZ 3.52Å; D117-K135 PolarHBondContact OD1-NZ 2.88Å; D117-K135 PolarHBondContact OD2-N 3.15Å; D117-K135 IonicContact OD2-NZ 2.87Å; D117-K135 PolarHBondContact OD2-NZ 2.63Å
118	F	84.9	Confident	86.3	Confident	86 Å²	86	62.9 Å²	62.9	38%	0.377	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.4	-59.7	172.9	172.1	-104	0	0	0	112	C116 H120 C140 K143	C116-F118 PolarHBondContact O-N 2.87Å; C116-F118 VanDerWaalsContact O-N 3.11Å; C116-F118 PolarHBondContact SG-N 2.84Å; C116-F118 VanDerWaalsContact SG-N 3.36Å; F118-H120 PolarHBondContact O-CD2 3.35Å; F118-H120 PolarHBondContact O-NE2 3.5Å; F118-C140 HydrophobicContact CB-CB 4.49Å; F118-C140 HydrophobicContact CD1-CB 3.9Å; F118-K143 HydrophobicContact CD1-CB 3.85Å; F118-K143 HydrophobicContact CD1-CG 4.26Å; F118-K143 HydrophobicContact CD2-CB 3.68Å; F118-K143 HydrophobicContact CE1-CB 3.66Å; F118-K143 HydrophobicContact CE1-CG 3.6Å; F118-K143 HydrophobicContact CE2-CB 3.49Å; F118-K143 VanDerWaalsContact CE2-CB 3.49Å; F118-K143 HydrophobicContact CE2-CD 4.35Å; F118-K143 HydrophobicContact CE2-CG 3.96Å; F118-K143 HydrophobicContact CG-CB 3.88Å; F118-K143 HydrophobicContact CZ-CB 3.48Å; F118-K143 VanDerWaalsContact CZ-CB 3.48Å; F118-K143 HydrophobicContact CZ-CD 3.93Å; F118-K143 HydrophobicContact CZ-CG 3.44Å; F118-K143 VanDerWaalsContact CZ-CG 3.44Å
119	C	85.3	Confident	86.1	Confident	34 Å²	34	58.6 Å²	58.6	23%	0.23	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-5.7	-175.3	76	0	0	0	0	113.2	C116 K121 H137	C116-C119 VanDerWaalsContact CB-SG 3.57Å; C116-C119 PolarHBondContact SG-N 3.25Å; C116-C119 VanDerWaalsContact SG-N 3.42Å; C116-C119 VanDerWaalsContact SG-SG 3.69Å; C119-K121 PolarHBondContact O-N 3.4Å; C119-H137 PolarHBondContact SG-CE1 2.89Å; C119-H137 PolarHBondContact SG-ND1 2.74Å
120	H	83.4	Confident	85.6	Confident	63 Å²	63	61.4 Å²	61.4	29%	0.292	28%	0.282	S	S	.	.			trans	62.3	13.3	175.6	-61	-73.9	0	0	0	114.9	C116 F118 Q558	C116-H120 WeakPolarHBondContact O-CA 3.41Å; C116-H120 PolarHBondContact O-N 3.48Å; F118-H120 PolarHBondContact O-CD2 3.35Å; F118-H120 PolarHBondContact O-NE2 3.5Å; H120-Q558 PolarHBondContact O-NE2 3.15Å
121	K	86.3	Confident	84.9	Confident	148 Å²	148	63.7 Å²	63.7	64%	0.643	30%	0.297	S	S	*	.	S	Bend	trans	-93.2	159.1	176.3	-63.4	-179.7	-177.5	-179.8	0	112.2	Y115 C116 C119 L123	Y115-K121 WeakPolarHBondContact CA-O 3.18Å; C116-K121 PolarHBondContact N-O 3.12Å; C119-K121 PolarHBondContact O-N 3.4Å; K121-L123 PolarHBondContact O-N 3.2Å
122	F	88.6	Confident	84.3	Confident	53 Å²	53	57 Å²	57	23%	0.232	27%	0.27	C	S	.	.	B	Isolated β-bridge	trans	-52.5	132.7	178.2	175.9	-112.8	0	0	0	111.9	L113 A114 F124 H137 T215	L113-F122 HydrophobicContact CD1-CD2 3.61Å; L113-F122 HydrophobicContact CD1-CE2 3.66Å; A114-F122 WeakPolarHBondContact O-CD2 3.45Å; F122-F124 HydrophobicContact CE1-CB 3.76Å; F122-F124 HydrophobicContact CE1-CD2 4.49Å; F122-F124 HydrophobicContact CZ-CB 4.14Å; F122-F124 HydrophobicContact CZ-CD2 4.28Å; F122-H137 PolarHBondContact O-CE1 3.14Å; F122-H137 PolarHBondContact O-NE2 2.91Å; F122-T215 HydrophobicContact CD1-CG2 4.07Å
123	L	89.2	Confident	84.1	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	25%	0.254	C	S	.	.			trans	-120	97.9	-173.9	-178.6	65.6	0	0	0	110	F110 A114 K121 N125 K135 H137	F110-L123 WeakPolarHBondContact CB-O 3.48Å; F110-L123 HydrophobicContact CD2-CD2 4.06Å; F110-L123 HydrophobicContact CD2-CG 3.91Å; F110-L123 HydrophobicContact CE2-CD2 3.56Å; F110-L123 HydrophobicContact CE2-CG 3.86Å; F110-L123 HydrophobicContact CZ-CD2 3.95Å; A114-L123 HydrophobicContact CB-CB 4.47Å; A114-L123 PolarHBondContact O-N 2.75Å; K121-L123 PolarHBondContact O-N 3.2Å; L123-N125 WeakPolarHBondContact CD1-O 3.49Å; L123-K135 HydrophobicContact CD2-CB 3.73Å; L123-H137 HydrophobicContact CD1-CB 4.32Å; L123-H137 WeakPolarHBondContact CD1-CD2 3.37Å
124	F	89.3	Confident	84	Confident	101 Å²	101	49.7 Å²	49.7	44%	0.443	24%	0.239	S	C	.	.	S	Bend	trans	-86.1	-47.5	173.2	-173.6	-112.7	0	0	0	112.2	T109 F110 F122	T109-F124 CarbonylContact C-O 3.51Å; T109-F124 WeakPolarHBondContact CA-O 3.49Å; T109-F124 HydrophobicContact CG2-CE1 4.3Å; T109-F124 HydrophobicContact CG2-CE2 4.42Å; T109-F124 HydrophobicContact CG2-CZ 4.12Å; F110-F124 PolarHBondContact N-O 3.44Å; F122-F124 HydrophobicContact CE1-CB 3.76Å; F122-F124 HydrophobicContact CE1-CD2 4.49Å; F122-F124 HydrophobicContact CZ-CB 4.14Å; F122-F124 HydrophobicContact CZ-CD2 4.28Å
125	N	88.1	Confident	84.1	Confident	89 Å²	89	50.9 Å²	50.9	48%	0.476	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	132.3	177.3	-73.1	-33.7	0	0	0	109.8	T109 L123	T109-N125 WeakPolarHBondContact CB-OD1 3.42Å; T109-N125 VanDerWaalsContact CG2-OD1 3.23Å; T109-N125 WeakPolarHBondContact CG2-OD1 3.35Å; T109-N125 PolarHBondContact OG1-OD1 3.23Å; L123-N125 WeakPolarHBondContact CD1-O 3.49Å
126	G	90.6	Very high	84.3	Confident	5 Å²	5	49 Å²	49	5%	0.052	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-176.6	-147.2	176.7	0	0	0	0	0	113	R107 K108 F136	R107-G126 CarbonylContact C-O 3.56Å; R107-G126 WeakPolarHBondContact CA-O 3.38Å; K108-G126 PolarHBondContact N-O 2.85Å; K108-G126 PolarHBondContact O-N 3.29Å; G126-F136 WeakPolarHBondContact CA-O 3.42Å
127	F	88.7	Confident	84.4	Confident	46 Å²	46	50 Å²	50	20%	0.202	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	149	-178.9	-63.1	-86.4	0	0	0	110.2	F105 V106 R107 K135 F136 Q138	F105-F127 HydrophobicContact CB-CB 4.42Å; V106-F127 WeakPolarHBondContact O-CA 3.44Å; R107-F127 HydrophobicContact CB-CD1 4.25Å; R107-F127 HydrophobicContact CB-CE1 4.1Å; R107-F127 HydrophobicContact CG-CD1 4.33Å; R107-F127 HydrophobicContact CG-CE1 3.98Å; R107-F127 HydrophobicContact CG-CZ 4.36Å; F127-K135 VanDerWaalsContact O-CA 3.25Å; F127-K135 WeakPolarHBondContact O-CA 2.98Å; F127-F136 HydrophobicContact CB-CD1 4.04Å; F127-F136 HydrophobicContact CB-CE1 3.43Å; F127-F136 VanDerWaalsContact CB-CE1 3.43Å; F127-F136 HydrophobicContact CB-CE2 4.17Å; F127-F136 HydrophobicContact CB-CZ 3.49Å; F127-F136 VanDerWaalsContact CB-CZ 3.49Å; F127-F136 AromaticContact CD2-CE2 3.78Å; F127-F136 HydrophobicContact CD2-CE2 3.78Å; F127-F136 AromaticContact CD2-CZ 3.81Å; F127-F136 HydrophobicContact CD2-CZ 3.81Å; F127-F136 HydrophobicContact CG-CE1 4.28Å; F127-F136 HydrophobicContact CG-CE2 4.28Å; F127-F136 AromaticContact CG-CZ 3.83Å; F127-F136 HydrophobicContact CG-CZ 3.83Å; F127-F136 PolarHBondContact N-O 2.94Å; F127-F136 PolarHBondContact O-N 2.84Å; F127-Q138 HydrophobicContact CE2-CB 3.79Å; F127-Q138 HydrophobicContact CE2-CG 3.91Å
128	R	84.8	Confident	84.5	Confident	86 Å²	86	53 Å²	53	33%	0.325	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	131.5	172.6	179.7	174.7	176.8	-106.8	5.1	109.8	V106 K108 F110 Y134 K135	V106-R128 PolarHBondContact N-O 3.15Å; V106-R128 PolarHBondContact O-N 3.26Å; K108-R128 HydrophobicContact CD-CB 4.46Å; F110-R128 HydrophobicContact CZ-CB 4.18Å; R128-Y134 CarbonylContact C-O 3.6Å; R128-Y134 VanDerWaalsContact CA-O 3.32Å; R128-Y134 WeakPolarHBondContact CA-O 3.34Å; R128-K135 HydrophobicContact CB-CG 4.28Å; R128-K135 HydrophobicContact CG-CG 4.02Å
129	C	81.9	Confident	84.6	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	130.4	170.9	-174.5	0	0	0	0	109.7	H103 N104 F105 T131 C132 G133 Y134	H103-C129 PolarHBondContact ND1-SG 2.96Å; N104-C129 CarbonylContact O-C 3.58Å; N104-C129 VanDerWaalsContact O-CA 3.31Å; N104-C129 WeakPolarHBondContact O-CA 3.18Å; F105-C129 HydrophobicContact CD1-CB 3.73Å; F105-C129 HydrophobicContact CE1-CB 3.58Å; C129-T131 VanDerWaalsContact C-N 3.33Å; C129-C132 VanDerWaalsContact CB-SG 3.59Å; C129-G133 WeakPolarHBondContact O-CA 3.46Å; C129-G133 PolarHBondContact O-N 2.75Å; C129-Y134 PolarHBondContact N-O 2.79Å
130	Q	76.1	Confident	84.7	Confident	117 Å²	117	52.8 Å²	52.8	55%	0.547	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-31.6	177.1	-69.5	-174.9	-37.9	0	0	112.6	N104 V106	N104-Q130 PolarHBondContact ND2-OE1 2.91Å; N104-Q130 PolarHBondContact O-N 3.41Å; V106-Q130 HydrophobicContact CB-CG 4.46Å; V106-Q130 HydrophobicContact CG2-CG 3.78Å
131	T	70.1	Confident	84.8	Confident	64 Å²	64	53 Å²	53	39%	0.393	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79	-62.8	-177.5	-44.9	0	0	0	0	111.7	C129	C129-T131 VanDerWaalsContact C-N 3.33Å
132	C	69.6	Low	84.4	Confident	20 Å²	20	50.8 Å²	50.8	14%	0.135	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97	-10.1	-172.5	74.1	0	0	0	0	113.2	H103 C129 Y134 R540	H103-C132 PolarHBondContact CE1-SG 2.9Å; H103-C132 PolarHBondContact ND1-SG 2.88Å; H103-C132 VanDerWaalsContact ND1-SG 3.44Å; C129-C132 VanDerWaalsContact CB-SG 3.59Å; C132-Y134 VanDerWaalsContact C-N 3.3Å; C132-Y134 PolarHBondContact O-N 3.39Å; C132-R540 PolarHBondContact O-NH1 2.89Å
133	G	77.8	Confident	84	Confident	16 Å²	16	54.5 Å²	54.5	17%	0.165	28%	0.279	C	S	.	.			trans	78.5	4.4	179	0	0	0	0	0	115.5	C129 K135	C129-G133 WeakPolarHBondContact O-CA 3.46Å; C129-G133 PolarHBondContact O-N 2.75Å; G133-K135 VanDerWaalsContact O-CG 3.32Å; G133-K135 WeakPolarHBondContact O-CG 3.47Å; G133-K135 PolarHBondContact O-N 3.36Å
134	Y	82.1	Confident	83.3	Confident	22 Å²	22	55.3 Å²	55.3	9%	0.086	29%	0.285	C	S	.	.			trans	-59	129.9	178.5	-167	-91	0	0	0	111.7	D117 R128 C129 C132 F136 V144	D117-Y134 HydrophobicContact CB-CD2 3.82Å; D117-Y134 HydrophobicContact CB-CE1 4.29Å; D117-Y134 HydrophobicContact CB-CE2 3.47Å; D117-Y134 VanDerWaalsContact CB-CE2 3.47Å; D117-Y134 HydrophobicContact CB-CG 4.37Å; D117-Y134 PolarHBondContact O-OH 2.91Å; D117-Y134 VanDerWaalsContact O-OH 3.08Å; D117-Y134 WeakPolarHBondContact OD2-CA 3.46Å; R128-Y134 CarbonylContact C-O 3.6Å; R128-Y134 VanDerWaalsContact CA-O 3.32Å; R128-Y134 WeakPolarHBondContact CA-O 3.34Å; C129-Y134 PolarHBondContact N-O 2.79Å; C132-Y134 VanDerWaalsContact C-N 3.3Å; C132-Y134 PolarHBondContact O-N 3.39Å; Y134-F136 HydrophobicContact CD1-CD1 4.11Å; Y134-F136 HydrophobicContact CE1-CB 4.21Å; Y134-F136 HydrophobicContact CE1-CD1 4.31Å; Y134-V144 HydrophobicContact CD1-CG1 3.86Å; Y134-V144 HydrophobicContact CE1-CB 4.35Å; Y134-V144 HydrophobicContact CE1-CG1 3.74Å; Y134-V144 HydrophobicContact CE1-CG2 4.13Å
135	K	88.6	Confident	82.4	Confident	26 Å²	26	53.7 Å²	53.7	11%	0.113	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	134.7	-172	-55.6	169.4	-55.4	-50.7	0	111	F110 D117 L123 F127 R128 G133	F110-K135 HydrophobicContact CE1-CD 3.66Å; F110-K135 HydrophobicContact CE1-CG 4.15Å; F110-K135 HydrophobicContact CZ-CB 4.27Å; F110-K135 HydrophobicContact CZ-CD 3.98Å; F110-K135 HydrophobicContact CZ-CG 3.98Å; D117-K135 WeakPolarHBondContact CB-O 3.2Å; D117-K135 VanDerWaalsContact CG-NZ 3.27Å; D117-K135 PolarHBondContact N-O 3.5Å; D117-K135 IonicContact OD1-NZ 3.52Å; D117-K135 PolarHBondContact OD1-NZ 2.88Å; D117-K135 PolarHBondContact OD2-N 3.15Å; D117-K135 IonicContact OD2-NZ 2.87Å; D117-K135 PolarHBondContact OD2-NZ 2.63Å; L123-K135 HydrophobicContact CD2-CB 3.73Å; F127-K135 VanDerWaalsContact O-CA 3.25Å; F127-K135 WeakPolarHBondContact O-CA 2.98Å; R128-K135 HydrophobicContact CB-CG 4.28Å; R128-K135 HydrophobicContact CG-CG 4.02Å; G133-K135 VanDerWaalsContact O-CG 3.32Å; G133-K135 WeakPolarHBondContact O-CG 3.47Å; G133-K135 PolarHBondContact O-N 3.36Å
136	F	90.9	Very high	81.3	Confident	9 Å²	9	53 Å²	53	4%	0.039	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	157.8	179.7	67.8	-78	0	0	0	113.6	F105 C116 G126 F127 Y134 C140 S141 V144	F105-F136 AromaticContact CD1-CE1 3.62Å; F105-F136 HydrophobicContact CD1-CE1 3.62Å; F105-F136 HydrophobicContact CD1-CZ 4.45Å; F105-F136 HydrophobicContact CD2-CE1 4.3Å; F105-F136 HydrophobicContact CD2-CZ 4.46Å; F105-F136 HydrophobicContact CE1-CD1 4.19Å; F105-F136 AromaticContact CE1-CE1 3.53Å; F105-F136 HydrophobicContact CE1-CE1 3.53Å; F105-F136 HydrophobicContact CE2-CE1 4.21Å; F105-F136 HydrophobicContact CG-CE1 4.02Å; F105-F136 HydrophobicContact CG-CZ 4.42Å; F105-F136 AromaticContact CZ-CE1 3.86Å; F105-F136 HydrophobicContact CZ-CE1 3.86Å; C116-F136 VanDerWaalsContact SG-CA 3.54Å; G126-F136 WeakPolarHBondContact CA-O 3.42Å; F127-F136 HydrophobicContact CB-CD1 4.04Å; F127-F136 HydrophobicContact CB-CE1 3.43Å; F127-F136 VanDerWaalsContact CB-CE1 3.43Å; F127-F136 HydrophobicContact CB-CE2 4.17Å; F127-F136 HydrophobicContact CB-CZ 3.49Å; F127-F136 VanDerWaalsContact CB-CZ 3.49Å; F127-F136 AromaticContact CD2-CE2 3.78Å; F127-F136 HydrophobicContact CD2-CE2 3.78Å; F127-F136 AromaticContact CD2-CZ 3.81Å; F127-F136 HydrophobicContact CD2-CZ 3.81Å; F127-F136 HydrophobicContact CG-CE1 4.28Å; F127-F136 HydrophobicContact CG-CE2 4.28Å; F127-F136 AromaticContact CG-CZ 3.83Å; F127-F136 HydrophobicContact CG-CZ 3.83Å; F127-F136 PolarHBondContact N-O 2.94Å; F127-F136 PolarHBondContact O-N 2.84Å; Y134-F136 HydrophobicContact CD1-CD1 4.11Å; Y134-F136 HydrophobicContact CE1-CB 4.21Å; Y134-F136 HydrophobicContact CE1-CD1 4.31Å; F136-C140 HydrophobicContact CB-CB 4.28Å; F136-C140 HydrophobicContact CD2-CB 4.38Å; F136-S141 VanDerWaalsContact CE2-CA 3.47Å; F136-V144 HydrophobicContact CB-CG2 4.06Å; F136-V144 HydrophobicContact CD1-CG1 4.37Å; F136-V144 HydrophobicContact CD1-CG2 3.63Å; F136-V144 HydrophobicContact CD2-CG2 3.35Å; F136-V144 HydrophobicContact CE1-CG1 4.33Å; F136-V144 HydrophobicContact CE1-CG2 3.85Å; F136-V144 HydrophobicContact CE2-CG2 3.66Å; F136-V144 HydrophobicContact CG-CG2 3.38Å; F136-V144 HydrophobicContact CZ-CG2 3.88Å
137	H	91.1	Very high	79.9	Confident	21 Å²	21	54.4 Å²	54.4	10%	0.097	29%	0.291	C	S	.	.			trans	-71.7	152.6	171.4	-59.9	99.6	0	0	0	111.1	C116 C119 F122 L123 H139 C140	C116-H137 WeakPolarHBondContact CB-CE1 3.43Å; C116-H137 WeakPolarHBondContact CB-ND1 3.46Å; C119-H137 PolarHBondContact SG-CE1 2.89Å; C119-H137 PolarHBondContact SG-ND1 2.74Å; F122-H137 PolarHBondContact O-CE1 3.14Å; F122-H137 PolarHBondContact O-NE2 2.91Å; L123-H137 HydrophobicContact CD1-CB 4.32Å; L123-H137 WeakPolarHBondContact CD1-CD2 3.37Å; H137-H139 WeakPolarHBondContact CB-CE1 3.46Å; H137-H139 AromaticContact CD2-CE1 3.93Å; H137-H139 AromaticContact CG-CE1 3.44Å; H137-H139 VanDerWaalsContact CG-CE1 3.44Å; H137-H139 AromaticContact CG-NE2 3.88Å; H137-H139 AromaticContact ND1-CE1 3.9Å; H137-H139 AromaticContact ND1-NE2 3.93Å; H137-H139 PolarHBondContact O-N 2.86Å; H137-H139 VanDerWaalsContact O-N 3.12Å; H137-C140 HydrophobicContact CB-CB 4.37Å; H137-C140 WeakPolarHBondContact O-CB 3.42Å; H137-C140 PolarHBondContact O-N 3.02Å
138	Q	87.9	Confident	78.8	Confident	106 Å²	106	52.2 Å²	52.2	50%	0.495	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-54.2	-35.9	175.3	-176.4	165.2	-6.8	0	0	113.9	F127 C140 S141	F127-Q138 HydrophobicContact CE2-CB 3.79Å; F127-Q138 HydrophobicContact CE2-CG 3.91Å; Q138-C140 VanDerWaalsContact C-N 3.3Å; Q138-C140 PolarHBondContact O-N 2.88Å; Q138-S141 VanDerWaalsContact O-CB 3.31Å; Q138-S141 WeakPolarHBondContact O-CB 3.4Å; Q138-S141 PolarHBondContact O-N 3.36Å; Q138-S141 PolarHBondContact O-OG 3.06Å; Q138-S141 VanDerWaalsContact O-OG 3.06Å
139	H	87	Confident	77.6	Confident	112 Å²	112	51.1 Å²	51.1	52%	0.519	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-77.5	-12.7	177.8	63.2	-99.8	0	0	0	113.9	H137 S141	H137-H139 WeakPolarHBondContact CB-CE1 3.46Å; H137-H139 AromaticContact CD2-CE1 3.93Å; H137-H139 AromaticContact CG-CE1 3.44Å; H137-H139 VanDerWaalsContact CG-CE1 3.44Å; H137-H139 AromaticContact CG-NE2 3.88Å; H137-H139 AromaticContact ND1-CE1 3.9Å; H137-H139 AromaticContact ND1-NE2 3.93Å; H137-H139 PolarHBondContact O-N 2.86Å; H137-H139 VanDerWaalsContact O-N 3.12Å; H139-S141 VanDerWaalsContact C-N 3.33Å
140	C	86.9	Confident	76.3	Confident	5 Å²	5	53 Å²	53	3%	0.034	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-89.8	1	174.1	-62.4	0	0	0	0	112.4	F118 F136 H137 Q138 S142 K143	F118-C140 HydrophobicContact CB-CB 4.49Å; F118-C140 HydrophobicContact CD1-CB 3.9Å; F136-C140 HydrophobicContact CB-CB 4.28Å; F136-C140 HydrophobicContact CD2-CB 4.38Å; H137-C140 HydrophobicContact CB-CB 4.37Å; H137-C140 WeakPolarHBondContact O-CB 3.42Å; H137-C140 PolarHBondContact O-N 3.02Å; Q138-C140 VanDerWaalsContact C-N 3.3Å; Q138-C140 PolarHBondContact O-N 2.88Å; C140-S142 VanDerWaalsContact C-N 3.29Å; C140-S142 PolarHBondContact O-N 2.91Å; C140-K143 PolarHBondContact O-N 3.42Å
141	S	84.3	Confident	75.2	Confident	67 Å²	67	48.3 Å²	48.3	47%	0.469	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-54.8	-39.4	-173.5	58.9	0	0	0	0	114	F136 Q138 H139 K143 V144	F136-S141 VanDerWaalsContact CE2-CA 3.47Å; Q138-S141 VanDerWaalsContact O-CB 3.31Å; Q138-S141 WeakPolarHBondContact O-CB 3.4Å; Q138-S141 PolarHBondContact O-N 3.36Å; Q138-S141 PolarHBondContact O-OG 3.06Å; Q138-S141 VanDerWaalsContact O-OG 3.06Å; H139-S141 VanDerWaalsContact C-N 3.33Å; S141-K143 PolarHBondContact O-N 3.39Å; S141-K143 VanDerWaalsContact O-N 3.17Å; S141-V144 WeakPolarHBondContact O-CG2 3.35Å; S141-V144 PolarHBondContact O-N 3.44Å
142	S	78.4	Confident	74	Confident	102 Å²	102	48.7 Å²	48.7	71%	0.713	27%	0.272	S	S	*	.	G	3₁₀ helix	trans	-69.2	-9.9	180	59.4	0	0	0	0	114.2	C140	C140-S142 VanDerWaalsContact C-N 3.29Å; C140-S142 PolarHBondContact O-N 2.91Å
143	K	80.1	Confident	73	Confident	130 Å²	130	49.5 Å²	49.5	57%	0.565	28%	0.276	S	S	*	.	G	3₁₀ helix	trans	-109.4	-2.7	-178	-58.4	-66.8	-173.8	-178.7	0	112.9	F118 C140 S141	F118-K143 HydrophobicContact CD1-CB 3.85Å; F118-K143 HydrophobicContact CD1-CG 4.26Å; F118-K143 HydrophobicContact CD2-CB 3.68Å; F118-K143 HydrophobicContact CE1-CB 3.66Å; F118-K143 HydrophobicContact CE1-CG 3.6Å; F118-K143 HydrophobicContact CE2-CB 3.49Å; F118-K143 VanDerWaalsContact CE2-CB 3.49Å; F118-K143 HydrophobicContact CE2-CD 4.35Å; F118-K143 HydrophobicContact CE2-CG 3.96Å; F118-K143 HydrophobicContact CG-CB 3.88Å; F118-K143 HydrophobicContact CZ-CB 3.48Å; F118-K143 VanDerWaalsContact CZ-CB 3.48Å; F118-K143 HydrophobicContact CZ-CD 3.93Å; F118-K143 HydrophobicContact CZ-CG 3.44Å; F118-K143 VanDerWaalsContact CZ-CG 3.44Å; C140-K143 PolarHBondContact O-N 3.42Å; S141-K143 PolarHBondContact O-N 3.39Å; S141-K143 VanDerWaalsContact O-N 3.17Å
144	V	75.4	Confident	71.4	Confident	18 Å²	18	50.9 Å²	50.9	11%	0.109	28%	0.281	C	S	.	.	S	Bend	trans	-71.5	134.8	179	-177.4	0	0	0	0	109	F105 Y134 F136 S141 T146	F105-V144 HydrophobicContact CE1-CG1 4.31Å; F105-V144 HydrophobicContact CE2-CG1 4.13Å; F105-V144 HydrophobicContact CZ-CG1 3.49Å; F105-V144 VanDerWaalsContact CZ-CG1 3.49Å; Y134-V144 HydrophobicContact CD1-CG1 3.86Å; Y134-V144 HydrophobicContact CE1-CB 4.35Å; Y134-V144 HydrophobicContact CE1-CG1 3.74Å; Y134-V144 HydrophobicContact CE1-CG2 4.13Å; F136-V144 HydrophobicContact CB-CG2 4.06Å; F136-V144 HydrophobicContact CD1-CG1 4.37Å; F136-V144 HydrophobicContact CD1-CG2 3.63Å; F136-V144 HydrophobicContact CD2-CG2 3.35Å; F136-V144 HydrophobicContact CE1-CG1 4.33Å; F136-V144 HydrophobicContact CE1-CG2 3.85Å; F136-V144 HydrophobicContact CE2-CG2 3.66Å; F136-V144 HydrophobicContact CG-CG2 3.38Å; F136-V144 HydrophobicContact CZ-CG2 3.88Å; S141-V144 WeakPolarHBondContact O-CG2 3.35Å; S141-V144 PolarHBondContact O-N 3.44Å; V144-T146 PolarHBondContact O-N 3.39Å
145	P	70.2	Confident	69.4	Low	67 Å²	67	50.9 Å²	50.9	44%	0.435	28%	0.284	S	S	.	.			trans	-51.8	136.2	172.2	-26.8	35.2	0	0	0	111.3	H103 V147	H103-P145 PolarHBondContact CD2-O 3.42Å; H103-P145 PolarHBondContact NE2-O 3.03Å; P145-V147 VanDerWaalsContact C-N 3.32Å
146	T	63.9	Low	66.9	Low	75 Å²	75	56.7 Å²	56.7	46%	0.46	31%	0.31	S	S	.	.	S	Bend	trans	-75.4	-25	-178.1	48.6	0	0	0	0	112.5	V144	V144-T146 PolarHBondContact O-N 3.39Å
147	V	62.5	Low	64.4	Low	33 Å²	33	61.7 Å²	61.7	20%	0.2	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	124	-177.2	-175.2	0	0	0	0	110.1	L100 H103 P145 V149	L100-V147 HydrophobicContact CD2-CG1 3.85Å; L100-V147 HydrophobicContact CD2-CG2 3.97Å; H103-V147 PolarHBondContact NE2-O 3.07Å; H103-V147 VanDerWaalsContact NE2-O 3.15Å; P145-V147 VanDerWaalsContact C-N 3.32Å; V147-V149 HydrophobicContact CG1-CG2 4.31Å; V147-V149 PolarHBondContact O-N 2.97Å; V147-V149 VanDerWaalsContact O-N 3.12Å
148	C	65.7	Low	61.8	Low	0 Å²	0	63.5 Å²	63.5	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	99.4	168.2	-176.4	0	0	0	0	108.3	T101 H103 D150	T101-C148 WeakPolarHBondContact O-CA 3.37Å; T101-C148 WeakPolarHBondContact O-CB 3.45Å; T101-C148 PolarHBondContact O-N 2.86Å; T101-C148 WeakPolarHBondContact OG1-CB 3.46Å; T101-C148 PolarHBondContact OG1-O 3.05Å; H103-C148 HydrophobicContact CB-CB 4.23Å; C148-D150 PolarHBondContact O-N 2.91Å
149	V	59.1	Low	59.2	Low	64 Å²	64	64.2 Å²	64.2	39%	0.388	35%	0.35	S	S	.	.			trans	-76.5	107.4	171.1	-175.4	0	0	0	0	107.9	V147 V154	V147-V149 HydrophobicContact CG1-CG2 4.31Å; V147-V149 PolarHBondContact O-N 2.97Å; V147-V149 VanDerWaalsContact O-N 3.12Å; V149-V154 HydrophobicContact CG1-CG2 3.15Å
150	D	54.9	Low	56.4	Low	39 Å²	39	63.1 Å²	63.1	21%	0.209	36%	0.355	C	S	.	.			trans	-74.5	125.9	162	-165.9	-3.4	0	0	0	108.1	C148 D152 T153 K536	C148-D150 PolarHBondContact O-N 2.91Å; D150-D152 PolarHBondContact O-N 3.28Å; D150-T153 PolarHBondContact O-N 2.82Å; D150-T153 VanDerWaalsContact O-N 3.14Å; D150-K536 IonicContact OD1-NZ 2.92Å; D150-K536 PolarHBondContact OD1-NZ 3.01Å; D150-K536 IonicContact OD2-NZ 3.63Å
151	M	52.2	Low	53.7	Low	19 Å²	19	70.2 Å²	70.2	9%	0.094	39%	0.393	C	S	.	.	H	α-helix	trans	-68.8	-17.2	-172.4	-69.9	-63.3	-162.8	0	0	112.6	T153 V154 S155 R540 I543	M151-T153 PolarHBondContact O-N 3.11Å; M151-V154 PolarHBondContact O-N 2.78Å; M151-V154 HydrophobicContact SD-CB 4.48Å; M151-V154 HydrophobicContact SD-CG2 4.24Å; M151-S155 PolarHBondContact O-N 2.91Å; M151-S155 VanDerWaalsContact O-N 3.16Å; M151-R540 HydrophobicContact CE-CB 3.98Å; M151-R540 HydrophobicContact CE-CG 3.9Å; M151-I543 HydrophobicContact CE-CD1 3.4Å; M151-I543 VanDerWaalsContact CE-CD1 3.4Å; M151-I543 HydrophobicContact SD-CD1 3.67Å
152	D	45.8	Very low	51	Low	72 Å²	72	71.7 Å²	71.7	39%	0.385	40%	0.403	S	S	.	.	H	α-helix	trans	-65.9	-26.4	174.8	-65	-20.8	0	0	0	112	D150 K156 K536	D150-D152 PolarHBondContact O-N 3.28Å; D152-K156 WeakPolarHBondContact O-CG 3.4Å; D152-K536 WeakPolarHBondContact OD1-CE 3.26Å; D152-K536 IonicContact OD1-NZ 3.68Å; D152-K536 VanDerWaalsContact OD2-CE 3.24Å; D152-K536 WeakPolarHBondContact OD2-CE 3.48Å; D152-K536 IonicContact OD2-NZ 2.69Å; D152-K536 PolarHBondContact OD2-NZ 2.87Å
153	T	48.2	Very low	48.6	Very low	37 Å²	37	71.1 Å²	71.1	23%	0.227	40%	0.398	C	S	.	.	H	α-helix	trans	-84.3	-32.1	175.9	-33.5	0	0	0	0	112.5	P99 D150 M151 K156 R157	P99-T153 VanDerWaalsContact CD-CG2 3.42Å; P99-T153 HydrophobicContact CG-CG2 3.27Å; P99-T153 WeakPolarHBondContact CG-OG1 3.37Å; D150-T153 PolarHBondContact O-N 2.82Å; D150-T153 VanDerWaalsContact O-N 3.14Å; M151-T153 PolarHBondContact O-N 3.11Å; T153-K156 PolarHBondContact O-N 3.08Å; T153-R157 PolarHBondContact O-N 3.39Å
154	V	45.3	Very low	46	Very low	44 Å²	44	71.1 Å²	71.1	27%	0.267	41%	0.409	S	S	.	.	H	α-helix	trans	-66	-41.7	176.2	-179.9	0	0	0	0	110.7	V149 M151 K156 R157	V149-V154 HydrophobicContact CG1-CG2 3.15Å; M151-V154 PolarHBondContact O-N 2.78Å; M151-V154 HydrophobicContact SD-CB 4.48Å; M151-V154 HydrophobicContact SD-CG2 4.24Å; V154-K156 VanDerWaalsContact C-N 3.3Å; V154-K156 PolarHBondContact O-N 3.35Å; V154-R157 PolarHBondContact O-N 3.18Å
155	S	38.5	Very low	43.6	Very low	22 Å²	22	77.9 Å²	77.9	15%	0.154	44%	0.444	C	S	.	.	H	α-helix	trans	-62.8	-33.9	174.6	-74.2	0	0	0	0	112.9	M151	M151-S155 PolarHBondContact O-N 2.91Å; M151-S155 VanDerWaalsContact O-N 3.16Å
156	K	37.6	Very low	41.5	Very low	149 Å²	149	83.2 Å²	83.2	65%	0.648	46%	0.457	S	S	*	.	H	α-helix	trans	-80.5	-27.2	178.5	-71.8	-179.7	179.6	-175.7	0	114.3	D152 T153 V154 C158 D159	D152-K156 WeakPolarHBondContact O-CG 3.4Å; T153-K156 PolarHBondContact O-N 3.08Å; V154-K156 VanDerWaalsContact C-N 3.3Å; V154-K156 PolarHBondContact O-N 3.35Å; K156-C158 VanDerWaalsContact C-N 3.26Å; K156-C158 PolarHBondContact O-N 3.13Å; K156-D159 WeakPolarHBondContact O-CB 3.28Å; K156-D159 PolarHBondContact O-N 3.14Å; K156-D159 VanDerWaalsContact O-N 3.13Å
157	R	37.7	Very low	39.7	Very low	113 Å²	113	84.8 Å²	84.8	43%	0.426	47%	0.469	S	S	.	.	H	α-helix	trans	-71.2	-19.9	177	-92.1	-177.9	175.2	-166.4	-6.1	113.9	D97 T153 V154 S160	D97-R157 PolarHBondContact O-NE 3.36Å; D97-R157 PolarHBondContact O-NH2 3.14Å; T153-R157 PolarHBondContact O-N 3.39Å; V154-R157 PolarHBondContact O-N 3.18Å; R157-S160 PolarHBondContact O-OG 2.89Å
158	C	35.6	Very low	38.1	Very low	60 Å²	60	92.1 Å²	92.1	41%	0.405	50%	0.501	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-16.8	170.5	-68.6	0	0	0	0	112.4	K156	K156-C158 VanDerWaalsContact C-N 3.26Å; K156-C158 PolarHBondContact O-N 3.13Å
159	D	34	Very low	36.2	Very low	121 Å²	121	99.8 Å²	99.8	65%	0.647	54%	0.54	S	S	*	.	S	Bend	trans	-81	-18.8	178.1	-64.4	-36.2	0	0	0	113.2	K156	K156-D159 WeakPolarHBondContact O-CB 3.28Å; K156-D159 PolarHBondContact O-N 3.14Å; K156-D159 VanDerWaalsContact O-N 3.13Å
160	S	28.2	Very low	34.6	Very low	89 Å²	89	104 Å²	104	62%	0.622	56%	0.56	S	S	*	*	S	Bend	trans	-101.8	-8.7	-174.5	46.1	0	0	0	0	115.6	R157	R157-S160 PolarHBondContact O-OG 2.89Å
161	N	29.4	Very low	33.1	Very low	154 Å²	154	110.3 Å²	110.3	82%	0.824	59%	0.592	S	S	*	*			trans	-113.3	37.6	177.8	-87.1	0.3	0	0	0	113.5	C163	N161-C163 PolarHBondContact O-N 3.14Å
162	S	28.5	Very low	31.8	Very low	98 Å²	98	115.2 Å²	115.2	69%	0.685	63%	0.626	S	S	*	*			trans	-86.8	92.5	161.2	63.8	0	0	0	0	110.7
163	C	27	Very low	30.7	Very low	89 Å²	89	120.2 Å²	120.2	60%	0.601	65%	0.647	S	S	*	*			trans	43.1	94.4	136.7	-135.2	0	0	0	0	119.1	N161 Y166	N161-C163 PolarHBondContact O-N 3.14Å; C163-Y166 VanDerWaalsContact SG-CE2 3.59Å
164	T	27.6	Very low	29.6	Very low	131 Å²	131	126.3 Å²	126.3	80%	0.804	68%	0.678	S	S	*	*			trans	-145.3	91.2	135.2	47.5	0	0	0	0	108.5
165	D	24.2	Very low	28.6	Very low	159 Å²	159	129.3 Å²	129.3	85%	0.85	70%	0.701	S	S	*	*			trans	172.4	105.9	135.7	-92.4	-19.1	0	0	0	109.4
166	Y	26.3	Very low	28.3	Very low	179 Å²	179	133.8 Å²	133.8	70%	0.702	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-100.5	126.1	169	-89.9	-80.9	0	0	0	108.7	C163	C163-Y166 VanDerWaalsContact SG-CE2 3.59Å
167	P	25.9	Very low	27.7	Very low	108 Å²	108	132.5 Å²	132.5	70%	0.701	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-89.8	123.2	150.8	-5.7	24.1	0	0	0	109	I169	P167-I169 PolarHBondContact O-N 3.38Å
168	Q	28.9	Very low	27	Very low	188 Å²	188	136 Å²	136	88%	0.879	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-54.7	124.6	165.2	-73.2	176.5	-25.1	0	0	109.7
169	I	26	Very low	26.5	Very low	161 Å²	161	139 Å²	139	83%	0.826	78%	0.782	S	S	*	*			trans	-109.1	109.6	163.9	-62	-179.8	0	0	0	107.7	P167	P167-I169 PolarHBondContact O-N 3.38Å
170	L	24.1	Very low	26	Very low	153 Å²	153	140.3 Å²	140.3	80%	0.801	79%	0.789	S	S	*	*			trans	-59.6	131.4	168.6	-74.3	151.3	0	0	0	110
171	L	23.3	Very low	25.9	Very low	170 Å²	170	144.3 Å²	144.3	89%	0.89	80%	0.803	S	S	*	*			trans	-69.9	142.4	163.3	-71.7	159.7	0	0	0	109.4
172	P	26.2	Very low	25.6	Very low	123 Å²	123	141.1 Å²	141.1	80%	0.799	80%	0.798	S	S	*	*			trans	-104.3	127.6	152.1	1.4	18.7	0	0	0	110.7
173	E	22.5	Very low	25.3	Very low	177 Å²	177	144.8 Å²	144.8	83%	0.827	81%	0.809	S	S	*	*			trans	-61.9	137.1	157.2	-67.9	178.3	134.7	0	0	110.2
174	N	25	Very low	25.2	Very low	164 Å²	164	146.8 Å²	146.8	88%	0.877	82%	0.818	S	S	*	*				179.7	124.7	127.7	-92.8	-23.4	0	0	0	111.5
175	S	23.9	Very low	25.4	Very low	107 Å²	107	145.6 Å²	145.6	75%	0.748	81%	0.813	S	S	*	*			trans	-87.5	-175.3	161.6	49.4	0	0	0	0	110.6
176	P	32.4	Very low	25.3	Very low	117 Å²	117	146 Å²	146	76%	0.76	81%	0.809	S	S	*	*				-129.2	160.7	-58.8	35.8	-21	0	0	0	111.4
177	S	24.7	Very low	25.5	Very low	122 Å²	122	142.7 Å²	142.7	85%	0.853	81%	0.81	S	S	*	*			trans	-152.4	115.4	160	25.7	0	0	0	0	113.5
178	Q	23.8	Very low	25.5	Very low	185 Å²	185	142.7 Å²	142.7	86%	0.864	82%	0.819	S	S	*	*			trans	-7.6	130.8	155.2	-63.7	171.1	-4.4	0	0	117.9
179	S	25.4	Very low	25.3	Very low	124 Å²	124	137 Å²	137	87%	0.867	81%	0.811	S	S	*	*				-145.8	120.1	127	47.2	0	0	0	0	110.1
180	N	23.6	Very low	25.2	Very low	148 Å²	148	135.5 Å²	135.5	79%	0.791	82%	0.815	S	S	*	*			trans	-68.6	135.4	171.1	-71.6	-54.2	0	0	0	109.6
181	L	25.9	Very low	25.2	Very low	174 Å²	174	132 Å²	132	91%	0.911	82%	0.815	S	S	*	*			trans	-142.2	97	143.1	-97.3	166.1	0	0	0	107.9
182	A	21.6	Very low	25.3	Very low	87 Å²	87	132 Å²	132	72%	0.719	82%	0.815	S	S	*	*			trans	-79.7	134.9	165.6	0	0	0	0	0	108.8
183	L	23.8	Very low	25.3	Very low	174 Å²	174	134.2 Å²	134.2	91%	0.911	82%	0.82	S	S	*	*			trans	-130.1	112.9	156.2	-81.1	168.5	0	0	0	107.8
184	T	25.3	Very low	25.7	Very low	131 Å²	131	131.3 Å²	131.3	80%	0.804	82%	0.819	S	S	*	*			trans	-78.8	167.9	171.2	30.6	0	0	0	0	111.6
185	P	30.3	Very low	25.8	Very low	106 Å²	106	128.8 Å²	128.8	69%	0.688	81%	0.811	S	S	*	*			trans	-103.7	178.7	-153.2	39.8	-32.7	0	0	0	114.6
186	E	23.5	Very low	25.8	Very low	167 Å²	167	129.8 Å²	129.8	78%	0.78	81%	0.813	S	S	*	*			trans	138.2	160.6	148.6	-75.1	-71.7	113.8	0	0	112.2
187	P	30.1	Very low	25.4	Very low	111 Å²	111	133.9 Å²	133.9	72%	0.721	82%	0.819	S	S	*	*			cis	-133.1	-172.2	-49.9	34.5	-15.6	0	0	0	114.2
188	A	24.7	Very low	25.4	Very low	107 Å²	107	135 Å²	135	88%	0.884	82%	0.816	S	S	*	*			trans	-68.9	153.8	-170.7	0	0	0	0	0	117.5
189	G	24.5	Very low	25.4	Very low	69 Å²	69	135.4 Å²	135.4	71%	0.711	82%	0.815	S	S	*	*			trans	-164.9	93.4	167.9	0	0	0	0	0	113.5
190	S	25.4	Very low	25.6	Very low	130 Å²	130	135.4 Å²	135.4	91%	0.909	81%	0.812	S	S	*	*			trans	13.3	135.5	151	50.7	0	0	0	0	122.4
191	G	24.1	Very low	25.8	Very low	78 Å²	78	134.2 Å²	134.2	80%	0.804	81%	0.81	S	S	*	*			trans	163.7	103.9	151.2	0	0	0	0	0	115.4
192	L	25.4	Very low	26	Very low	171 Å²	171	133.1 Å²	133.1	90%	0.895	81%	0.811	S	S	*	*			trans	-53.9	145.9	166.8	-74.6	146	0	0	0	111.9
193	L	24.6	Very low	26.2	Very low	170 Å²	170	132.6 Å²	132.6	89%	0.89	81%	0.814	S	S	*	*				165.1	125.9	125.9	-84.1	163.8	0	0	0	111
194	S	32	Very low	26.5	Very low	116 Å²	116	127.6 Å²	127.6	81%	0.811	81%	0.805	S	S	*	*			trans	-67.9	149.8	166.7	-47.2	0	0	0	0	110.9
195	P	27.1	Very low	26.6	Very low	110 Å²	110	129.6 Å²	129.6	71%	0.714	81%	0.811	S	S	*	*			trans	-120.9	117.8	148.9	21.2	-2.6	0	0	0	111.8
196	T	23.3	Very low	26.9	Very low	128 Å²	128	128.4 Å²	128.4	79%	0.785	82%	0.817	S	S	*	*			trans	-17.8	120.2	142.7	25.4	0	0	0	0	115	N198	T196-N198 PolarHBondContact O-N 2.92Å
197	F	25.1	Very low	27.5	Very low	203 Å²	203	128.8 Å²	128.8	89%	0.89	82%	0.819	S	S	*	*			trans	-76.8	104.2	162.7	-89	-87.6	0	0	0	109.6
198	N	22.9	Very low	27.6	Very low	146 Å²	146	129.3 Å²	129.3	78%	0.781	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-72.7	128.3	163.6	-85.1	-13.2	0	0	0	109.5	T196	T196-N198 PolarHBondContact O-N 2.92Å
199	F	25.5	Very low	28.1	Very low	193 Å²	193	132 Å²	132	85%	0.846	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-78.1	128.5	166.1	-83.6	-88.8	0	0	0	110
200	P	27.9	Very low	29	Very low	124 Å²	124	136.5 Å²	136.5	81%	0.805	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-76.1	127.4	159.8	-3.8	21.2	0	0	0	109.1
201	T	28.9	Very low	30.1	Very low	123 Å²	123	141.7 Å²	141.7	76%	0.755	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-96.6	166	162.3	25.6	0	0	0	0	109.6
202	T	29.5	Very low	31.5	Very low	151 Å²	151	145.4 Å²	145.4	93%	0.926	82%	0.822	S	S	*	*			trans	86.6	129.8	-176.2	74.7	0	0	0	0	114.3
203	G	25.9	Very low	33.1	Very low	76 Å²	76	148.8 Å²	148.8	78%	0.784	82%	0.823	S	S	*	*			cis	175.9	153	-2.7	0	0	0	0	0	109.6
204	G	29.9	Very low	34.8	Very low	69 Å²	69	146.2 Å²	146.2	71%	0.711	82%	0.819	S	S	*	*			trans	73.7	97.5	158.4	0	0	0	0	0	117.8
205	D	28.2	Very low	36.2	Very low	174 Å²	174	145.8 Å²	145.8	93%	0.93	81%	0.812	S	S	*	*				-170	133.6	117.5	-94.9	-23.8	0	0	0	111.5	Q207	D205-Q207 PolarHBondContact O-N 2.94Å
206	G	37.2	Very low	38.1	Very low	80 Å²	80	145.5 Å²	145.5	83%	0.825	81%	0.812	S	S	*	*			trans	-72.4	105.6	-169.5	0	0	0	0	0	113.4
207	Q	34.1	Very low	40	Very low	176 Å²	176	145.4 Å²	145.4	82%	0.822	81%	0.812	S	S	*	*			trans	-131	137	145.4	-72.1	-174.7	12.5	0	0	108.1	D205 L209	D205-Q207 PolarHBondContact O-N 2.94Å; Q207-L209 VanDerWaalsContact C-N 3.3Å; Q207-L209 PolarHBondContact O-N 2.83Å
208	S	33.1	Very low	42.1	Very low	122 Å²	122	139.2 Å²	139.2	85%	0.853	79%	0.792	S	S	*	*			trans	-54.4	88.7	177.7	162	0	0	0	0	111	Q210	S208-Q210 VanDerWaalsContact C-N 3.34Å; S208-Q210 PolarHBondContact O-N 2.96Å
209	L	35.7	Very low	44.5	Very low	163 Å²	163	138.3 Å²	138.3	85%	0.853	79%	0.787	S	S	*	*			trans	-71	95.6	166.2	-75.7	168.2	0	0	0	106.9	Q207 R211	Q207-L209 VanDerWaalsContact C-N 3.3Å; Q207-L209 PolarHBondContact O-N 2.83Å; L209-R211 PolarHBondContact O-N 3.46Å
210	Q	44	Very low	46.5	Very low	163 Å²	163	135.3 Å²	135.3	76%	0.762	78%	0.784	S	S	*	*			trans	-61.5	92.2	167.6	-148	171	21.5	0	0	106.9	S208 H212	S208-Q210 VanDerWaalsContact C-N 3.34Å; S208-Q210 PolarHBondContact O-N 2.96Å; Q210-H212 PolarHBondContact O-N 2.79Å
211	R	47.9	Very low	47.7	Very low	240 Å²	240	136.5 Å²	136.5	91%	0.906	78%	0.779	S	S	*	*			trans	-54.6	109.4	-176.4	-139.5	-179.8	-165.4	-168.9	4.8	107.8	L209 R213	L209-R211 PolarHBondContact O-N 3.46Å; R211-R213 PolarHBondContact O-N 3.18Å
212	H	53.7	Low	48.2	Very low	155 Å²	155	139.5 Å²	139.5	72%	0.718	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-60.6	128.4	-178	-66.1	-58.2	0	0	0	109.5	Q210 S214	Q210-H212 PolarHBondContact O-N 2.79Å; H212-S214 PolarHBondContact O-N 2.89Å
213	R	58.1	Low	48.7	Very low	242 Å²	242	137.4 Å²	137.4	91%	0.913	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-71.2	124.9	171.4	-68.5	-175.3	179.8	173.5	-0.2	108.2	R211	R211-R213 PolarHBondContact O-N 3.18Å
214	S	59.8	Low	48.9	Very low	116 Å²	116	138.3 Å²	138.3	81%	0.811	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-54.4	142.2	167	-54.5	0	0	0	0	109.6	H212 S216	H212-S214 PolarHBondContact O-N 2.89Å; S214-S216 PolarHBondContact O-N 3.47Å
215	T	62.1	Low	49.2	Very low	108 Å²	108	140.8 Å²	140.8	66%	0.663	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-65.4	124.5	-179.6	50.3	0	0	0	0	110.3	F122	F122-T215 HydrophobicContact CD1-CG2 4.07Å
216	S	67.3	Low	49.5	Very low	103 Å²	103	136.3 Å²	136.3	72%	0.72	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-77.3	172.3	169.3	56.2	0	0	0	0	111.4	S214	S214-S216 PolarHBondContact O-N 3.47Å
217	T	63.1	Low	49.4	Very low	127 Å²	127	137.4 Å²	137.4	78%	0.779	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-54.3	128.5	176.6	-44.1	0	0	0	0	111.4
218	P	70	Confident	49.6	Very low	72 Å²	72	135.6 Å²	135.6	47%	0.468	73%	0.729	S	S	.	*	P	Polyproline II helix	trans	-75.1	169.5	175.4	31.7	-34.7	0	0	0	112
219	N	73.1	Confident	49.9	Very low	127 Å²	127	133.7 Å²	133.7	68%	0.679	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-60	139.1	176.5	-65.9	-23.3	0	0	0	111.7
220	V	67.6	Low	50	Low	130 Å²	130	128.8 Å²	128.8	79%	0.788	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-95.8	117.3	174.2	-178.4	0	0	0	0	108.8
221	H	53.3	Low	49.9	Very low	150 Å²	150	124.5 Å²	124.5	69%	0.694	68%	0.675	S	S	*	*			trans	-104	122.1	171.5	-77.4	-77	0	0	0	109.6	V223	H221-V223 PolarHBondContact O-N 2.86Å
222	M	38.3	Very low	49.8	Very low	185 Å²	185	118 Å²	118	91%	0.911	66%	0.657	S	S	*	*			trans	-84.6	106.1	168.8	-65.7	-149.1	-65.4	0	0	109	S224	M222-S224 PolarHBondContact O-N 3.26Å
223	V	39.4	Very low	49.2	Very low	108 Å²	108	115 Å²	115	66%	0.655	65%	0.649	S	S	*	*			trans	-86.5	103.1	167.1	-179	0	0	0	0	107	H221 T225	H221-V223 PolarHBondContact O-N 2.86Å; V223-T225 PolarHBondContact O-N 3.5Å
224	S	30.2	Very low	48.4	Very low	95 Å²	95	108.3 Å²	108.3	66%	0.664	63%	0.631	S	S	*	*			trans	-73	114.3	178	-159.3	0	0	0	0	109.6	M222 V226	M222-S224 PolarHBondContact O-N 3.26Å; S224-V226 VanDerWaalsContact C-N 3.26Å; S224-V226 PolarHBondContact O-N 3.25Å; S224-V226 WeakPolarHBondContact OG-CG2 3.36Å
225	T	37.3	Very low	47.4	Very low	121 Å²	121	108.6 Å²	108.6	74%	0.742	62%	0.619	S	S	*	*			trans	-89.8	24.3	178	59	0	0	0	0	112.6	V223 D227	V223-T225 PolarHBondContact O-N 3.5Å; T225-D227 PolarHBondContact O-N 2.91Å
226	V	34.8	Very low	46.1	Very low	80 Å²	80	110 Å²	110	49%	0.485	62%	0.618	S	S	.	*			trans	-72.1	126.1	179.2	-116.6	0	0	0	0	109.9	S224 T230	S224-V226 VanDerWaalsContact C-N 3.26Å; S224-V226 PolarHBondContact O-N 3.25Å; S224-V226 WeakPolarHBondContact OG-CG2 3.36Å; V226-T230 HydrophobicContact CG1-CG2 4.22Å
227	D	35.4	Very low	44.8	Very low	103 Å²	103	109.8 Å²	109.8	55%	0.551	61%	0.613	S	S	*	*			trans	-60.1	139.2	170.2	-165.8	-1.9	0	0	0	109.8	T225 T229 T230	T225-D227 PolarHBondContact O-N 2.91Å; D227-T229 PolarHBondContact O-N 3.33Å; D227-T229 VanDerWaalsContact O-N 3.14Å; D227-T229 PolarHBondContact OD1-OG1 3.02Å; D227-T229 PolarHBondContact OD2-OG1 3.17Å; D227-T230 WeakPolarHBondContact O-CB 2.9Å; D227-T230 PolarHBondContact O-N 3.35Å; D227-T230 PolarHBondContact O-OG1 3.47Å
228	I	38	Very low	43.5	Very low	137 Å²	137	110.1 Å²	110.1	70%	0.703	61%	0.609	S	S	*	*	H	α-helix	trans	-60.5	-26.5	-176.7	-70.1	171.3	0	0	0	110.8	T230 V231	I228-T230 VanDerWaalsContact C-N 3.3Å; I228-T230 PolarHBondContact O-N 2.88Å; I228-V231 PolarHBondContact O-N 2.93Å
229	T	38.1	Very low	41.9	Very low	82 Å²	82	114.1 Å²	114.1	50%	0.503	62%	0.62	S	S	.	*	H	α-helix	trans	-63.8	-29.5	172.3	43.8	0	0	0	0	113.6	D227	D227-T229 PolarHBondContact O-N 3.33Å; D227-T229 VanDerWaalsContact O-N 3.14Å; D227-T229 PolarHBondContact OD1-OG1 3.02Å; D227-T229 PolarHBondContact OD2-OG1 3.17Å
230	T	39.5	Very low	40.1	Very low	61 Å²	61	117.9 Å²	117.9	37%	0.374	63%	0.625	S	S	.	*	H	α-helix	trans	-77.6	-27.9	-179.1	-44.5	0	0	0	0	111.7	V226 D227 I228 V233 L234	V226-T230 HydrophobicContact CG1-CG2 4.22Å; D227-T230 WeakPolarHBondContact O-CB 2.9Å; D227-T230 PolarHBondContact O-N 3.35Å; D227-T230 PolarHBondContact O-OG1 3.47Å; I228-T230 VanDerWaalsContact C-N 3.3Å; I228-T230 PolarHBondContact O-N 2.88Å; T230-V233 PolarHBondContact O-N 3.06Å; T230-L234 HydrophobicContact CG2-CD1 4.35Å; T230-L234 PolarHBondContact O-N 3.37Å
231	V	41.6	Very low	38.7	Very low	73 Å²	73	118.8 Å²	118.8	44%	0.442	63%	0.626	S	S	.	*	H	α-helix	trans	-68.8	-36.3	179	-174.5	0	0	0	0	111.1	I228 V233 L234 E235	I228-V231 PolarHBondContact O-N 2.93Å; V231-V233 VanDerWaalsContact C-N 3.34Å; V231-V233 PolarHBondContact O-N 3.14Å; V231-L234 PolarHBondContact O-N 3.09Å; V231-E235 PolarHBondContact O-N 3.45Å
232	I	44.5	Very low	37.6	Very low	102 Å²	102	117.7 Å²	117.7	52%	0.523	63%	0.63	S	S	.	*	H	α-helix	trans	-66.2	-37.6	178.9	-61	175.5	0	0	0	111	E236	I232-E236 PolarHBondContact O-N 2.96Å
233	V	42.3	Very low	37.3	Very low	94 Å²	94	117.3 Å²	117.3	57%	0.57	63%	0.63	S	S	*	*	H	α-helix	trans	-73.6	-31.2	180	-178.4	0	0	0	0	112.2	T230 V231 T237	T230-V233 PolarHBondContact O-N 3.06Å; V231-V233 VanDerWaalsContact C-N 3.34Å; V231-V233 PolarHBondContact O-N 3.14Å; V233-T237 PolarHBondContact O-N 3.03Å; V233-T237 PolarHBondContact O-OG1 2.92Å
234	L	40.2	Very low	36.8	Very low	100 Å²	100	115.5 Å²	115.5	52%	0.524	63%	0.633	S	S	.	*	H	α-helix	trans	-76.1	-34.1	175.9	-77.8	161.9	0	0	0	112.6	T230 V231 T237 L238	T230-L234 HydrophobicContact CG2-CD1 4.35Å; T230-L234 PolarHBondContact O-N 3.37Å; V231-L234 PolarHBondContact O-N 3.09Å; L234-T237 PolarHBondContact O-N 2.91Å; L234-T237 PolarHBondContact O-OG1 3.37Å; L234-L238 PolarHBondContact O-N 3.47Å
235	E	39.2	Very low	37.3	Very low	122 Å²	122	116.9 Å²	116.9	57%	0.57	64%	0.64	S	S	*	*	H	α-helix	trans	-69	-32.5	174.9	-92	-168	152.5	0	0	113.1	V231	V231-E235 PolarHBondContact O-N 3.45Å
236	E	35.7	Very low	36.8	Very low	137 Å²	137	119.6 Å²	119.6	64%	0.64	64%	0.644	S	S	*	*	H	α-helix	trans	-71.3	-31.1	175.2	-84.3	-171.4	146.1	0	0	113	I232	I232-E236 PolarHBondContact O-N 2.96Å
237	T	38.8	Very low	36.8	Very low	99 Å²	99	120.4 Å²	120.4	61%	0.607	65%	0.651	S	S	*	*	H	α-helix	trans	-80.7	-19.9	179.4	26.6	0	0	0	0	113.7	V233 L234	V233-T237 PolarHBondContact O-N 3.03Å; V233-T237 PolarHBondContact O-OG1 2.92Å; L234-T237 PolarHBondContact O-N 2.91Å; L234-T237 PolarHBondContact O-OG1 3.37Å
238	L	37.2	Very low	36.5	Very low	134 Å²	134	120.7 Å²	120.7	70%	0.702	66%	0.661	S	S	*	*	H	α-helix	trans	-89.6	-10.7	177.1	-75.4	163.5	0	0	0	114	L234 Y240	L234-L238 PolarHBondContact O-N 3.47Å; L238-Y240 VanDerWaalsContact C-N 3.32Å; L238-Y240 PolarHBondContact O-N 2.88Å
239	K	36.5	Very low	36.2	Very low	157 Å²	157	120.4 Å²	120.4	68%	0.683	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.8	-7	177.5	-81.3	176.3	-179.8	173	0	114.9
240	Y	34	Very low	35.8	Very low	205 Å²	205	126 Å²	126	80%	0.804	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.2	1.6	-177.6	-90.1	-78.1	0	0	0	116	L238	L238-Y240 VanDerWaalsContact C-N 3.32Å; L238-Y240 PolarHBondContact O-N 2.88Å
241	N	38.4	Very low	35.5	Very low	150 Å²	150	128.8 Å²	128.8	80%	0.802	70%	0.704	S	S	*	*			trans	-133.8	91.2	176.5	-79.6	-37	0	0	0	110.9
242	T	29.2	Very low	35	Very low	127 Å²	127	130.6 Å²	130.6	78%	0.779	72%	0.717	S	S	*	*			trans	-145	102	167.1	-20.2	0	0	0	0	109.9
243	I	32	Very low	34.3	Very low	177 Å²	177	132.3 Å²	132.3	91%	0.908	73%	0.733	S	S	*	*			trans	-117.5	137.9	156.7	-66.5	177.1	0	0	0	106.2
244	G	29.6	Very low	33.7	Very low	69 Å²	69	133.4 Å²	133.4	71%	0.711	75%	0.745	S	S	*	*			trans	-72.8	-170.3	-155.7	0	0	0	0	0	119.9
245	P	41.4	Very low	33.6	Very low	125 Å²	125	134.3 Å²	134.3	81%	0.812	76%	0.757	S	S	*	*			trans	-113.4	166.3	-148.7	41.1	-32.3	0	0	0	115.4
246	E	25.5	Very low	33.5	Very low	178 Å²	178	134.1 Å²	134.1	83%	0.832	77%	0.766	S	S	*	*			trans	175.2	163.5	148.4	-99.8	-84.3	120.7	0	0	110.3
247	P	35	Very low	33.2	Very low	97 Å²	97	132.8 Å²	132.8	63%	0.63	77%	0.772	S	S	*	*				-120.4	173.5	-108.3	36.2	-17.9	0	0	0	116.5
248	S	29.3	Very low	32.7	Very low	108 Å²	108	133 Å²	133	76%	0.755	78%	0.777	S	S	*	*			trans	-54.7	161.8	-177.6	54.2	0	0	0	0	118.5
249	P	31.5	Very low	32.3	Very low	132 Å²	132	134.9 Å²	134.9	86%	0.857	79%	0.787	S	S	*	*			trans	-130.6	158.5	131.5	33	-18.5	0	0	0	115.7
250	K	30.9	Very low	31.8	Very low	199 Å²	199	131.2 Å²	131.2	87%	0.865	79%	0.794	S	S	*	*			trans	-73.6	167.2	-170.5	-72.8	175.9	-179.1	174.7	0	115.1
251	P	33.7	Very low	31.6	Very low	119 Å²	119	127.1 Å²	127.1	77%	0.773	80%	0.795	S	S	*	*			trans	-93.9	158	-170.8	37.6	-32.4	0	0	0	113.5
252	P	30.9	Very low	31.7	Very low	111 Å²	111	126.2 Å²	126.2	72%	0.721	80%	0.798	S	S	*	*			trans	-107.1	120.5	161.1	33.3	-21.8	0	0	0	111.1
253	T	28.3	Very low	31.5	Very low	139 Å²	139	123.6 Å²	123.6	85%	0.853	80%	0.796	S	S	*	*				47.6	110.8	92.5	38	0	0	0	0	116.2
254	S	30.2	Very low	31.4	Very low	116 Å²	116	125.8 Å²	125.8	81%	0.811	79%	0.792	S	S	*	*			trans	-79.8	157.7	164.8	37.1	0	0	0	0	111.8
255	P	37.6	Very low	31.2	Very low	120 Å²	120	133 Å²	133	78%	0.779	80%	0.798	S	S	*	*				-155	-159.8	103.6	38	-15.8	0	0	0	113.2
256	P	38.6	Very low	30.7	Very low	118 Å²	118	134.9 Å²	134.9	77%	0.766	80%	0.801	S	S	*	*				-123.3	-179.3	-71	37.8	-21.2	0	0	0	114
257	S	27.8	Very low	30.8	Very low	109 Å²	109	135.5 Å²	135.5	76%	0.762	80%	0.804	S	S	*	*			trans	-58.2	145.8	177.9	49.8	0	0	0	0	117.7
258	S	28.3	Very low	30.6	Very low	103 Å²	103	140.2 Å²	140.2	72%	0.72	81%	0.814	S	S	*	*				172.4	146.6	111.2	59.7	0	0	0	0	115.8
259	L	29.1	Very low	30.5	Very low	174 Å²	174	140.3 Å²	140.3	91%	0.911	82%	0.815	S	S	*	*			trans	71.5	121.7	149	-74.8	144.8	0	0	0	122.3
260	G	27.2	Very low	30.7	Very low	80 Å²	80	139.7 Å²	139.7	83%	0.825	81%	0.811	S	S	*	*			trans	124.9	87.6	141.1	0	0	0	0	0	118.2
261	S	28.1	Very low	30.7	Very low	119 Å²	119	138 Å²	138	83%	0.832	81%	0.81	S	S	*	*			trans	-79.6	171.7	153	-58.5	0	0	0	0	109.3
262	P	41.1	Very low	30.6	Very low	131 Å²	131	141.7 Å²	141.7	85%	0.851	82%	0.817	S	S	*	*			cis	-143.1	170.9	12.3	39	-18.8	0	0	0	116.6
263	G	26.2	Very low	30.6	Very low	71 Å²	71	144.9 Å²	144.9	73%	0.732	82%	0.822	S	S	*	*			trans	137.9	114.8	143.4	0	0	0	0	0	119.5
264	R	28.3	Very low	30.8	Very low	223 Å²	223	148.2 Å²	148.2	84%	0.842	83%	0.825	S	S	*	*			trans	73.4	120.5	140.3	-70.8	-175.5	-178.8	-161.3	1.6	122.2
265	R	27.1	Very low	30.8	Very low	220 Å²	220	151.4 Å²	151.4	83%	0.83	83%	0.827	S	S	*	*				70.9	109.2	129.1	-69.3	-171.3	-176.1	-159.4	1.2	120.3
266	L	30.5	Very low	30.5	Very low	165 Å²	165	157.2 Å²	157.2	86%	0.864	83%	0.833	S	S	*	*				1.8	128.8	129.6	-148	85.5	0	0	0	117.5
267	Q	27.6	Very low	30	Very low	192 Å²	192	161.7 Å²	161.7	90%	0.897	84%	0.841	S	S	*	*			trans	-156.8	131.1	140.3	-110.6	174.7	20.5	0	0	113
268	K	29.4	Very low	30.1	Very low	195 Å²	195	162 Å²	162	85%	0.848	84%	0.843	S	S	*	*			trans	-79.3	155.6	161.4	-79.8	173.8	168.2	177.6	0	109.8
269	S	28.1	Very low	30.1	Very low	111 Å²	111	163.2 Å²	163.2	78%	0.776	85%	0.851	S	S	*	*			trans	175.8	169.7	141.2	45.6	0	0	0	0	109.8
270	P	36.6	Very low	30.3	Very low	118 Å²	118	160.5 Å²	160.5	77%	0.766	85%	0.847	S	S	*	*			cis	-130.7	162.7	-17.6	17.3	6.8	0	0	0	114.4
271	L	31	Very low	30.6	Very low	164 Å²	164	161.6 Å²	161.6	86%	0.859	84%	0.842	S	S	*	*			trans	-83.8	146.2	158.2	-78.7	151.4	0	0	0	109.2
272	E	30.6	Very low	31.2	Very low	197 Å²	197	163.2 Å²	163.2	92%	0.921	84%	0.842	S	S	*	*			trans	-122.1	142.4	157.3	-81.1	-160.1	133.8	0	0	112.1
273	H	30.3	Very low	31.2	Very low	177 Å²	177	164.5 Å²	164.5	82%	0.819	84%	0.841	S	S	*	*			trans	-82.5	152.2	-170	-98.5	-125.1	0	0	0	113.5
274	K	32.9	Very low	31.8	Very low	210 Å²	210	170.7 Å²	170.7	91%	0.913	85%	0.848	S	S	*	*			trans	-153.8	146.5	133.7	-130	173	-179.1	175.1	0	112.9
275	E	30.9	Very low	32.4	Very low	183 Å²	183	169.2 Å²	169.2	86%	0.855	85%	0.848	S	S	*	*			trans	-83.1	169	-153.5	-67	175.5	113.4	0	0	117.5
276	R	30.8	Very low	32.9	Very low	241 Å²	241	167.3 Å²	167.3	91%	0.909	85%	0.845	S	S	*	*			trans	-56.7	151.2	-179	-72.4	168.1	162.9	153.1	-5.9	116.2
277	K	29	Very low	33.2	Very low	212 Å²	212	165.7 Å²	165.7	92%	0.922	84%	0.842	S	S	*	*				-160.2	146.9	121.5	-106.2	171.8	-173.2	-179.9	0	111.8
278	S	28.8	Very low	33.7	Very low	117 Å²	117	164.4 Å²	164.4	82%	0.818	84%	0.836	S	S	*	*			trans	-94.6	139.7	-169.1	49.4	0	0	0	0	113.4
279	S	29.4	Very low	34.2	Very low	127 Å²	127	166.5 Å²	166.5	89%	0.888	84%	0.838	S	S	*	*			trans	-153.7	136.3	150.1	57.4	0	0	0	0	111.3
280	S	33.1	Very low	34.8	Very low	118 Å²	118	164.7 Å²	164.7	83%	0.825	84%	0.837	S	S	*	*			trans	-73.4	139.8	-172.7	120.2	0	0	0	0	113.4
281	S	33.9	Very low	35	Very low	103 Å²	103	161.9 Å²	161.9	72%	0.72	83%	0.83	S	S	*	*			trans	178.8	126.3	130.4	53.6	0	0	0	0	111.5
282	D	40.8	Very low	35.7	Very low	153 Å²	153	165 Å²	165	82%	0.818	83%	0.831	S	S	*	*			trans	24	111.5	150.8	-64.2	-49.4	0	0	0	121.1
283	D	39.5	Very low	36.5	Very low	158 Å²	158	163.9 Å²	163.9	85%	0.845	82%	0.819	S	S	*	*				-172.3	99.1	121.1	-108.4	-35.9	0	0	0	110.6	K285	D283-K285 PolarHBondContact O-N 3.2Å
284	K	38.5	Very low	37.6	Very low	201 Å²	201	159.6 Å²	159.6	87%	0.874	80%	0.802	S	S	*	*			trans	-74.2	76.2	171.5	-80.6	179.7	178.3	165.9	0	110	K286	K284-K286 PolarHBondContact O-N 3.36Å
285	K	41.8	Very low	38.8	Very low	191 Å²	191	152 Å²	152	83%	0.83	78%	0.776	S	S	*	*			trans	-68.2	88.7	151.3	-92.6	178.1	179.6	168.2	0	107.9	D283 V287	D283-K285 PolarHBondContact O-N 3.2Å; K285-V287 VanDerWaalsContact C-N 3.26Å; K285-V287 PolarHBondContact O-N 3.01Å
286	K	37.5	Very low	40	Very low	180 Å²	180	143.7 Å²	143.7	78%	0.783	74%	0.738	S	S	*	*			trans	-56.5	94.8	161.8	-87.3	-178.9	174.7	176.6	0	107.4	K284 H288	K284-K286 PolarHBondContact O-N 3.36Å; K286-H288 VanDerWaalsContact C-N 3.28Å; K286-H288 PolarHBondContact O-N 3.07Å
287	V	37.3	Very low	41.3	Very low	131 Å²	131	139.3 Å²	139.3	79%	0.794	72%	0.722	S	S	*	*			trans	-56.8	102.8	156.4	177.2	0	0	0	0	105	K285 R289	K285-V287 VanDerWaalsContact C-N 3.26Å; K285-V287 PolarHBondContact O-N 3.01Å; V287-R289 PolarHBondContact O-N 3.27Å
288	H	37.6	Very low	43.2	Very low	166 Å²	166	137 Å²	137	77%	0.769	71%	0.709	S	S	*	*			trans	-52.3	110.7	167.4	-105.8	52.8	0	0	0	105.8	K286 G290	K286-H288 VanDerWaalsContact C-N 3.28Å; K286-H288 PolarHBondContact O-N 3.07Å; H288-G290 PolarHBondContact O-N 3.04Å
289	R	40.6	Very low	45.8	Very low	239 Å²	239	134.9 Å²	134.9	90%	0.902	68%	0.683	S	S	*	*			trans	-56.3	101.8	160.8	-74.4	-173.3	-168.3	-152.3	2.9	104.6	V287 G291	V287-R289 PolarHBondContact O-N 3.27Å; R289-G291 PolarHBondContact O-N 3.08Å
290	G	40.2	Very low	48.8	Very low	72 Å²	72	131.8 Å²	131.8	74%	0.742	65%	0.654	S	S	*	*			trans	-52.6	113.2	174.4	0	0	0	0	0	106.5	H288 Y292	H288-G290 PolarHBondContact O-N 3.04Å; G290-Y292 PolarHBondContact O-N 3.29Å
291	G	41	Very low	51.7	Low	60 Å²	60	126.6 Å²	126.6	62%	0.619	62%	0.618	S	S	*	*			trans	-49	140.9	172.8	0	0	0	0	0	108.3	R289 R293	R289-G291 PolarHBondContact O-N 3.08Å; G291-R293 VanDerWaalsContact C-N 3.3Å; G291-R293 PolarHBondContact O-N 3.4Å
292	Y	45.4	Very low	54.4	Low	228 Å²	228	124.1 Å²	124.1	89%	0.894	60%	0.599	S	S	*	*			trans	-49.6	96.6	174.7	-172.1	-96.2	0	0	0	108.7	G290 D294	G290-Y292 PolarHBondContact O-N 3.29Å; Y292-D294 PolarHBondContact O-N 3.04Å
293	R	46.7	Very low	56.9	Low	174 Å²	174	122.4 Å²	122.4	66%	0.657	58%	0.582	S	S	*	*			trans	-72.4	111.9	-178.8	-79.4	-174.5	174.5	-171.3	-2	106.4	G291 S295	G291-R293 VanDerWaalsContact C-N 3.3Å; G291-R293 PolarHBondContact O-N 3.4Å; R293-S295 PolarHBondContact O-N 3.03Å
294	D	54.1	Low	59.5	Low	88 Å²	88	125.2 Å²	125.2	47%	0.471	58%	0.581	S	S	.	*			trans	-55.1	132.1	173.6	-179.8	12.4	0	0	0	109.5	Y292 S296 Y297	Y292-D294 PolarHBondContact O-N 3.04Å; D294-S296 PolarHBondContact O-N 2.96Å; D294-S296 PolarHBondContact OD1-N 2.97Å; D294-S296 WeakPolarHBondContact OD2-CB 3.29Å; D294-S296 PolarHBondContact OD2-OG 3.36Å; D294-Y297 WeakPolarHBondContact O-CB 3.47Å; D294-Y297 PolarHBondContact O-N 2.83Å
295	S	58	Low	62.1	Low	51 Å²	51	120.1 Å²	120.1	36%	0.357	56%	0.56	S	S	.	*	G	3₁₀ helix	trans	-57.5	-14.9	179	67.4	0	0	0	0	113.6	R293 Y297 R355	R293-S295 PolarHBondContact O-N 3.03Å; S295-Y297 VanDerWaalsContact C-N 3.29Å; S295-Y297 PolarHBondContact O-N 3.16Å; S295-R355 PolarHBondContact OG-NH2 2.81Å
296	S	56	Low	64.6	Low	8 Å²	8	111.5 Å²	111.5	6%	0.056	52%	0.523	C	S	.	.	G	3₁₀ helix	trans	-63.4	-29.1	171.7	68.6	0	0	0	0	113.8	D294 Y298 W299	D294-S296 PolarHBondContact O-N 2.96Å; D294-S296 PolarHBondContact OD1-N 2.97Å; D294-S296 WeakPolarHBondContact OD2-CB 3.29Å; D294-S296 PolarHBondContact OD2-OG 3.36Å; S296-Y298 PolarHBondContact O-N 3.33Å; S296-W299 PolarHBondContact O-N 3Å
297	Y	57.3	Low	67.4	Low	149 Å²	149	107 Å²	107	58%	0.584	51%	0.511	S	S	*	.	G	3₁₀ helix	trans	-62.7	-27.6	-178.1	-175.2	-99.3	0	0	0	113.4	D294 S295 W299	D294-Y297 WeakPolarHBondContact O-CB 3.47Å; D294-Y297 PolarHBondContact O-N 2.83Å; S295-Y297 VanDerWaalsContact C-N 3.29Å; S295-Y297 PolarHBondContact O-N 3.16Å; Y297-W299 VanDerWaalsContact C-N 3.32Å; Y297-W299 PolarHBondContact O-N 3.3Å
298	Y	69.2	Low	70.1	Confident	164 Å²	164	103.4 Å²	103.4	64%	0.643	49%	0.487	S	S	*	.	G	3₁₀ helix	trans	-78	-12.4	-176.5	-74.8	-83.6	0	0	0	114.6	S296	S296-Y298 PolarHBondContact O-N 3.33Å
299	W	84.9	Confident	72.9	Confident	72 Å²	72	99.8 Å²	99.8	27%	0.273	47%	0.47	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.8	-4.7	-174.6	-59.8	93.4	0	0	0	113.3	S296 Y297 R355 G367 F368	S296-W299 PolarHBondContact O-N 3Å; Y297-W299 VanDerWaalsContact C-N 3.32Å; Y297-W299 PolarHBondContact O-N 3.3Å; W299-R355 HydrophobicContact CD2-CB 4.38Å; W299-G367 WeakPolarHBondContact O-CA 3.48Å; W299-F368 HydrophobicContact CB-CD1 4.28Å; W299-F368 HydrophobicContact CB-CE1 3.95Å; W299-F368 WeakPolarHBondContact O-CD1 3.34Å; W299-F368 PolarHBondContact O-N 2.77Å
300	E	92	Very high	75.4	Confident	62 Å²	62	96 Å²	96	29%	0.29	46%	0.461	S	S	.	.	B	Isolated β-bridge	trans	-83.8	112.9	172	-173	169.1	177.9	0	0	109	F368 T370	E300-F368 CarbonylContact C-O 3.56Å; E300-F368 WeakPolarHBondContact CA-O 3.35Å; E300-F368 HydrophobicContact CB-CD2 4.48Å; E300-F368 HydrophobicContact CB-CE1 4.44Å; E300-F368 HydrophobicContact CB-CE2 3.8Å; E300-F368 HydrophobicContact CB-CZ 3.78Å; E300-F368 HydrophobicContact CG-CD2 4.37Å; E300-F368 HydrophobicContact CG-CE2 3.85Å; E300-F368 HydrophobicContact CG-CZ 4.35Å; E300-T370 HydrophobicContact CG-CG2 4.45Å; E300-T370 WeakPolarHBondContact OE1-CB 3.4Å; E300-T370 VanDerWaalsContact OE1-CG2 3.28Å; E300-T370 WeakPolarHBondContact OE1-CG2 3.47Å; E300-T370 PolarHBondContact OE1-OG1 3.24Å
301	V	92.7	Very high	78	Confident	9 Å²	9	99.9 Å²	99.9	6%	0.055	45%	0.453	C	S	.	.			trans	-92.4	124	-176.2	-177.4	0	0	0	0	109.5	Y303 E305 V306 W325 F368 M369 I377	V301-Y303 PolarHBondContact O-N 3.42Å; V301-E305 HydrophobicContact CG1-CB 4.42Å; V301-V306 HydrophobicContact CG1-CG2 3.5Å; V301-W325 HydrophobicContact CB-CZ2 4.46Å; V301-W325 HydrophobicContact CG1-CD2 4.35Å; V301-W325 HydrophobicContact CG1-CG 4.44Å; V301-W325 HydrophobicContact CG1-CZ2 4.06Å; V301-W325 VanDerWaalsContact CG1-NE1 3.32Å; V301-W325 HydrophobicContact CG2-CH2 3.94Å; V301-W325 HydrophobicContact CG2-CZ2 3.52Å; V301-F368 PolarHBondContact N-O 3.39Å; V301-M369 HydrophobicContact CB-CG 4.39Å; V301-M369 WeakPolarHBondContact O-CG 3.19Å; V301-I377 HydrophobicContact CB-CD1 3.85Å; V301-I377 HydrophobicContact CG1-CD1 4.07Å; V301-I377 HydrophobicContact CG2-CD1 3.94Å
302	P	92.4	Very high	80.4	Confident	50 Å²	50	101.2 Å²	101.2	33%	0.325	45%	0.445	S	S	.	.			trans	-63.4	132.5	173.1	-23.9	36	0	0	0	111.4	R304 E305	P302-R304 HydrophobicContact CB-CG 3.98Å; P302-R304 PolarHBondContact O-N 2.78Å; P302-E305 HydrophobicContact CB-CG 4.38Å; P302-E305 WeakPolarHBondContact CG-OE1 3.37Å; P302-E305 WeakPolarHBondContact O-CB 3.35Å; P302-E305 PolarHBondContact O-N 3.19Å
303	Y	92.1	Very high	82.3	Confident	117 Å²	117	91.9 Å²	91.9	46%	0.459	42%	0.418	S	S	.	.	G	3₁₀ helix	trans	-50.5	-36.6	179.6	175.8	-108.2	0	0	0	114	V301 E305 V306 L308 M369 P372	V301-Y303 PolarHBondContact O-N 3.42Å; Y303-E305 PolarHBondContact O-N 2.86Å; Y303-E305 VanDerWaalsContact O-N 3.17Å; Y303-V306 PolarHBondContact O-N 2.76Å; Y303-L308 HydrophobicContact CE2-CD1 3.97Å; Y303-M369 HydrophobicContact CD2-CE 3.79Å; Y303-M369 HydrophobicContact CD2-SD 4.41Å; Y303-P372 HydrophobicContact CD2-CG 4.36Å; Y303-P372 HydrophobicContact CE2-CG 4.48Å; Y303-P372 HydrophobicContact CG-CG 4.48Å
304	R	93.4	Very high	84.1	Confident	218 Å²	218	86.6 Å²	86.6	82%	0.823	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	-61.9	-19.5	179.3	65.1	-177.3	178.1	-169.7	-0.4	114.8	P302	P302-R304 HydrophobicContact CB-CG 3.98Å; P302-R304 PolarHBondContact O-N 2.78Å
305	E	93.3	Very high	85	Confident	93 Å²	93	84.3 Å²	84.3	44%	0.435	40%	0.403	S	S	.	.	G	3₁₀ helix	trans	-87.8	-11.8	178.6	-65.4	174	-155.8	0	0	112.1	V301 P302 Y303	V301-E305 HydrophobicContact CG1-CB 4.42Å; P302-E305 HydrophobicContact CB-CG 4.38Å; P302-E305 WeakPolarHBondContact CG-OE1 3.37Å; P302-E305 WeakPolarHBondContact O-CB 3.35Å; P302-E305 PolarHBondContact O-N 3.19Å; Y303-E305 PolarHBondContact O-N 2.86Å; Y303-E305 VanDerWaalsContact O-N 3.17Å
306	V	94.9	Very high	85.6	Confident	10 Å²	10	85.1 Å²	85.1	6%	0.061	41%	0.408	C	S	.	.			trans	-111.3	126.5	-171.6	-176.8	0	0	0	0	109.8	V301 Y303 W325 I331 M369 I377	V301-V306 HydrophobicContact CG1-CG2 3.5Å; Y303-V306 PolarHBondContact O-N 2.76Å; V306-W325 HydrophobicContact CG2-CB 4.25Å; V306-W325 HydrophobicContact CG2-CG 4.11Å; V306-I331 HydrophobicContact CG1-CD1 3.21Å; V306-I331 HydrophobicContact CG1-CG1 4.12Å; V306-M369 HydrophobicContact CB-SD 4.34Å; V306-M369 HydrophobicContact CG2-SD 4.03Å; V306-I377 HydrophobicContact CG2-CD1 3.96Å
307	T	96.1	Very high	86.3	Confident	86 Å²	86	86 Å²	86	53%	0.528	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	114	172.6	-54.3	0	0	0	0	109.9	G323 K324	T307-G323 CarbonylContact O-C 3.59Å; T307-G323 WeakPolarHBondContact O-CA 3.28Å; T307-K324 PolarHBondContact N-O 3.09Å; T307-K324 PolarHBondContact O-N 3.33Å
308	L	95	Very high	87.6	Confident	56 Å²	56	79 Å²	79	29%	0.293	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	133.2	171.2	-75	162	0	0	0	110	Y303 F321 I331 I333	Y303-L308 HydrophobicContact CE2-CD1 3.97Å; L308-F321 HydrophobicContact CD2-CB 3.62Å; L308-F321 HydrophobicContact CD2-CD1 4.43Å; L308-F321 HydrophobicContact CD2-CD2 4.14Å; L308-F321 HydrophobicContact CD2-CG 3.83Å; L308-I331 HydrophobicContact CD2-CB 4.05Å; L308-I331 HydrophobicContact CD2-CD1 3.67Å; L308-I331 HydrophobicContact CD2-CG2 3.96Å; L308-I331 HydrophobicContact CG-CD1 4.32Å; L308-I333 HydrophobicContact CD1-CD1 4.08Å; L308-I333 HydrophobicContact CD2-CD1 4.25Å
309	Q	94.9	Very high	88.5	Confident	89 Å²	89	72.3 Å²	72.3	42%	0.416	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	-134.2	177.3	-58.2	-178.3	-32.5	0	0	109.8	R311 K322	Q309-R311 PolarHBondContact O-N 2.8Å; Q309-K322 CarbonylContact C-O 3.53Å; Q309-K322 WeakPolarHBondContact CA-O 3.28Å; Q309-K322 WeakPolarHBondContact CB-O 2.91Å; Q309-K322 PolarHBondContact N-O 3.37Å
310	K	94.2	Very high	88.9	Confident	161 Å²	161	70.8 Å²	70.8	70%	0.7	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.2	131.3	-175.5	-175.9	177.5	178.5	179.8	0	111.9	I312 F321 K322	K310-I312 HydrophobicContact CG-CD1 4.39Å; K310-I312 PolarHBondContact O-N 2.84Å; K310-F321 WeakPolarHBondContact O-CA 3.25Å; K310-K322 PolarHBondContact O-N 3.03Å
311	R	95.3	Very high	89	Confident	153 Å²	153	69.8 Å²	69.8	58%	0.577	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.6	124.5	165.8	-177.6	176.8	170.2	-164.8	-4.2	109.6	Q309 T314 T319 F321	Q309-R311 PolarHBondContact O-N 2.8Å; R311-T314 PolarHBondContact NE-OG1 3Å; R311-T314 PolarHBondContact NH2-OG1 3.09Å; R311-T319 HydrophobicContact CG-CG2 3.79Å; R311-F321 HydrophobicContact CB-CD1 3.81Å; R311-F321 HydrophobicContact CB-CE1 3.7Å; R311-F321 HydrophobicContact CG-CD1 4.32Å; R311-F321 HydrophobicContact CG-CE1 3.98Å; R311-F321 HydrophobicContact CG-CZ 4.35Å
312	I	90.8	Very high	89.2	Confident	88 Å²	88	71.4 Å²	71.4	45%	0.451	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	-45	-178.6	-55.9	-54.5	0	0	0	110.8	K310 V320 K322 W380	K310-I312 HydrophobicContact CG-CD1 4.39Å; K310-I312 PolarHBondContact O-N 2.84Å; I312-V320 HydrophobicContact CB-CG1 4.47Å; I312-V320 PolarHBondContact N-O 3.18Å; I312-K322 HydrophobicContact CD1-CB 4.11Å; I312-K322 HydrophobicContact CG1-CB 4.34Å; I312-W380 HydrophobicContact CD1-CH2 3.76Å; I312-W380 HydrophobicContact CD1-CZ3 4.24Å; I312-W380 HydrophobicContact CG1-CH2 3.95Å; I312-W380 HydrophobicContact CG1-CZ3 3.98Å
313	G	85.6	Confident	89.3	Confident	32 Å²	32	69 Å²	69	33%	0.33	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-179.3	167.7	-179.7	0	0	0	0	0	113	T319 V320	G313-T319 CarbonylContact O-C 3.41Å; G313-T319 WeakPolarHBondContact O-CA 3.4Å; G313-T319 WeakPolarHBondContact O-CG2 3.39Å; G313-V320 PolarHBondContact N-O 3.21Å; G313-V320 PolarHBondContact O-N 3.5Å
314	T	83.9	Confident	89.5	Confident	62 Å²	62	67.3 Å²	67.3	38%	0.38	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	121.7	175.8	-65.5	0	0	0	0	109.2	R311 T319 K335	R311-T314 PolarHBondContact NE-OG1 3Å; R311-T314 PolarHBondContact NH2-OG1 3.09Å; T314-T319 WeakPolarHBondContact CG2-OG1 3.44Å; T314-T319 VanDerWaalsContact OG1-CG2 3.3Å; T314-T319 WeakPolarHBondContact OG1-CG2 3.17Å; T314-T319 PolarHBondContact OG1-OG1 2.92Å; T314-K335 VanDerWaalsContact CG2-NZ 3.32Å
315	G	74.1	Confident	89.6	Confident	41 Å²	41	59.2 Å²	59.2	42%	0.423	31%	0.308	S	S	.	.			trans	-104.4	-169.6	174.7	0	0	0	0	0	112.5	G318 K335	G315-G318 PolarHBondContact N-O 3.43Å; G315-K335 WeakPolarHBondContact O-CE 3.44Å; G315-K335 PolarHBondContact O-NZ 3.1Å
316	S	70	Confident	89.6	Confident	68 Å²	68	63.1 Å²	63.1	48%	0.476	33%	0.326	S	S	.	.	S	Bend	trans	-61.7	-42.5	174.3	49.7	0	0	0	0	112
317	F	70.6	Confident	89.6	Confident	27 Å²	27	64.5 Å²	64.5	12%	0.118	34%	0.343	C	S	.	.	S	Bend	trans	-85.1	-18.2	-173.3	-59.1	-79.7	0	0	0	115	L334 K335 L446 K450	F317-L334 WeakPolarHBondContact O-CD2 3.47Å; F317-K335 PolarHBondContact O-N 2.79Å; F317-L446 HydrophobicContact CD1-CB 4.33Å; F317-K450 HydrophobicContact CD1-CB 4.15Å; F317-K450 HydrophobicContact CD1-CD 4.3Å; F317-K450 HydrophobicContact CE1-CB 3.74Å; F317-K450 HydrophobicContact CE1-CD 3.69Å; F317-K450 HydrophobicContact CE1-CG 4.2Å; F317-K450 HydrophobicContact CZ-CD 4.42Å
318	G	83.6	Confident	89.6	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	171	178.5	-166.8	0	0	0	0	0	114.1	G315 I333	G315-G318 PolarHBondContact N-O 3.43Å; G318-I333 CarbonylContact C-O 3.52Å; G318-I333 WeakPolarHBondContact CA-O 3.44Å
319	T	89.9	Confident	89.7	Confident	24 Å²	24	60.2 Å²	60.2	15%	0.147	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	129.1	169.6	-59.4	0	0	0	0	109.1	R311 G313 T314 F321 K332 I333	R311-T319 HydrophobicContact CG-CG2 3.79Å; G313-T319 CarbonylContact O-C 3.41Å; G313-T319 WeakPolarHBondContact O-CA 3.4Å; G313-T319 WeakPolarHBondContact O-CG2 3.39Å; T314-T319 WeakPolarHBondContact CG2-OG1 3.44Å; T314-T319 VanDerWaalsContact OG1-CG2 3.3Å; T314-T319 WeakPolarHBondContact OG1-CG2 3.17Å; T314-T319 PolarHBondContact OG1-OG1 2.92Å; T319-F321 HydrophobicContact CG2-CD2 4.12Å; T319-F321 HydrophobicContact CG2-CE1 4.45Å; T319-F321 HydrophobicContact CG2-CE2 3.38Å; T319-F321 HydrophobicContact CG2-CZ 3.59Å; T319-K332 CarbonylContact O-C 3.59Å; T319-K332 WeakPolarHBondContact O-CA 3.33Å; T319-I333 PolarHBondContact N-O 3.04Å; T319-I333 PolarHBondContact O-N 3.29Å
320	V	92	Very high	89.7	Confident	40 Å²	40	56.7 Å²	56.7	24%	0.242	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	132.3	179.8	-176.5	0	0	0	0	109.5	I312 G313 A330 I331 K332	I312-V320 HydrophobicContact CB-CG1 4.47Å; I312-V320 PolarHBondContact N-O 3.18Å; G313-V320 PolarHBondContact N-O 3.21Å; G313-V320 PolarHBondContact O-N 3.5Å; V320-A330 HydrophobicContact CG1-CB 4.44Å; V320-I331 CarbonylContact C-O 3.5Å; V320-I331 WeakPolarHBondContact CA-O 3.24Å; V320-K332 HydrophobicContact CG2-CB 4.16Å; V320-K332 HydrophobicContact CG2-CD 4.26Å; V320-K332 HydrophobicContact CG2-CG 3.9Å
321	F	94.5	Very high	89.7	Confident	42 Å²	42	49 Å²	49	18%	0.184	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	144.7	174.6	-61.5	-98.9	0	0	0	109.1	L308 K310 R311 T319 I331 I333	L308-F321 HydrophobicContact CD2-CB 3.62Å; L308-F321 HydrophobicContact CD2-CD1 4.43Å; L308-F321 HydrophobicContact CD2-CD2 4.14Å; L308-F321 HydrophobicContact CD2-CG 3.83Å; K310-F321 WeakPolarHBondContact O-CA 3.25Å; R311-F321 HydrophobicContact CB-CD1 3.81Å; R311-F321 HydrophobicContact CB-CE1 3.7Å; R311-F321 HydrophobicContact CG-CD1 4.32Å; R311-F321 HydrophobicContact CG-CE1 3.98Å; R311-F321 HydrophobicContact CG-CZ 4.35Å; T319-F321 HydrophobicContact CG2-CD2 4.12Å; T319-F321 HydrophobicContact CG2-CE1 4.45Å; T319-F321 HydrophobicContact CG2-CE2 3.38Å; T319-F321 HydrophobicContact CG2-CZ 3.59Å; F321-I331 PolarHBondContact N-O 3.4Å; F321-I331 PolarHBondContact O-N 2.76Å; F321-I333 HydrophobicContact CD2-CD1 3.89Å; F321-I333 HydrophobicContact CD2-CG1 4.04Å; F321-I333 HydrophobicContact CE2-CB 4.32Å; F321-I333 HydrophobicContact CE2-CD1 3.62Å; F321-I333 HydrophobicContact CE2-CG1 4.01Å; F321-I333 HydrophobicContact CZ-CD1 4.42Å
322	K	95.8	Very high	89.6	Confident	42 Å²	42	42.6 Å²	42.6	18%	0.183	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	143.7	158	-174.9	168.7	-176.7	162.6	0	107.5	Q309 K310 I312 D328 W380 E382	Q309-K322 CarbonylContact C-O 3.53Å; Q309-K322 WeakPolarHBondContact CA-O 3.28Å; Q309-K322 WeakPolarHBondContact CB-O 2.91Å; Q309-K322 PolarHBondContact N-O 3.37Å; K310-K322 PolarHBondContact O-N 3.03Å; I312-K322 HydrophobicContact CD1-CB 4.11Å; I312-K322 HydrophobicContact CG1-CB 4.34Å; K322-D328 WeakPolarHBondContact CE-OD1 3.15Å; K322-D328 IonicContact NZ-OD1 3.17Å; K322-W380 HydrophobicContact CB-CE3 4.17Å; K322-W380 HydrophobicContact CB-CH2 4.03Å; K322-W380 HydrophobicContact CB-CZ3 3.72Å; K322-W380 HydrophobicContact CD-CD2 4.19Å; K322-W380 HydrophobicContact CD-CE3 4.31Å; K322-W380 HydrophobicContact CD-CH2 3.99Å; K322-W380 HydrophobicContact CD-CZ2 3.82Å; K322-W380 HydrophobicContact CD-CZ3 4.22Å; K322-W380 HydrophobicContact CG-CD2 4.21Å; K322-W380 HydrophobicContact CG-CE3 3.93Å; K322-W380 HydrophobicContact CG-CH2 4.19Å; K322-W380 HydrophobicContact CG-CZ2 4.43Å; K322-W380 HydrophobicContact CG-CZ3 3.93Å; K322-E382 IonicContact NZ-OE1 2.71Å
323	G	96	Very high	89.6	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	179.8	174.3	0	0	0	0	0	113.2	T307 V329	T307-G323 CarbonylContact O-C 3.59Å; T307-G323 WeakPolarHBondContact O-CA 3.28Å; G323-V329 PolarHBondContact N-O 3.2Å; G323-V329 WeakPolarHBondContact O-CG2 3.44Å; G323-V329 PolarHBondContact O-N 3.21Å
324	K	96.6	Very high	89.7	Confident	82 Å²	82	38.6 Å²	38.6	36%	0.357	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	125.9	176.9	-67.2	-69.9	-167.4	-179.8	0	110.7	T307 G327 D328	T307-K324 PolarHBondContact N-O 3.09Å; T307-K324 PolarHBondContact O-N 3.33Å; K324-G327 VanDerWaalsContact CA-O 3.29Å; K324-G327 WeakPolarHBondContact CA-O 3.19Å; K324-D328 WeakPolarHBondContact CD-OD1 3.23Å; K324-D328 WeakPolarHBondContact CE-OD1 3.34Å; K324-D328 IonicContact NZ-OD1 3.61Å; K324-D328 PolarHBondContact NZ-OD1 3.23Å; K324-D328 IonicContact NZ-OD2 2.77Å; K324-D328 PolarHBondContact NZ-OD2 3.07Å
325	W	95.1	Very high	89.5	Confident	47 Å²	47	41.5 Å²	41.5	18%	0.178	23%	0.225	C	C	.	.	S	Bend	trans	-159.1	105	170.2	-178	72	0	0	0	108.2	V301 V306 G327 V329 M366 I377	V301-W325 HydrophobicContact CB-CZ2 4.46Å; V301-W325 HydrophobicContact CG1-CD2 4.35Å; V301-W325 HydrophobicContact CG1-CG 4.44Å; V301-W325 HydrophobicContact CG1-CZ2 4.06Å; V301-W325 VanDerWaalsContact CG1-NE1 3.32Å; V301-W325 HydrophobicContact CG2-CH2 3.94Å; V301-W325 HydrophobicContact CG2-CZ2 3.52Å; V306-W325 HydrophobicContact CG2-CB 4.25Å; V306-W325 HydrophobicContact CG2-CG 4.11Å; W325-G327 PolarHBondContact N-O 2.85Å; W325-G327 PolarHBondContact O-N 3.11Å; W325-G327 VanDerWaalsContact O-N 3.07Å; W325-V329 HydrophobicContact CB-CG1 4.29Å; W325-V329 HydrophobicContact CB-CG2 4.04Å; W325-M366 HydrophobicContact CE3-CB 4.5Å; W325-M366 HydrophobicContact CZ3-CB 3.96Å; W325-I377 HydrophobicContact CE3-CG2 4.4Å
326	H	93.9	Very high	89.5	Confident	175 Å²	175	41 Å²	41	81%	0.81	21%	0.214	S	C	*	.	S	Bend	trans	50.4	27.6	-169.6	-58	-62.8	0	0	0	115
327	G	94.4	Very high	89.2	Confident	40 Å²	40	47.3 Å²	47.3	41%	0.412	23%	0.233	S	C	.	.	S	Bend	trans	137	-174.2	-171.4	0	0	0	0	0	111.5	K324 W325	K324-G327 VanDerWaalsContact CA-O 3.29Å; K324-G327 WeakPolarHBondContact CA-O 3.19Å; W325-G327 PolarHBondContact N-O 2.85Å; W325-G327 PolarHBondContact O-N 3.11Å; W325-G327 VanDerWaalsContact O-N 3.07Å
328	D	96	Very high	89.3	Confident	51 Å²	51	54.5 Å²	54.5	27%	0.273	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	130	171.9	-76.2	-59.1	0	0	0	111.2	K322 K324 W380	K322-D328 WeakPolarHBondContact CE-OD1 3.15Å; K322-D328 IonicContact NZ-OD1 3.17Å; K324-D328 WeakPolarHBondContact CD-OD1 3.23Å; K324-D328 WeakPolarHBondContact CE-OD1 3.34Å; K324-D328 IonicContact NZ-OD1 3.61Å; K324-D328 PolarHBondContact NZ-OD1 3.23Å; K324-D328 IonicContact NZ-OD2 2.77Å; K324-D328 PolarHBondContact NZ-OD2 3.07Å; D328-W380 HydrophobicContact CB-CB 3.78Å; D328-W380 HydrophobicContact CB-CG 4Å; D328-W380 WeakPolarHBondContact O-CB 3.49Å; D328-W380 PolarHBondContact O-N 3.37Å
329	V	96	Very high	88.8	Confident	1 Å²	1	56.8 Å²	56.8	1%	0.006	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	155.2	-179.9	-62.9	0	0	0	0	111.6	G323 W325 I331 M366 I377	G323-V329 PolarHBondContact N-O 3.2Å; G323-V329 WeakPolarHBondContact O-CG2 3.44Å; G323-V329 PolarHBondContact O-N 3.21Å; W325-V329 HydrophobicContact CB-CG1 4.29Å; W325-V329 HydrophobicContact CB-CG2 4.04Å; V329-I331 HydrophobicContact CG2-CD1 4.1Å; V329-I331 HydrophobicContact CG2-CG1 3.9Å; V329-M366 HydrophobicContact CG1-SD 3.57Å; V329-M366 VanDerWaalsContact CG1-SD 3.57Å; V329-I377 HydrophobicContact CB-CG2 3.83Å; V329-I377 HydrophobicContact CG1-CG2 4.06Å; V329-I377 HydrophobicContact CG2-CG2 4.04Å
330	A	95	Very high	88.4	Confident	15 Å²	15	58.4 Å²	58.4	12%	0.124	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	125.1	166.2	0	0	0	0	0	109.1	V320 I377 T378 W380	V320-A330 HydrophobicContact CG1-CB 4.44Å; A330-I377 WeakPolarHBondContact O-CA 3.41Å; A330-T378 PolarHBondContact N-O 3.06Å; A330-T378 PolarHBondContact O-N 3.44Å; A330-W380 HydrophobicContact CB-CE3 4.11Å
331	I	94.7	Very high	88	Confident	0 Å²	0	61 Å²	61	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	109.9	-178.7	-56.2	157.3	0	0	0	108.1	V306 L308 V320 F321 V329 I333 A375 I376 I377	V306-I331 HydrophobicContact CG1-CD1 3.21Å; V306-I331 HydrophobicContact CG1-CG1 4.12Å; L308-I331 HydrophobicContact CD2-CB 4.05Å; L308-I331 HydrophobicContact CD2-CD1 3.67Å; L308-I331 HydrophobicContact CD2-CG2 3.96Å; L308-I331 HydrophobicContact CG-CD1 4.32Å; V320-I331 CarbonylContact C-O 3.5Å; V320-I331 WeakPolarHBondContact CA-O 3.24Å; F321-I331 PolarHBondContact N-O 3.4Å; F321-I331 PolarHBondContact O-N 2.76Å; V329-I331 HydrophobicContact CG2-CD1 4.1Å; V329-I331 HydrophobicContact CG2-CG1 3.9Å; I331-I333 HydrophobicContact CG2-CG1 4.28Å; I331-A375 HydrophobicContact CG2-CB 4.07Å; I331-I376 WeakPolarHBondContact CA-O 3.49Å; I331-I377 HydrophobicContact CG1-CG1 4.49Å
332	K	92.6	Very high	87.3	Confident	17 Å²	17	65.3 Å²	65.3	7%	0.074	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	102.4	177.1	-171.9	174.1	-164.3	173	0	109.5	T319 V320 A375 I376 D443 L446	T319-K332 CarbonylContact O-C 3.59Å; T319-K332 WeakPolarHBondContact O-CA 3.33Å; V320-K332 HydrophobicContact CG2-CB 4.16Å; V320-K332 HydrophobicContact CG2-CD 4.26Å; V320-K332 HydrophobicContact CG2-CG 3.9Å; K332-A375 CarbonylContact O-C 3.6Å; K332-A375 WeakPolarHBondContact O-CA 3.36Å; K332-I376 PolarHBondContact N-O 3.19Å; K332-I376 PolarHBondContact O-N 2.96Å; K332-D443 IonicContact NZ-OD1 2.8Å; K332-D443 PolarHBondContact NZ-OD1 3.46Å; K332-D443 IonicContact NZ-OD2 2.79Å; K332-D443 PolarHBondContact NZ-OD2 3.47Å; K332-L446 HydrophobicContact CD-CD1 3.99Å
333	I	91.5	Very high	86.4	Confident	31 Å²	31	65.3 Å²	65.3	16%	0.159	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	120.4	173.6	-56.2	-176.9	0	0	0	108.4	L308 G318 T319 F321 I331 N373 A375	L308-I333 HydrophobicContact CD1-CD1 4.08Å; L308-I333 HydrophobicContact CD2-CD1 4.25Å; G318-I333 CarbonylContact C-O 3.52Å; G318-I333 WeakPolarHBondContact CA-O 3.44Å; T319-I333 PolarHBondContact N-O 3.04Å; T319-I333 PolarHBondContact O-N 3.29Å; F321-I333 HydrophobicContact CD2-CD1 3.89Å; F321-I333 HydrophobicContact CD2-CG1 4.04Å; F321-I333 HydrophobicContact CE2-CB 4.32Å; F321-I333 HydrophobicContact CE2-CD1 3.62Å; F321-I333 HydrophobicContact CE2-CG1 4.01Å; F321-I333 HydrophobicContact CZ-CD1 4.42Å; I331-I333 HydrophobicContact CG2-CG1 4.28Å; I333-N373 HydrophobicContact CG2-CB 3.69Å; I333-A375 HydrophobicContact CG1-CB 4.32Å
334	L	87.1	Confident	85.7	Confident	6 Å²	6	67.8 Å²	67.8	3%	0.031	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	145.1	-175.8	-59.1	163.7	0	0	0	109.9	F317 V336 F347 F374 I376 W453	F317-L334 WeakPolarHBondContact O-CD2 3.47Å; L334-V336 PolarHBondContact O-N 2.9Å; L334-F347 HydrophobicContact CD1-CD2 4.18Å; L334-F347 HydrophobicContact CD1-CE2 3.54Å; L334-F347 HydrophobicContact CD1-CZ 4.1Å; L334-F374 HydrophobicContact CB-CB 4.18Å; L334-F374 WeakPolarHBondContact CB-O 3.39Å; L334-F374 HydrophobicContact CD1-CB 3.76Å; L334-F374 HydrophobicContact CG-CB 4.46Å; L334-F374 PolarHBondContact N-O 3.41Å; L334-I376 HydrophobicContact CD1-CD1 4.25Å; L334-I376 HydrophobicContact CD1-CG1 4.22Å; L334-I376 HydrophobicContact CD2-CD1 4.43Å; L334-W453 HydrophobicContact CB-CH2 4.32Å; L334-W453 HydrophobicContact CD1-CH2 3.54Å; L334-W453 HydrophobicContact CD1-CZ2 4.3Å; L334-W453 HydrophobicContact CD1-CZ3 4.48Å; L334-W453 HydrophobicContact CD2-CH2 4.26Å; L334-W453 HydrophobicContact CD2-CZ3 4.49Å; L334-W453 HydrophobicContact CG-CH2 4.22Å
335	K	80.3	Confident	85.1	Confident	122 Å²	122	68.8 Å²	68.8	53%	0.53	35%	0.349	S	S	.	.	S	Bend	trans	-79.8	55.9	-178.8	-72.5	171.9	175.3	175.6	0	111.8	T314 G315 F317	T314-K335 VanDerWaalsContact CG2-NZ 3.32Å; G315-K335 WeakPolarHBondContact O-CE 3.44Å; G315-K335 PolarHBondContact O-NZ 3.1Å; F317-K335 PolarHBondContact O-N 2.79Å
336	V	73.5	Confident	84.3	Confident	30 Å²	30	67.2 Å²	67.2	18%	0.182	35%	0.346	C	S	.	.			trans	-121.9	112.2	176.2	-173.8	0	0	0	0	107.7	L334 P339 W453	L334-V336 PolarHBondContact O-N 2.9Å; V336-P339 HydrophobicContact CG1-CB 3.81Å; V336-P339 HydrophobicContact CG1-CG 4.35Å; V336-W453 HydrophobicContact CG2-CE3 4.31Å; V336-W453 HydrophobicContact CG2-CH2 4.46Å; V336-W453 HydrophobicContact CG2-CZ3 4.22Å
337	K	63.5	Low	83.8	Confident	202 Å²	202	58.9 Å²	58.9	88%	0.878	31%	0.308	S	S	*	.	S	Bend	trans	-77.8	-39.3	-178.5	-70.8	-177	177.7	-177.3	0	111.4
338	E	72.7	Confident	83.2	Confident	178 Å²	178	59.1 Å²	59.1	83%	0.832	30%	0.298	S	S	*	.	S	Bend	trans	-145.6	94.6	-178.5	-67.9	179.3	-173.2	0	0	110.2
339	P	74.3	Confident	82.5	Confident	48 Å²	48	60.5 Å²	60.5	31%	0.312	31%	0.305	S	S	.	.			trans	-76.1	135	-178.6	25.7	-27.9	0	0	0	111.4	V336 Q343 F374	V336-P339 HydrophobicContact CG1-CB 3.81Å; V336-P339 HydrophobicContact CG1-CG 4.35Å; P339-Q343 HydrophobicContact CB-CB 4.37Å; P339-F374 HydrophobicContact CB-CD2 4.21Å; P339-F374 HydrophobicContact CB-CE1 4.26Å; P339-F374 HydrophobicContact CB-CE2 3.35Å; P339-F374 HydrophobicContact CB-CZ 3.39Å; P339-F374 HydrophobicContact CG-CD1 4.22Å; P339-F374 HydrophobicContact CG-CD2 4.27Å; P339-F374 HydrophobicContact CG-CE1 3.53Å; P339-F374 HydrophobicContact CG-CE2 3.57Å; P339-F374 HydrophobicContact CG-CZ 3.15Å
340	T	81.4	Confident	81.8	Confident	57 Å²	57	61.2 Å²	61.2	35%	0.35	31%	0.308	S	S	.	.			trans	-67.2	158.5	170.5	82.1	0	0	0	0	110.9	E342 Q343 L344	T340-E342 WeakPolarHBondContact CB-OE2 3.32Å; T340-E342 PolarHBondContact O-N 3.11Å; T340-E342 PolarHBondContact OG1-N 2.99Å; T340-E342 PolarHBondContact OG1-OE2 3.35Å; T340-Q343 PolarHBondContact O-N 3.41Å; T340-Q343 WeakPolarHBondContact OG1-CG 3.19Å; T340-Q343 PolarHBondContact OG1-N 2.96Å; T340-L344 PolarHBondContact O-N 3.47Å
341	P	82.8	Confident	81.4	Confident	96 Å²	96	60.5 Å²	60.5	62%	0.623	30%	0.302	S	S	*	.	H	α-helix	trans	-54	-35.8	174.5	-26.4	35.9	0	0	0	113.2	L344 Q345	P341-L344 PolarHBondContact O-N 3.39Å; P341-Q345 WeakPolarHBondContact O-CB 3.44Å; P341-Q345 PolarHBondContact O-N 2.99Å
342	E	80.1	Confident	80.8	Confident	132 Å²	132	62 Å²	62	62%	0.617	31%	0.309	S	S	*	.	H	α-helix	trans	-68.1	-42.7	176.8	-56.7	70.3	-148.7	0	0	111.1	T340 Q345 A346	T340-E342 WeakPolarHBondContact CB-OE2 3.32Å; T340-E342 PolarHBondContact O-N 3.11Å; T340-E342 PolarHBondContact OG1-N 2.99Å; T340-E342 PolarHBondContact OG1-OE2 3.35Å; E342-Q345 PolarHBondContact O-N 2.82Å; E342-A346 WeakPolarHBondContact O-CB 3.25Å; E342-A346 PolarHBondContact O-N 3.3Å
343	Q	76.6	Confident	80.3	Confident	42 Å²	42	64 Å²	64	20%	0.196	32%	0.323	C	S	.	.	H	α-helix	trans	-66.1	-38.1	175.7	-69.7	175.5	-26.2	0	0	111.9	P339 T340 F347 W453	P339-Q343 HydrophobicContact CB-CB 4.37Å; T340-Q343 PolarHBondContact O-N 3.41Å; T340-Q343 WeakPolarHBondContact OG1-CG 3.19Å; T340-Q343 PolarHBondContact OG1-N 2.96Å; Q343-F347 VanDerWaalsContact O-CB 3.27Å; Q343-F347 WeakPolarHBondContact O-CB 3.45Å; Q343-F347 PolarHBondContact O-N 2.78Å; Q343-W453 HydrophobicContact CG-CG 4.49Å; Q343-W453 PolarHBondContact NE2-O 3.16Å; Q343-W453 PolarHBondContact O-NE1 2.87Å
344	L	82.7	Confident	79.9	Confident	52 Å²	52	62.9 Å²	62.9	27%	0.272	32%	0.317	S	S	.	.	H	α-helix	trans	-62.6	-45.9	172.7	175.2	63.4	0	0	0	110.9	T340 P341 F347 K348 T370 F374	T340-L344 PolarHBondContact O-N 3.47Å; P341-L344 PolarHBondContact O-N 3.39Å; L344-F347 PolarHBondContact O-N 3.27Å; L344-K348 HydrophobicContact CD1-CG 4.48Å; L344-K348 WeakPolarHBondContact O-CG 3.35Å; L344-K348 PolarHBondContact O-N 3.32Å; L344-T370 HydrophobicContact CD1-CG2 3.92Å; L344-F374 HydrophobicContact CB-CZ 3.89Å; L344-F374 HydrophobicContact CD1-CE1 3.66Å; L344-F374 HydrophobicContact CD1-CE2 4.27Å; L344-F374 HydrophobicContact CD1-CZ 3.3Å; L344-F374 HydrophobicContact CG-CZ 4.15Å
345	Q	82.4	Confident	79.7	Confident	102 Å²	102	65.6 Å²	65.6	48%	0.477	33%	0.327	S	S	.	.	H	α-helix	trans	-66.2	-42.3	178.6	-172.2	59.6	45.4	0	0	111.5	P341 E342 F347 K348 N349	P341-Q345 WeakPolarHBondContact O-CB 3.44Å; P341-Q345 PolarHBondContact O-N 2.99Å; E342-Q345 PolarHBondContact O-N 2.82Å; Q345-F347 VanDerWaalsContact C-N 3.35Å; Q345-F347 PolarHBondContact O-N 3.42Å; Q345-K348 PolarHBondContact O-N 3.15Å; Q345-N349 PolarHBondContact NE2-OD1 2.7Å; Q345-N349 WeakPolarHBondContact O-CB 3.37Å; Q345-N349 PolarHBondContact O-N 2.83Å; Q345-N349 PolarHBondContact O-ND2 3.49Å; Q345-N349 PolarHBondContact O-OD1 2.74Å
346	A	78.4	Confident	79.9	Confident	14 Å²	14	66 Å²	66	12%	0.116	33%	0.329	C	S	.	.	H	α-helix	trans	-61.2	-43.9	175	0	0	0	0	0	111.5	E342 N349 E350 R452	E342-A346 WeakPolarHBondContact O-CB 3.25Å; E342-A346 PolarHBondContact O-N 3.3Å; A346-N349 PolarHBondContact O-N 3.3Å; A346-E350 VanDerWaalsContact O-CG 3.32Å; A346-E350 WeakPolarHBondContact O-CG 3.35Å; A346-E350 PolarHBondContact O-N 2.98Å; A346-R452 HydrophobicContact CB-CB 4.37Å
347	F	83.1	Confident	80.7	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-59.2	-49.7	174.4	175.7	-111.3	0	0	0	111.3	L334 Q343 L344 Q345 N349 E350 M351 F368 F374 I376 V449 W453	L334-F347 HydrophobicContact CD1-CD2 4.18Å; L334-F347 HydrophobicContact CD1-CE2 3.54Å; L334-F347 HydrophobicContact CD1-CZ 4.1Å; Q343-F347 VanDerWaalsContact O-CB 3.27Å; Q343-F347 WeakPolarHBondContact O-CB 3.45Å; Q343-F347 PolarHBondContact O-N 2.78Å; L344-F347 PolarHBondContact O-N 3.27Å; Q345-F347 VanDerWaalsContact C-N 3.35Å; Q345-F347 PolarHBondContact O-N 3.42Å; F347-N349 VanDerWaalsContact C-N 3.33Å; F347-N349 PolarHBondContact O-N 2.95Å; F347-E350 PolarHBondContact O-N 3.31Å; F347-E350 VanDerWaalsContact O-N 3.16Å; F347-M351 HydrophobicContact CD1-CG 4.37Å; F347-M351 HydrophobicContact CD2-CE 3.94Å; F347-M351 HydrophobicContact CD2-CG 4.38Å; F347-M351 HydrophobicContact CD2-SD 4.49Å; F347-M351 HydrophobicContact CE1-CG 4.02Å; F347-M351 HydrophobicContact CE2-CE 3.59Å; F347-M351 HydrophobicContact CE2-CG 4.03Å; F347-M351 HydrophobicContact CE2-SD 3.76Å; F347-M351 HydrophobicContact CZ-CE 4.26Å; F347-M351 HydrophobicContact CZ-CG 3.84Å; F347-M351 HydrophobicContact CZ-SD 3.81Å; F347-M351 WeakPolarHBondContact O-CG 3.48Å; F347-M351 PolarHBondContact O-N 3.36Å; F347-F368 HydrophobicContact CE1-CB 4.14Å; F347-F368 AromaticContact CE1-CD2 3.67Å; F347-F368 HydrophobicContact CE1-CD2 3.67Å; F347-F368 HydrophobicContact CE1-CE2 4.42Å; F347-F368 HydrophobicContact CE1-CG 4.14Å; F347-F368 HydrophobicContact CZ-CB 3.92Å; F347-F368 HydrophobicContact CZ-CD2 4.32Å; F347-F368 HydrophobicContact CZ-CG 4.38Å; F347-F374 HydrophobicContact CB-CD2 4.47Å; F347-F374 HydrophobicContact CB-CE2 4.22Å; F347-F374 HydrophobicContact CD1-CD2 4.13Å; F347-F374 HydrophobicContact CD1-CE2 4.25Å; F347-F374 HydrophobicContact CD1-CG 4.44Å; F347-F374 HydrophobicContact CE1-CG 4.44Å; F347-F374 HydrophobicContact CG-CD2 4.15Å; F347-F374 HydrophobicContact CG-CE2 4.31Å; F347-I376 HydrophobicContact CE2-CD1 4.09Å; F347-I376 HydrophobicContact CE2-CG1 3.96Å; F347-I376 HydrophobicContact CZ-CG1 4.11Å; F347-V449 HydrophobicContact CD2-CG1 4.38Å; F347-W453 HydrophobicContact CB-CZ2 4.06Å; F347-W453 HydrophobicContact CD2-CH2 4.26Å; F347-W453 AromaticContact CD2-CZ2 3.7Å; F347-W453 HydrophobicContact CD2-CZ2 3.7Å; F347-W453 HydrophobicContact CG-CZ2 4.2Å
348	K	83.1	Confident	82.1	Confident	46 Å²	46	64 Å²	64	20%	0.2	31%	0.313	C	S	.	.	H	α-helix	trans	-56.4	-47.2	176.4	-76.5	-176.9	172	-172.1	0	111.3	L344 Q345 E350 M351 Q352	L344-K348 HydrophobicContact CD1-CG 4.48Å; L344-K348 WeakPolarHBondContact O-CG 3.35Å; L344-K348 PolarHBondContact O-N 3.32Å; Q345-K348 PolarHBondContact O-N 3.15Å; K348-E350 VanDerWaalsContact C-N 3.29Å; K348-E350 PolarHBondContact O-N 3.45Å; K348-M351 PolarHBondContact O-N 3.41Å; K348-M351 VanDerWaalsContact O-N 3.13Å; K348-Q352 VanDerWaalsContact O-CG 3.31Å; K348-Q352 WeakPolarHBondContact O-CG 3.43Å; K348-Q352 PolarHBondContact O-N 3.43Å
349	N	81.3	Confident	83.2	Confident	79 Å²	79	58.3 Å²	58.3	42%	0.422	29%	0.286	S	S	.	.	H	α-helix	trans	-57.8	-40.9	178.1	-69.8	-12.7	0	0	0	112.2	Q345 A346 F347 Q352 V353	Q345-N349 PolarHBondContact NE2-OD1 2.7Å; Q345-N349 WeakPolarHBondContact O-CB 3.37Å; Q345-N349 PolarHBondContact O-N 2.83Å; Q345-N349 PolarHBondContact O-ND2 3.49Å; Q345-N349 PolarHBondContact O-OD1 2.74Å; A346-N349 PolarHBondContact O-N 3.3Å; F347-N349 VanDerWaalsContact C-N 3.33Å; F347-N349 PolarHBondContact O-N 2.95Å; N349-Q352 WeakPolarHBondContact O-CB 3.29Å; N349-Q352 PolarHBondContact O-N 3.32Å; N349-V353 PolarHBondContact O-N 3.13Å
350	E	81.3	Confident	84.2	Confident	16 Å²	16	59.3 Å²	59.3	8%	0.075	29%	0.291	C	S	.	.	H	α-helix	trans	-67.4	-40.6	176.2	-69.1	-76.1	158.8	0	0	111.5	A346 F347 K348 Q352 V353 L354 T448 V449 R452	A346-E350 VanDerWaalsContact O-CG 3.32Å; A346-E350 WeakPolarHBondContact O-CG 3.35Å; A346-E350 PolarHBondContact O-N 2.98Å; F347-E350 PolarHBondContact O-N 3.31Å; F347-E350 VanDerWaalsContact O-N 3.16Å; K348-E350 VanDerWaalsContact C-N 3.29Å; K348-E350 PolarHBondContact O-N 3.45Å; E350-Q352 PolarHBondContact O-N 3.2Å; E350-V353 WeakPolarHBondContact O-CA 3.2Å; E350-V353 WeakPolarHBondContact O-CB 3.48Å; E350-V353 PolarHBondContact O-N 3.04Å; E350-L354 PolarHBondContact O-N 3.18Å; E350-T448 VanDerWaalsContact OE1-CB 3.26Å; E350-T448 WeakPolarHBondContact OE1-CB 3.38Å; E350-T448 WeakPolarHBondContact OE1-CG2 3.23Å; E350-V449 HydrophobicContact CB-CG2 3.49Å; E350-V449 VanDerWaalsContact CB-CG2 3.49Å; E350-V449 HydrophobicContact CG-CG2 3.44Å; E350-V449 VanDerWaalsContact CG-CG2 3.44Å; E350-R452 IonicContact OE1-CZ 3.76Å; E350-R452 IonicContact OE1-NH1 3.85Å; E350-R452 PolarHBondContact OE1-NH1 3.28Å
351	M	86.1	Confident	85	Confident	1 Å²	1	56.7 Å²	56.7	1%	0.005	28%	0.275	C	S	.	.	H	α-helix	trans	-62.6	-31.4	174.2	-60.9	-53.5	97.4	0	0	112	F347 K348 V353 L354 R355 F365 F368 I376	F347-M351 HydrophobicContact CD1-CG 4.37Å; F347-M351 HydrophobicContact CD2-CE 3.94Å; F347-M351 HydrophobicContact CD2-CG 4.38Å; F347-M351 HydrophobicContact CD2-SD 4.49Å; F347-M351 HydrophobicContact CE1-CG 4.02Å; F347-M351 HydrophobicContact CE2-CE 3.59Å; F347-M351 HydrophobicContact CE2-CG 4.03Å; F347-M351 HydrophobicContact CE2-SD 3.76Å; F347-M351 HydrophobicContact CZ-CE 4.26Å; F347-M351 HydrophobicContact CZ-CG 3.84Å; F347-M351 HydrophobicContact CZ-SD 3.81Å; F347-M351 WeakPolarHBondContact O-CG 3.48Å; F347-M351 PolarHBondContact O-N 3.36Å; K348-M351 PolarHBondContact O-N 3.41Å; K348-M351 VanDerWaalsContact O-N 3.13Å; M351-V353 PolarHBondContact O-N 2.79Å; M351-L354 HydrophobicContact CE-CD1 3.48Å; M351-L354 VanDerWaalsContact CE-CD1 3.48Å; M351-L354 HydrophobicContact CE-CG 4.42Å; M351-L354 PolarHBondContact O-N 3.33Å; M351-L354 HydrophobicContact SD-CD1 4.07Å; M351-R355 WeakPolarHBondContact O-CB 3.36Å; M351-R355 WeakPolarHBondContact O-CG 3.42Å; M351-R355 PolarHBondContact O-N 3.02Å; M351-F365 HydrophobicContact CB-CZ 4.23Å; M351-F365 HydrophobicContact CG-CZ 4.43Å; M351-F365 HydrophobicContact SD-CE2 3.55Å; M351-F365 VanDerWaalsContact SD-CE2 3.55Å; M351-F365 HydrophobicContact SD-CZ 3.82Å; M351-F368 HydrophobicContact CB-CD1 3.74Å; M351-F368 HydrophobicContact CB-CE1 3.98Å; M351-F368 HydrophobicContact CB-CG 4.32Å; M351-F368 HydrophobicContact CG-CB 3.97Å; M351-F368 HydrophobicContact CG-CD1 3.71Å; M351-F368 HydrophobicContact CG-CD2 4.41Å; M351-F368 HydrophobicContact CG-CE1 4.28Å; M351-F368 HydrophobicContact CG-CG 3.77Å; M351-F368 HydrophobicContact SD-CB 3.95Å; M351-F368 HydrophobicContact SD-CG 4.4Å; M351-I376 HydrophobicContact CE-CD1 3.87Å; M351-I376 HydrophobicContact CE-CG1 4.35Å; M351-I376 HydrophobicContact SD-CD1 4.15Å; M351-I376 HydrophobicContact SD-CG1 4Å
352	Q	82.1	Confident	85.5	Confident	31 Å²	31	52.2 Å²	52.2	15%	0.145	25%	0.246	C	C	.	.	H	α-helix	trans	-64.7	-27.2	173.3	-60.4	-60	-51.2	0	0	113	K348 N349 E350 R355	K348-Q352 VanDerWaalsContact O-CG 3.31Å; K348-Q352 WeakPolarHBondContact O-CG 3.43Å; K348-Q352 PolarHBondContact O-N 3.43Å; N349-Q352 WeakPolarHBondContact O-CB 3.29Å; N349-Q352 PolarHBondContact O-N 3.32Å; E350-Q352 PolarHBondContact O-N 3.2Å; Q352-R355 WeakPolarHBondContact O-CG 3.29Å
353	V	81.5	Confident	86.2	Confident	59 Å²	59	46.7 Å²	46.7	36%	0.358	22%	0.221	S	C	.	.	H	α-helix	trans	-80	-49.3	174.5	178.7	0	0	0	0	109.7	N349 E350 M351 R355 K356 I421	N349-V353 PolarHBondContact O-N 3.13Å; E350-V353 WeakPolarHBondContact O-CA 3.2Å; E350-V353 WeakPolarHBondContact O-CB 3.48Å; E350-V353 PolarHBondContact O-N 3.04Å; M351-V353 PolarHBondContact O-N 2.79Å; V353-R355 VanDerWaalsContact C-N 3.34Å; V353-R355 PolarHBondContact O-N 3.17Å; V353-K356 PolarHBondContact O-N 3.43Å; V353-K356 VanDerWaalsContact O-N 3.12Å; V353-I421 HydrophobicContact CG1-CD1 3.6Å; V353-I421 HydrophobicContact CG1-CG1 3.72Å
354	L	83.5	Confident	86.9	Confident	8 Å²	8	47.7 Å²	47.7	4%	0.042	23%	0.227	C	C	.	.	H	α-helix	trans	-59.3	-40.6	-178.8	-64.5	-177.4	0	0	0	112.7	E350 M351 K356 T357 F365 F444	E350-L354 PolarHBondContact O-N 3.18Å; M351-L354 HydrophobicContact CE-CD1 3.48Å; M351-L354 VanDerWaalsContact CE-CD1 3.48Å; M351-L354 HydrophobicContact CE-CG 4.42Å; M351-L354 PolarHBondContact O-N 3.33Å; M351-L354 HydrophobicContact SD-CD1 4.07Å; L354-K356 PolarHBondContact O-N 3.11Å; L354-K356 VanDerWaalsContact O-N 3.08Å; L354-T357 WeakPolarHBondContact O-CB 3.17Å; L354-T357 PolarHBondContact O-N 3.36Å; L354-T357 PolarHBondContact O-OG1 2.95Å; L354-F365 HydrophobicContact CB-CB 4.41Å; L354-F365 HydrophobicContact CB-CD1 4.49Å; L354-F365 HydrophobicContact CB-CD2 3.89Å; L354-F365 HydrophobicContact CB-CE2 4.25Å; L354-F365 HydrophobicContact CB-CG 4Å; L354-F365 HydrophobicContact CD1-CD2 4.13Å; L354-F365 HydrophobicContact CD1-CE2 4.26Å; L354-F444 HydrophobicContact CD2-CD2 3.53Å; L354-F444 HydrophobicContact CD2-CE2 3.25Å; L354-F444 HydrophobicContact CD2-CZ 4.04Å
355	R	84.2	Confident	87.4	Confident	63 Å²	63	45.7 Å²	45.7	24%	0.238	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-21.5	179	72.2	178.8	174.5	103.4	-7.2	114.5	S295 W299 M351 Q352 V353 T357 F365	S295-R355 PolarHBondContact OG-NH2 2.81Å; W299-R355 HydrophobicContact CD2-CB 4.38Å; M351-R355 WeakPolarHBondContact O-CB 3.36Å; M351-R355 WeakPolarHBondContact O-CG 3.42Å; M351-R355 PolarHBondContact O-N 3.02Å; Q352-R355 WeakPolarHBondContact O-CG 3.29Å; V353-R355 VanDerWaalsContact C-N 3.34Å; V353-R355 PolarHBondContact O-N 3.17Å; R355-T357 VanDerWaalsContact C-N 3.25Å; R355-F365 HydrophobicContact CB-CD1 4.02Å; R355-F365 HydrophobicContact CB-CE1 3.98Å
356	K	83.5	Confident	87.9	Confident	130 Å²	130	43.2 Å²	43.2	57%	0.565	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-0.2	179	-62.5	177.8	-175.4	177.7	0	112.3	V353 L354 Y415	V353-K356 PolarHBondContact O-N 3.43Å; V353-K356 VanDerWaalsContact O-N 3.12Å; L354-K356 PolarHBondContact O-N 3.11Å; L354-K356 VanDerWaalsContact O-N 3.08Å; K356-Y415 PolarHBondContact O-OH 3.16Å
357	T	90.1	Very high	88.6	Confident	3 Å²	3	42.5 Å²	42.5	2%	0.018	20%	0.199	C	C	.	.			trans	-89.9	119.3	179	66	0	0	0	0	111	L354 R355 Y415 L416 I421 F444	L354-T357 WeakPolarHBondContact O-CB 3.17Å; L354-T357 PolarHBondContact O-N 3.36Å; L354-T357 PolarHBondContact O-OG1 2.95Å; R355-T357 VanDerWaalsContact C-N 3.25Å; T357-Y415 WeakPolarHBondContact CA-OH 3.49Å; T357-Y415 HydrophobicContact CG2-CE1 4.28Å; T357-L416 HydrophobicContact CG2-CD2 4.2Å; T357-I421 HydrophobicContact CG2-CD1 3.62Å; T357-F444 HydrophobicContact CG2-CE2 3.8Å; T357-F444 HydrophobicContact CG2-CZ 4.29Å
358	R	92.7	Very high	89	Confident	186 Å²	186	42.6 Å²	42.6	70%	0.702	20%	0.2	S	C	*	.			trans	-144.5	102.2	174.9	-74.1	-169.7	173.7	-179.9	-3.6	108.6	Y415	R358-Y415 PolarHBondContact N-OH 3.48Å
359	H	95.6	Very high	89.4	Confident	59 Å²	59	40.6 Å²	40.6	27%	0.273	19%	0.191	S	C	.	.			trans	-154.2	146.5	179.6	-176.1	-98.3	0	0	0	109.4	N361 I362 Y415	H359-N361 PolarHBondContact CE1-OD1 2.99Å; H359-N361 PolarHBondContact ND1-N 3.21Å; H359-N361 PolarHBondContact O-N 3.32Å; H359-I362 HydrophobicContact CB-CB 4.12Å; H359-I362 HydrophobicContact CB-CG1 3.84Å; H359-I362 PolarHBondContact O-N 3.19Å; H359-I362 VanDerWaalsContact O-N 3.09Å; H359-Y415 HydrophobicContact CB-CD1 3.72Å; H359-Y415 HydrophobicContact CB-CD2 3.86Å; H359-Y415 HydrophobicContact CB-CE1 3.99Å; H359-Y415 HydrophobicContact CB-CE2 4.09Å; H359-Y415 HydrophobicContact CB-CG 3.68Å; H359-Y415 AromaticContact CD2-CD2 3.82Å; H359-Y415 AromaticContact CD2-CG 3.95Å; H359-Y415 AromaticContact CG-CG 3.79Å
360	V	95.9	Very high	89.8	Confident	69 Å²	69	37.8 Å²	37.8	42%	0.418	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-35.6	-177.3	64.4	0	0	0	0	111.9	T438 K440	V360-T438 HydrophobicContact CG2-CG2 4Å; V360-K440 WeakPolarHBondContact O-CD 3.48Å; V360-K440 VanDerWaalsContact O-CE 3.24Å; V360-K440 WeakPolarHBondContact O-CE 3.39Å; V360-K440 PolarHBondContact O-NZ 3.1Å
361	N	97.3	Very high	90	Very high	2 Å²	2	44.7 Å²	44.7	1%	0.011	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.3	8.7	180	-55.2	116.8	0	0	0	116.1	H359 Q408 V439 I441	H359-N361 PolarHBondContact CE1-OD1 2.99Å; H359-N361 PolarHBondContact ND1-N 3.21Å; H359-N361 PolarHBondContact O-N 3.32Å; N361-Q408 WeakPolarHBondContact CB-O 3.5Å; N361-Q408 VanDerWaalsContact CG-O 3.3Å; N361-Q408 PolarHBondContact ND2-OE1 2.89Å; N361-Q408 PolarHBondContact OD1-O 3.47Å; N361-V439 WeakPolarHBondContact CA-O 3.45Å; N361-V439 PolarHBondContact ND2-O 3.01Å; N361-V439 VanDerWaalsContact ND2-O 3.1Å; N361-I441 WeakPolarHBondContact O-CG1 3.37Å; N361-I441 PolarHBondContact O-N 3.26Å
362	I	95.2	Very high	90	Very high	3 Å²	3	48.8 Å²	48.8	2%	0.015	23%	0.233	C	C	.	.	B	Isolated β-bridge	trans	-111	137.1	176.2	-62.9	-55.6	0	0	0	108.9	H359 L364 G412 Y415 L416 I441 F444	H359-I362 HydrophobicContact CB-CB 4.12Å; H359-I362 HydrophobicContact CB-CG1 3.84Å; H359-I362 PolarHBondContact O-N 3.19Å; H359-I362 VanDerWaalsContact O-N 3.09Å; I362-L364 PolarHBondContact O-N 2.82Å; I362-G412 WeakPolarHBondContact CD1-O 3.04Å; I362-Y415 HydrophobicContact CG1-CD1 3.95Å; I362-L416 HydrophobicContact CD1-CD1 3.81Å; I362-L416 HydrophobicContact CD1-CD2 4.05Å; I362-L416 HydrophobicContact CD1-CG 3.73Å; I362-L416 HydrophobicContact CG1-CD2 4.36Å; I362-L416 HydrophobicContact CG1-CG 4.42Å; I362-I441 HydrophobicContact CD1-CB 3.96Å; I362-I441 HydrophobicContact CD1-CD1 4.24Å; I362-I441 HydrophobicContact CD1-CG1 4.5Å; I362-F444 HydrophobicContact CG2-CD1 4.34Å; I362-F444 HydrophobicContact CG2-CE1 3.36Å; I362-F444 HydrophobicContact CG2-CE2 4.34Å; I362-F444 HydrophobicContact CG2-CZ 3.35Å
363	L	93.4	Very high	90.2	Very high	16 Å²	16	50.5 Å²	50.5	8%	0.084	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-63.6	120.7	175.4	-168.6	72	0	0	0	109	F365 T378 Q379 C381 K440 I441	L363-F365 PolarHBondContact O-N 3.32Å; L363-F365 VanDerWaalsContact O-N 3.15Å; L363-T378 HydrophobicContact CD2-CG2 4.16Å; L363-Q379 HydrophobicContact CD1-CG 3.49Å; L363-Q379 VanDerWaalsContact CD1-CG 3.49Å; L363-Q379 HydrophobicContact CG-CG 4.04Å; L363-C381 WeakPolarHBondContact CD1-SG 3.45Å; L363-K440 HydrophobicContact CD1-CB 4.13Å; L363-I441 VanDerWaalsContact CB-O 3.26Å; L363-I441 WeakPolarHBondContact CB-O 3.32Å; L363-I441 PolarHBondContact N-O 2.84Å
364	L	92.6	Very high	90.6	Very high	62 Å²	62	48.2 Å²	48.2	33%	0.325	23%	0.229	S	C	.	.	P	Polyproline II helix	trans	-64.7	117.5	-175.4	-179.3	63.4	0	0	0	111	I362 M366 T378 Q379	I362-L364 PolarHBondContact O-N 2.82Å; L364-M366 HydrophobicContact CD2-CE 4.13Å; L364-M366 HydrophobicContact CD2-CG 4.47Å; L364-M366 HydrophobicContact CG-CG 4.35Å; L364-T378 CarbonylContact O-C 3.34Å; L364-T378 VanDerWaalsContact O-CA 3.23Å; L364-T378 WeakPolarHBondContact O-CA 3.33Å; L364-T378 WeakPolarHBondContact O-CB 3.42Å; L364-Q379 HydrophobicContact CB-CB 4.11Å; L364-Q379 HydrophobicContact CB-CG 3.93Å; L364-Q379 PolarHBondContact O-N 3.09Å
365	F	92.4	Very high	91	Very high	11 Å²	11	47.8 Å²	47.8	5%	0.048	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	126.9	165.8	178.3	-93.2	0	0	0	109.8	M351 L354 R355 L363 G367 F368 I376	M351-F365 HydrophobicContact CB-CZ 4.23Å; M351-F365 HydrophobicContact CG-CZ 4.43Å; M351-F365 HydrophobicContact SD-CE2 3.55Å; M351-F365 VanDerWaalsContact SD-CE2 3.55Å; M351-F365 HydrophobicContact SD-CZ 3.82Å; L354-F365 HydrophobicContact CB-CB 4.41Å; L354-F365 HydrophobicContact CB-CD1 4.49Å; L354-F365 HydrophobicContact CB-CD2 3.89Å; L354-F365 HydrophobicContact CB-CE2 4.25Å; L354-F365 HydrophobicContact CB-CG 4Å; L354-F365 HydrophobicContact CD1-CD2 4.13Å; L354-F365 HydrophobicContact CD1-CE2 4.26Å; R355-F365 HydrophobicContact CB-CD1 4.02Å; R355-F365 HydrophobicContact CB-CE1 3.98Å; L363-F365 PolarHBondContact O-N 3.32Å; L363-F365 VanDerWaalsContact O-N 3.15Å; F365-G367 WeakPolarHBondContact CE2-O 3.36Å; F365-G367 WeakPolarHBondContact CZ-O 3.48Å; F365-F368 HydrophobicContact CZ-CB 4.34Å; F365-F368 HydrophobicContact CZ-CD1 4.11Å; F365-I376 HydrophobicContact CD2-CG2 4.07Å; F365-I376 HydrophobicContact CE2-CG2 3.92Å
366	M	92.6	Very high	91.3	Very high	49 Å²	49	45.2 Å²	45.2	24%	0.241	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	-34.1	-176.2	-73.6	-178.7	165.5	0	0	112.5	W325 V329 L364 I377 Q379	W325-M366 HydrophobicContact CE3-CB 4.5Å; W325-M366 HydrophobicContact CZ3-CB 3.96Å; V329-M366 HydrophobicContact CG1-SD 3.57Å; V329-M366 VanDerWaalsContact CG1-SD 3.57Å; L364-M366 HydrophobicContact CD2-CE 4.13Å; L364-M366 HydrophobicContact CD2-CG 4.47Å; L364-M366 HydrophobicContact CG-CG 4.35Å; M366-I377 HydrophobicContact CB-CG2 4.16Å; M366-I377 WeakPolarHBondContact CB-O 3.47Å; M366-I377 PolarHBondContact N-O 3.1Å; M366-Q379 HydrophobicContact CE-CB 3.73Å
367	G	92.3	Very high	91.8	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	172.1	-175.6	179.3	0	0	0	0	0	112.2	W299 F365 I377	W299-G367 WeakPolarHBondContact O-CA 3.48Å; F365-G367 WeakPolarHBondContact CE2-O 3.36Å; F365-G367 WeakPolarHBondContact CZ-O 3.48Å; G367-I377 PolarHBondContact N-O 3.42Å; G367-I377 PolarHBondContact O-N 3.42Å
368	F	92.6	Very high	92	Very high	1 Å²	1	40.1 Å²	40.1	0%	0.004	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	161.7	175.6	66.6	-88	0	0	0	110.7	W299 E300 V301 F347 M351 F365 T370 A375	W299-F368 HydrophobicContact CB-CD1 4.28Å; W299-F368 HydrophobicContact CB-CE1 3.95Å; W299-F368 WeakPolarHBondContact O-CD1 3.34Å; W299-F368 PolarHBondContact O-N 2.77Å; E300-F368 CarbonylContact C-O 3.56Å; E300-F368 WeakPolarHBondContact CA-O 3.35Å; E300-F368 HydrophobicContact CB-CD2 4.48Å; E300-F368 HydrophobicContact CB-CE1 4.44Å; E300-F368 HydrophobicContact CB-CE2 3.8Å; E300-F368 HydrophobicContact CB-CZ 3.78Å; E300-F368 HydrophobicContact CG-CD2 4.37Å; E300-F368 HydrophobicContact CG-CE2 3.85Å; E300-F368 HydrophobicContact CG-CZ 4.35Å; V301-F368 PolarHBondContact N-O 3.39Å; F347-F368 HydrophobicContact CE1-CB 4.14Å; F347-F368 AromaticContact CE1-CD2 3.67Å; F347-F368 HydrophobicContact CE1-CD2 3.67Å; F347-F368 HydrophobicContact CE1-CE2 4.42Å; F347-F368 HydrophobicContact CE1-CG 4.14Å; F347-F368 HydrophobicContact CZ-CB 3.92Å; F347-F368 HydrophobicContact CZ-CD2 4.32Å; F347-F368 HydrophobicContact CZ-CG 4.38Å; M351-F368 HydrophobicContact CB-CD1 3.74Å; M351-F368 HydrophobicContact CB-CE1 3.98Å; M351-F368 HydrophobicContact CB-CG 4.32Å; M351-F368 HydrophobicContact CG-CB 3.97Å; M351-F368 HydrophobicContact CG-CD1 3.71Å; M351-F368 HydrophobicContact CG-CD2 4.41Å; M351-F368 HydrophobicContact CG-CE1 4.28Å; M351-F368 HydrophobicContact CG-CG 3.77Å; M351-F368 HydrophobicContact SD-CB 3.95Å; M351-F368 HydrophobicContact SD-CG 4.4Å; F365-F368 HydrophobicContact CZ-CB 4.34Å; F365-F368 HydrophobicContact CZ-CD1 4.11Å; F368-T370 HydrophobicContact CD2-CG2 4.07Å; F368-T370 HydrophobicContact CE2-CG2 3.84Å; F368-A375 CarbonylContact C-O 3.38Å; F368-A375 WeakPolarHBondContact CA-O 3.27Å; F368-A375 WeakPolarHBondContact CB-O 3.36Å
369	M	91.6	Very high	92.1	Very high	4 Å²	4	32.6 Å²	32.6	2%	0.02	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	145.7	171.9	-47.8	-173.9	-25.7	0	0	109	V301 Y303 V306 F374 A375 I377	V301-M369 HydrophobicContact CB-CG 4.39Å; V301-M369 WeakPolarHBondContact O-CG 3.19Å; Y303-M369 HydrophobicContact CD2-CE 3.79Å; Y303-M369 HydrophobicContact CD2-SD 4.41Å; V306-M369 HydrophobicContact CB-SD 4.34Å; V306-M369 HydrophobicContact CG2-SD 4.03Å; M369-F374 VanDerWaalsContact O-CA 3.31Å; M369-F374 WeakPolarHBondContact O-CA 3.33Å; M369-A375 HydrophobicContact CB-CB 4.09Å; M369-A375 HydrophobicContact CE-CB 3.8Å; M369-A375 HydrophobicContact CG-CB 4.23Å; M369-A375 PolarHBondContact N-O 3.39Å; M369-A375 PolarHBondContact O-N 2.83Å; M369-I377 HydrophobicContact CG-CD1 3.96Å; M369-I377 HydrophobicContact CG-CG1 4.45Å; M369-I377 HydrophobicContact SD-CD1 4.26Å
370	T	88.7	Confident	91.9	Very high	21 Å²	21	32 Å²	32	13%	0.129	17%	0.165	C	C	.	.			trans	-107.6	-18.6	172.2	67.3	0	0	0	0	113.1	E300 L344 F368 F374	E300-T370 HydrophobicContact CG-CG2 4.45Å; E300-T370 WeakPolarHBondContact OE1-CB 3.4Å; E300-T370 VanDerWaalsContact OE1-CG2 3.28Å; E300-T370 WeakPolarHBondContact OE1-CG2 3.47Å; E300-T370 PolarHBondContact OE1-OG1 3.24Å; L344-T370 HydrophobicContact CD1-CG2 3.92Å; F368-T370 HydrophobicContact CD2-CG2 4.07Å; F368-T370 HydrophobicContact CE2-CG2 3.84Å; T370-F374 HydrophobicContact CG2-CE1 4.34Å; T370-F374 WeakPolarHBondContact O-CD1 3.25Å
371	K	86.9	Confident	91.7	Very high	161 Å²	161	29.5 Å²	29.5	70%	0.7	15%	0.151	S	C	*	.	S	Bend	trans	-133.3	144.9	-178.1	-63.3	-177	-177.8	-177.6	0	110	N373	K371-N373 VanDerWaalsContact C-N 3.29Å
372	P	84.8	Confident	91.2	Very high	87 Å²	87	34 Å²	34	57%	0.565	17%	0.172	S	C	*	.	S	Bend	cis	-70.9	-21.5	-7.7	30.1	-35.2	0	0	0	113.1	Y303	Y303-P372 HydrophobicContact CD2-CG 4.36Å; Y303-P372 HydrophobicContact CE2-CG 4.48Å; Y303-P372 HydrophobicContact CG-CG 4.48Å
373	N	87.5	Confident	90.7	Very high	67 Å²	67	35.3 Å²	35.3	36%	0.358	19%	0.186	S	C	.	.	S	Bend	trans	-126.7	157.1	176	-62.9	-72.7	0	0	0	109.4	I333 K371 A375	I333-N373 HydrophobicContact CG2-CB 3.69Å; K371-N373 VanDerWaalsContact C-N 3.29Å; N373-A375 PolarHBondContact O-N 3.32Å
374	F	89.1	Confident	90.5	Very high	10 Å²	10	37 Å²	37	4%	0.044	20%	0.199	C	C	.	.			trans	-64.4	126.1	169.1	-73.2	3.5	0	0	0	109.7	L334 P339 L344 F347 M369 T370 W453	L334-F374 HydrophobicContact CB-CB 4.18Å; L334-F374 WeakPolarHBondContact CB-O 3.39Å; L334-F374 HydrophobicContact CD1-CB 3.76Å; L334-F374 HydrophobicContact CG-CB 4.46Å; L334-F374 PolarHBondContact N-O 3.41Å; P339-F374 HydrophobicContact CB-CD2 4.21Å; P339-F374 HydrophobicContact CB-CE1 4.26Å; P339-F374 HydrophobicContact CB-CE2 3.35Å; P339-F374 HydrophobicContact CB-CZ 3.39Å; P339-F374 HydrophobicContact CG-CD1 4.22Å; P339-F374 HydrophobicContact CG-CD2 4.27Å; P339-F374 HydrophobicContact CG-CE1 3.53Å; P339-F374 HydrophobicContact CG-CE2 3.57Å; P339-F374 HydrophobicContact CG-CZ 3.15Å; L344-F374 HydrophobicContact CB-CZ 3.89Å; L344-F374 HydrophobicContact CD1-CE1 3.66Å; L344-F374 HydrophobicContact CD1-CE2 4.27Å; L344-F374 HydrophobicContact CD1-CZ 3.3Å; L344-F374 HydrophobicContact CG-CZ 4.15Å; F347-F374 HydrophobicContact CB-CD2 4.47Å; F347-F374 HydrophobicContact CB-CE2 4.22Å; F347-F374 HydrophobicContact CD1-CD2 4.13Å; F347-F374 HydrophobicContact CD1-CE2 4.25Å; F347-F374 HydrophobicContact CD1-CG 4.44Å; F347-F374 HydrophobicContact CE1-CG 4.44Å; F347-F374 HydrophobicContact CG-CD2 4.15Å; F347-F374 HydrophobicContact CG-CE2 4.31Å; M369-F374 VanDerWaalsContact O-CA 3.31Å; M369-F374 WeakPolarHBondContact O-CA 3.33Å; T370-F374 HydrophobicContact CG2-CE1 4.34Å; T370-F374 WeakPolarHBondContact O-CD1 3.25Å; F374-W453 HydrophobicContact CD2-CZ2 4.41Å
375	A	91.4	Very high	90.6	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	153.1	177.1	0	0	0	0	0	111.5	I331 K332 I333 F368 M369 N373	I331-A375 HydrophobicContact CG2-CB 4.07Å; K332-A375 CarbonylContact O-C 3.6Å; K332-A375 WeakPolarHBondContact O-CA 3.36Å; I333-A375 HydrophobicContact CG1-CB 4.32Å; F368-A375 CarbonylContact C-O 3.38Å; F368-A375 WeakPolarHBondContact CA-O 3.27Å; F368-A375 WeakPolarHBondContact CB-O 3.36Å; M369-A375 HydrophobicContact CB-CB 4.09Å; M369-A375 HydrophobicContact CE-CB 3.8Å; M369-A375 HydrophobicContact CG-CB 4.23Å; M369-A375 PolarHBondContact N-O 3.39Å; M369-A375 PolarHBondContact O-N 2.83Å; N373-A375 PolarHBondContact O-N 3.32Å
376	I	92.3	Very high	90.7	Very high	8 Å²	8	34.5 Å²	34.5	4%	0.041	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	132	173.9	-61.7	174.9	0	0	0	107.7	I331 K332 L334 F347 M351 F365 T378 L446	I331-I376 WeakPolarHBondContact CA-O 3.49Å; K332-I376 PolarHBondContact N-O 3.19Å; K332-I376 PolarHBondContact O-N 2.96Å; L334-I376 HydrophobicContact CD1-CD1 4.25Å; L334-I376 HydrophobicContact CD1-CG1 4.22Å; L334-I376 HydrophobicContact CD2-CD1 4.43Å; F347-I376 HydrophobicContact CE2-CD1 4.09Å; F347-I376 HydrophobicContact CE2-CG1 3.96Å; F347-I376 HydrophobicContact CZ-CG1 4.11Å; M351-I376 HydrophobicContact CE-CD1 3.87Å; M351-I376 HydrophobicContact CE-CG1 4.35Å; M351-I376 HydrophobicContact SD-CD1 4.15Å; M351-I376 HydrophobicContact SD-CG1 4Å; F365-I376 HydrophobicContact CD2-CG2 4.07Å; F365-I376 HydrophobicContact CE2-CG2 3.92Å; I376-T378 HydrophobicContact CG2-CG2 4.09Å; I376-L446 HydrophobicContact CD1-CD2 3.17Å
377	I	93.7	Very high	90.8	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	122.5	179.8	-51.5	177.5	0	0	0	107.8	V301 V306 W325 V329 A330 I331 M366 G367 M369	V301-I377 HydrophobicContact CB-CD1 3.85Å; V301-I377 HydrophobicContact CG1-CD1 4.07Å; V301-I377 HydrophobicContact CG2-CD1 3.94Å; V306-I377 HydrophobicContact CG2-CD1 3.96Å; W325-I377 HydrophobicContact CE3-CG2 4.4Å; V329-I377 HydrophobicContact CB-CG2 3.83Å; V329-I377 HydrophobicContact CG1-CG2 4.06Å; V329-I377 HydrophobicContact CG2-CG2 4.04Å; A330-I377 WeakPolarHBondContact O-CA 3.41Å; I331-I377 HydrophobicContact CG1-CG1 4.49Å; M366-I377 HydrophobicContact CB-CG2 4.16Å; M366-I377 WeakPolarHBondContact CB-O 3.47Å; M366-I377 PolarHBondContact N-O 3.1Å; G367-I377 PolarHBondContact N-O 3.42Å; G367-I377 PolarHBondContact O-N 3.42Å; M369-I377 HydrophobicContact CG-CD1 3.96Å; M369-I377 HydrophobicContact CG-CG1 4.45Å; M369-I377 HydrophobicContact SD-CD1 4.26Å
378	T	93.8	Very high	90.8	Very high	27 Å²	27	41.4 Å²	41.4	17%	0.166	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	165.7	175.8	59.6	0	0	0	0	110.4	A330 L363 L364 I376 W380	A330-T378 PolarHBondContact N-O 3.06Å; A330-T378 PolarHBondContact O-N 3.44Å; L363-T378 HydrophobicContact CD2-CG2 4.16Å; L364-T378 CarbonylContact O-C 3.34Å; L364-T378 VanDerWaalsContact O-CA 3.23Å; L364-T378 WeakPolarHBondContact O-CA 3.33Å; L364-T378 WeakPolarHBondContact O-CB 3.42Å; I376-T378 HydrophobicContact CG2-CG2 4.09Å; T378-W380 PolarHBondContact O-N 3.38Å
379	Q	93.6	Very high	90.9	Very high	27 Å²	27	42.8 Å²	42.8	13%	0.126	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-51.7	143.3	169.2	65	171.2	73.4	0	0	111	L363 L364 M366	L363-Q379 HydrophobicContact CD1-CG 3.49Å; L363-Q379 VanDerWaalsContact CD1-CG 3.49Å; L363-Q379 HydrophobicContact CG-CG 4.04Å; L364-Q379 HydrophobicContact CB-CB 4.11Å; L364-Q379 HydrophobicContact CB-CG 3.93Å; L364-Q379 PolarHBondContact O-N 3.09Å; M366-Q379 HydrophobicContact CE-CB 3.73Å
380	W	93.4	Very high	90.9	Very high	47 Å²	47	43.2 Å²	43.2	18%	0.178	22%	0.221	C	C	.	.			trans	-72.9	144.8	165.5	-179.7	-106.8	0	0	0	110.1	I312 K322 D328 A330 T378 E382	I312-W380 HydrophobicContact CD1-CH2 3.76Å; I312-W380 HydrophobicContact CD1-CZ3 4.24Å; I312-W380 HydrophobicContact CG1-CH2 3.95Å; I312-W380 HydrophobicContact CG1-CZ3 3.98Å; K322-W380 HydrophobicContact CB-CE3 4.17Å; K322-W380 HydrophobicContact CB-CH2 4.03Å; K322-W380 HydrophobicContact CB-CZ3 3.72Å; K322-W380 HydrophobicContact CD-CD2 4.19Å; K322-W380 HydrophobicContact CD-CE3 4.31Å; K322-W380 HydrophobicContact CD-CH2 3.99Å; K322-W380 HydrophobicContact CD-CZ2 3.82Å; K322-W380 HydrophobicContact CD-CZ3 4.22Å; K322-W380 HydrophobicContact CG-CD2 4.21Å; K322-W380 HydrophobicContact CG-CE3 3.93Å; K322-W380 HydrophobicContact CG-CH2 4.19Å; K322-W380 HydrophobicContact CG-CZ2 4.43Å; K322-W380 HydrophobicContact CG-CZ3 3.93Å; D328-W380 HydrophobicContact CB-CB 3.78Å; D328-W380 HydrophobicContact CB-CG 4Å; D328-W380 WeakPolarHBondContact O-CB 3.49Å; D328-W380 PolarHBondContact O-N 3.37Å; A330-W380 HydrophobicContact CB-CE3 4.11Å; T378-W380 PolarHBondContact O-N 3.38Å; W380-E382 VanDerWaalsContact CD1-CD 3.4Å; W380-E382 PolarHBondContact NE1-OE1 3.4Å; W380-E382 VanDerWaalsContact NE1-OE1 3.12Å; W380-E382 PolarHBondContact NE1-OE2 3.42Å
381	C	91.2	Very high	91.1	Very high	16 Å²	16	44.1 Å²	44.1	11%	0.108	22%	0.223	C	C	.	.			trans	-117.2	118.2	173	-75	0	0	0	0	108.5	L363 G383	L363-C381 WeakPolarHBondContact CD1-SG 3.45Å; C381-G383 VanDerWaalsContact C-N 3.29Å; C381-G383 PolarHBondContact O-N 3.46Å
382	E	86.6	Confident	91.3	Very high	97 Å²	97	40 Å²	40	45%	0.453	21%	0.211	S	C	.	.	S	Bend	trans	-71.1	-22.2	179.7	-65	-62.6	168.1	0	0	113.9	K322 W380 E435	K322-E382 IonicContact NZ-OE1 2.71Å; W380-E382 VanDerWaalsContact CD1-CD 3.4Å; W380-E382 PolarHBondContact NE1-OE1 3.4Å; W380-E382 VanDerWaalsContact NE1-OE1 3.12Å; W380-E382 PolarHBondContact NE1-OE2 3.42Å; E382-E435 HydrophobicContact CB-CG 4.3Å
383	G	84	Confident	91.6	Very high	30 Å²	30	39.7 Å²	39.7	31%	0.309	21%	0.208	S	C	.	.	S	Bend	trans	-85	-171.9	175.1	0	0	0	0	0	114.1	C381 L433	C381-G383 VanDerWaalsContact C-N 3.29Å; C381-G383 PolarHBondContact O-N 3.46Å; G383-L433 VanDerWaalsContact CA-O 3.28Å; G383-L433 WeakPolarHBondContact CA-O 3.42Å
384	S	90.1	Very high	91.7	Very high	51 Å²	51	43.7 Å²	43.7	36%	0.357	23%	0.225	S	C	.	.			trans	-108.1	168.7	-176.9	-69.9	0	0	0	0	112.6	L433	S384-L433 PolarHBondContact O-N 2.91Å
385	S	93.6	Very high	91.6	Very high	22 Å²	22	45.1 Å²	45.1	15%	0.154	23%	0.234	C	C	.	.	B	Isolated β-bridge	trans	-65.7	151	170.6	63.7	0	0	0	0	111.2	Y387 R388 H389 N429 I431	S385-Y387 PolarHBondContact O-N 3.25Å; S385-R388 WeakPolarHBondContact O-CB 3.3Å; S385-R388 PolarHBondContact O-N 3.18Å; S385-R388 PolarHBondContact OG-N 3.43Å; S385-H389 PolarHBondContact O-CD2 3.42Å; S385-H389 PolarHBondContact O-N 3.13Å; S385-N429 WeakPolarHBondContact CB-O 3.42Å; S385-I431 CarbonylContact C-O 3.51Å; S385-I431 VanDerWaalsContact CA-O 3.32Å; S385-I431 WeakPolarHBondContact CA-O 3.48Å
386	L	95.8	Very high	91.3	Very high	0 Å²	0	55 Å²	55	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-56.6	-38.1	174.4	178	61.4	0	0	0	110.6	R388 H389 L390 V405 S428 I431 L433 V494 L498	L386-R388 VanDerWaalsContact C-N 3.35Å; L386-R388 PolarHBondContact O-N 3.04Å; L386-H389 PolarHBondContact O-N 3.26Å; L386-L390 HydrophobicContact CD1-CD1 3.87Å; L386-L390 HydrophobicContact CD1-CD2 4.48Å; L386-L390 HydrophobicContact CD1-CG 3.93Å; L386-L390 HydrophobicContact CD2-CD1 4.37Å; L386-L390 HydrophobicContact CG-CD1 3.8Å; L386-L390 HydrophobicContact CG-CG 4.26Å; L386-L390 WeakPolarHBondContact O-CG 3.49Å; L386-L390 PolarHBondContact O-N 3.4Å; L386-V405 HydrophobicContact CD1-CG1 4.26Å; L386-V405 HydrophobicContact CD2-CG1 4.23Å; L386-S428 PolarHBondContact N-O 3.29Å; L386-I431 HydrophobicContact CB-CB 4.11Å; L386-I431 HydrophobicContact CB-CG2 4.1Å; L386-I431 HydrophobicContact CD2-CB 4.44Å; L386-I431 HydrophobicContact CD2-CD1 4.33Å; L386-I431 HydrophobicContact CD2-CG2 4.16Å; L386-I431 PolarHBondContact N-O 3.31Å; L386-L433 HydrophobicContact CD1-CD1 4.1Å; L386-V494 HydrophobicContact CD2-CG1 3.96Å; L386-L498 HydrophobicContact CD1-CD2 3.8Å; L386-L498 HydrophobicContact CD2-CD1 4.4Å; L386-L498 HydrophobicContact CD2-CD2 4.06Å; L386-L498 HydrophobicContact CD2-CG 4.19Å; L386-L498 HydrophobicContact CG-CD2 4.47Å
387	Y	94.3	Very high	91	Very high	67 Å²	67	55.3 Å²	55.3	26%	0.263	28%	0.278	S	S	.	.	H	α-helix	trans	-55.7	-46.5	173.8	-175.9	-84	0	0	0	112.4	S385 H389 L390 H391 V392 S428 N429 W468 L503	S385-Y387 PolarHBondContact O-N 3.25Å; Y387-H389 VanDerWaalsContact C-N 3.32Å; Y387-H389 PolarHBondContact O-N 2.85Å; Y387-L390 PolarHBondContact O-N 3.19Å; Y387-H391 AromaticContact CD2-CD2 3.58Å; Y387-H391 HydrophobicContact CE1-CB 4.38Å; Y387-H391 AromaticContact CE2-CD2 3.72Å; Y387-H391 PolarHBondContact O-N 3.16Å; Y387-V392 HydrophobicContact CD1-CG2 4.33Å; Y387-V392 HydrophobicContact CE1-CG2 4.11Å; Y387-S428 WeakPolarHBondContact CD2-OG 3.39Å; Y387-S428 PolarHBondContact N-O 3.26Å; Y387-N429 WeakPolarHBondContact CD2-OD1 3.39Å; Y387-N429 VanDerWaalsContact CG-ND2 3.3Å; Y387-W468 HydrophobicContact CD2-CH2 4.36Å; Y387-W468 HydrophobicContact CE2-CH2 4.29Å; Y387-L503 HydrophobicContact CE2-CD1 4.12Å; Y387-L503 HydrophobicContact CE2-CD2 4.03Å
388	R	92.5	Very high	90.7	Very high	127 Å²	127	59.8 Å²	59.8	48%	0.479	30%	0.302	S	S	.	.	H	α-helix	trans	-60.1	-45.6	178	-178	89.9	178.8	169.4	3.8	110.2	S385 L386 V392 T393	S385-R388 WeakPolarHBondContact O-CB 3.3Å; S385-R388 PolarHBondContact O-N 3.18Å; S385-R388 PolarHBondContact OG-N 3.43Å; L386-R388 VanDerWaalsContact C-N 3.35Å; L386-R388 PolarHBondContact O-N 3.04Å; R388-V392 HydrophobicContact CG-CB 4.4Å; R388-V392 WeakPolarHBondContact O-CA 3.44Å; R388-V392 WeakPolarHBondContact O-CB 3.46Å; R388-V392 PolarHBondContact O-N 3.21Å; R388-V392 VanDerWaalsContact O-N 3.12Å; R388-T393 PolarHBondContact O-N 3.07Å
389	H	93.8	Very high	90.4	Very high	30 Å²	30	60 Å²	60	14%	0.139	30%	0.304	C	S	.	.	H	α-helix	trans	-64.5	-42.1	180	-77.8	-74.9	0	0	0	112.9	S385 L386 Y387 E394 T395 F397	S385-H389 PolarHBondContact O-CD2 3.42Å; S385-H389 PolarHBondContact O-N 3.13Å; L386-H389 PolarHBondContact O-N 3.26Å; Y387-H389 VanDerWaalsContact C-N 3.32Å; Y387-H389 PolarHBondContact O-N 2.85Å; H389-E394 CarbonylContact O-C 3.49Å; H389-E394 WeakPolarHBondContact O-CA 3.39Å; H389-E394 PolarHBondContact O-N 3.48Å; H389-E394 VanDerWaalsContact O-N 3.13Å; H389-T395 PolarHBondContact ND1-OG1 2.94Å; H389-T395 PolarHBondContact O-N 3.29Å; H389-F397 HydrophobicContact CB-CE2 3.77Å; H389-F397 HydrophobicContact CB-CZ 3.67Å
390	L	92.8	Very high	90.1	Very high	12 Å²	12	61.4 Å²	61.4	6%	0.063	31%	0.311	C	S	.	.	H	α-helix	trans	-77.1	-46	-177	-65.9	176.1	0	0	0	112.8	L386 Y387 F397 E497 L498	L386-L390 HydrophobicContact CD1-CD1 3.87Å; L386-L390 HydrophobicContact CD1-CD2 4.48Å; L386-L390 HydrophobicContact CD1-CG 3.93Å; L386-L390 HydrophobicContact CD2-CD1 4.37Å; L386-L390 HydrophobicContact CG-CD1 3.8Å; L386-L390 HydrophobicContact CG-CG 4.26Å; L386-L390 WeakPolarHBondContact O-CG 3.49Å; L386-L390 PolarHBondContact O-N 3.4Å; Y387-L390 PolarHBondContact O-N 3.19Å; L390-F397 HydrophobicContact CD2-CD2 3.85Å; L390-F397 HydrophobicContact CD2-CE2 3.78Å; L390-F397 HydrophobicContact CG-CE2 4.49Å; L390-E497 HydrophobicContact CD1-CB 3.94Å; L390-L498 HydrophobicContact CD1-CD2 4.28Å; L390-L498 HydrophobicContact CD1-CG 4.44Å; L390-L498 HydrophobicContact CD2-CD2 4.49Å
391	H	92.3	Very high	90	Very high	40 Å²	40	62.9 Å²	62.9	19%	0.185	32%	0.316	C	S	.	.	H	α-helix	trans	-115.1	-3.3	-163.6	-51.3	-61.9	0	0	0	114.8	Y387 E497	Y387-H391 AromaticContact CD2-CD2 3.58Å; Y387-H391 HydrophobicContact CE1-CB 4.38Å; Y387-H391 AromaticContact CE2-CD2 3.72Å; Y387-H391 PolarHBondContact O-N 3.16Å; H391-E497 IonicContact CD2-OE1 2.76Å; H391-E497 IonicContact CE1-OE1 2.91Å; H391-E497 IonicContact NE2-OE1 2.73Å; H391-E497 PolarHBondContact NE2-OE1 2.9Å
392	V	91.9	Very high	90.1	Very high	74 Å²	74	64.3 Å²	64.3	45%	0.448	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.8	-49.8	-179.4	-175.2	0	0	0	0	111.8	Y387 R388	Y387-V392 HydrophobicContact CD1-CG2 4.33Å; Y387-V392 HydrophobicContact CE1-CG2 4.11Å; R388-V392 HydrophobicContact CG-CB 4.4Å; R388-V392 WeakPolarHBondContact O-CA 3.44Å; R388-V392 WeakPolarHBondContact O-CB 3.46Å; R388-V392 PolarHBondContact O-N 3.21Å; R388-V392 VanDerWaalsContact O-N 3.12Å
393	T	90.3	Very high	90.4	Very high	82 Å²	82	59.7 Å²	59.7	50%	0.503	30%	0.298	S	S	.	.	S	Bend	trans	-91.9	-15.3	178.1	-54.5	0	0	0	0	111.6	R388 T395	R388-T393 PolarHBondContact O-N 3.07Å; T393-T395 PolarHBondContact O-N 3.08Å
394	E	88.7	Confident	90.9	Very high	151 Å²	151	59.6 Å²	59.6	71%	0.706	29%	0.29	S	S	*	.			trans	48.3	44.8	-178.2	-61	-177.4	-175.1	0	0	112	H389 K396	H389-E394 CarbonylContact O-C 3.49Å; H389-E394 WeakPolarHBondContact O-CA 3.39Å; H389-E394 PolarHBondContact O-N 3.48Å; H389-E394 VanDerWaalsContact O-N 3.13Å; E394-K396 PolarHBondContact O-N 3.24Å
395	T	88.5	Confident	91.2	Very high	40 Å²	40	57.2 Å²	57.2	25%	0.245	27%	0.274	C	S	.	.			trans	-59.1	125.7	-179.7	-55	0	0	0	0	109.4	H389 T393 F397 W437	H389-T395 PolarHBondContact ND1-OG1 2.94Å; H389-T395 PolarHBondContact O-N 3.29Å; T393-T395 PolarHBondContact O-N 3.08Å; T395-F397 HydrophobicContact CG2-CE2 4.35Å; T395-F397 HydrophobicContact CG2-CZ 4.27Å; T395-F397 WeakPolarHBondContact O-CD2 3.5Å; T395-F397 PolarHBondContact O-N 3.09Å; T395-W437 HydrophobicContact CG2-CH2 4.21Å
396	K	85.1	Confident	91.4	Very high	208 Å²	208	56.1 Å²	56.1	90%	0.904	27%	0.266	S	S	*	.			trans	-75.3	98.5	179.9	-66.7	-174.1	179.3	-179.6	0	110.6	E394	E394-K396 PolarHBondContact O-N 3.24Å
397	F	85.1	Confident	91.4	Very high	14 Å²	14	58 Å²	58	6%	0.061	27%	0.273	C	S	.	.			trans	-85.9	129.3	170	-63	-80.2	0	0	0	111.1	H389 L390 T395 R401 R402 L433 W437	H389-F397 HydrophobicContact CB-CE2 3.77Å; H389-F397 HydrophobicContact CB-CZ 3.67Å; L390-F397 HydrophobicContact CD2-CD2 3.85Å; L390-F397 HydrophobicContact CD2-CE2 3.78Å; L390-F397 HydrophobicContact CG-CE2 4.49Å; T395-F397 HydrophobicContact CG2-CE2 4.35Å; T395-F397 HydrophobicContact CG2-CZ 4.27Å; T395-F397 WeakPolarHBondContact O-CD2 3.5Å; T395-F397 PolarHBondContact O-N 3.09Å; F397-R401 HydrophobicContact CD1-CB 4.3Å; F397-R401 HydrophobicContact CD1-CG 3.59Å; F397-R401 HydrophobicContact CE1-CG 4.16Å; F397-R402 HydrophobicContact CB-CG 3.55Å; F397-R402 HydrophobicContact CG-CG 4.43Å; F397-R402 PolarHBondContact O-NE 2.9Å; F397-R402 PolarHBondContact O-NH2 3.31Å; F397-L433 HydrophobicContact CE1-CD1 3.93Å; F397-L433 HydrophobicContact CZ-CD1 3.71Å; F397-W437 HydrophobicContact CD1-CZ3 4.33Å; F397-W437 AromaticContact CE1-CE3 3.93Å; F397-W437 HydrophobicContact CE1-CE3 3.93Å; F397-W437 AromaticContact CE1-CH2 3.97Å; F397-W437 HydrophobicContact CE1-CH2 3.97Å; F397-W437 AromaticContact CE1-CZ3 3.34Å; F397-W437 HydrophobicContact CE1-CZ3 3.34Å; F397-W437 AromaticContact CZ-CZ3 3.93Å; F397-W437 HydrophobicContact CZ-CZ3 3.93Å
398	D	87.7	Confident	91.6	Very high	94 Å²	94	55.7 Å²	55.7	50%	0.503	27%	0.265	S	S	.	.			trans	-69.6	160.6	164.7	74.5	-22.4	0	0	0	110.7	M400 R401 R402	D398-M400 PolarHBondContact O-N 3.45Å; D398-R401 PolarHBondContact O-N 3.36Å; D398-R401 WeakPolarHBondContact OD1-CA 3.47Å; D398-R401 WeakPolarHBondContact OD1-CB 3.36Å; D398-R401 PolarHBondContact OD1-N 3.11Å; D398-R402 WeakPolarHBondContact O-CG 3.29Å; D398-R402 PolarHBondContact O-N 3.29Å
399	T	87.1	Confident	91.9	Very high	31 Å²	31	49.6 Å²	49.6	19%	0.19	24%	0.242	C	C	.	.	H	α-helix	trans	-59.8	-36.6	-175.7	-51.4	0	0	0	0	111.7	R402 I403 M570	T399-R402 PolarHBondContact O-N 3.17Å; T399-I403 HydrophobicContact CG2-CD1 3.95Å; T399-I403 VanDerWaalsContact O-CG1 3.29Å; T399-I403 WeakPolarHBondContact O-CG1 3.44Å; T399-I403 PolarHBondContact O-N 3.1Å; T399-M570 HydrophobicContact CG2-CE 3.52Å; T399-M570 HydrophobicContact CG2-SD 4.49Å
400	M	88.3	Confident	92.1	Very high	57 Å²	57	48.2 Å²	48.2	28%	0.281	24%	0.235	S	C	.	.	H	α-helix	trans	-64.8	-44	178.3	-70.4	-60.7	-80.1	0	0	112	D398 R402 I403 D404 M570	D398-M400 PolarHBondContact O-N 3.45Å; M400-R402 PolarHBondContact O-N 3.35Å; M400-I403 PolarHBondContact O-N 3.05Å; M400-D404 WeakPolarHBondContact O-CB 3.18Å; M400-D404 PolarHBondContact O-N 3.37Å; M400-M570 HydrophobicContact CE-CB 4.19Å; M400-M570 HydrophobicContact CG-CE 4.23Å; M400-M570 HydrophobicContact SD-CB 3.46Å; M400-M570 WeakPolarHBondContact SD-CB 3.47Å; M400-M570 HydrophobicContact SD-CE 3.65Å; M400-M570 HydrophobicContact SD-CG 3.65Å
401	R	91.1	Very high	92.4	Very high	77 Å²	77	49.8 Å²	49.8	29%	0.291	24%	0.242	S	C	.	.	H	α-helix	trans	-64.7	-39.7	175.6	-174.5	63	64.9	176.9	8	112	F397 D398 I403 D404 V405 W437	F397-R401 HydrophobicContact CD1-CB 4.3Å; F397-R401 HydrophobicContact CD1-CG 3.59Å; F397-R401 HydrophobicContact CE1-CG 4.16Å; D398-R401 PolarHBondContact O-N 3.36Å; D398-R401 WeakPolarHBondContact OD1-CA 3.47Å; D398-R401 WeakPolarHBondContact OD1-CB 3.36Å; D398-R401 PolarHBondContact OD1-N 3.11Å; R401-I403 VanDerWaalsContact C-N 3.34Å; R401-I403 PolarHBondContact O-N 3.3Å; R401-D404 PolarHBondContact O-N 2.81Å; R401-V405 HydrophobicContact CG-CG2 4.43Å; R401-V405 WeakPolarHBondContact O-CG2 3.45Å; R401-V405 PolarHBondContact O-N 3.08Å; R401-W437 VanDerWaalsContact CZ-CD1 3.41Å
402	R	93	Very high	92.6	Very high	46 Å²	46	47.9 Å²	47.9	17%	0.174	23%	0.233	C	C	.	.	H	α-helix	trans	-60.4	-44.6	176.4	-63.5	171.8	-174.3	-149.8	10.2	111.4	F397 D398 T399 M400 A406 L498 M499	F397-R402 HydrophobicContact CB-CG 3.55Å; F397-R402 HydrophobicContact CG-CG 4.43Å; F397-R402 PolarHBondContact O-NE 2.9Å; F397-R402 PolarHBondContact O-NH2 3.31Å; D398-R402 WeakPolarHBondContact O-CG 3.29Å; D398-R402 PolarHBondContact O-N 3.29Å; T399-R402 PolarHBondContact O-N 3.17Å; M400-R402 PolarHBondContact O-N 3.35Å; R402-A406 WeakPolarHBondContact O-CB 3.45Å; R402-A406 PolarHBondContact O-N 3.37Å; R402-L498 VanDerWaalsContact CD-O 3.28Å; R402-L498 WeakPolarHBondContact CD-O 3.33Å; R402-L498 PolarHBondContact NH1-O 2.85Å; R402-M499 HydrophobicContact CB-CE 3.53Å; R402-M499 HydrophobicContact CB-SD 4.4Å
403	I	92.9	Very high	92.9	Very high	1 Å²	1	44.3 Å²	44.3	1%	0.005	21%	0.212	C	C	.	.	H	α-helix	trans	-64.3	-41.4	176.4	-67.7	165.8	0	0	0	110.8	T399 M400 R401 A406 R407 P535 M538 I563 V566 Q567 M570	T399-I403 HydrophobicContact CG2-CD1 3.95Å; T399-I403 VanDerWaalsContact O-CG1 3.29Å; T399-I403 WeakPolarHBondContact O-CG1 3.44Å; T399-I403 PolarHBondContact O-N 3.1Å; M400-I403 PolarHBondContact O-N 3.05Å; R401-I403 VanDerWaalsContact C-N 3.34Å; R401-I403 PolarHBondContact O-N 3.3Å; I403-A406 WeakPolarHBondContact O-CB 3.37Å; I403-A406 PolarHBondContact O-N 3.22Å; I403-R407 WeakPolarHBondContact O-CB 3.38Å; I403-R407 PolarHBondContact O-N 3.02Å; I403-P535 HydrophobicContact CD1-CG 4.32Å; I403-M538 HydrophobicContact CG1-CE 4.03Å; I403-I563 HydrophobicContact CG2-CG2 4.16Å; I403-V566 HydrophobicContact CD1-CG1 4.03Å; I403-Q567 HydrophobicContact CG2-CB 4.11Å; I403-Q567 HydrophobicContact CG2-CG 4.47Å; I403-M570 HydrophobicContact CD1-CE 3.91Å; I403-M570 HydrophobicContact CD1-CG 3.78Å; I403-M570 HydrophobicContact CD1-SD 3.86Å
404	D	94	Very high	93.3	Very high	28 Å²	28	42.5 Å²	42.5	15%	0.15	20%	0.199	C	C	.	.	H	α-helix	trans	-66.5	-42.2	178.9	-174.7	58.3	0	0	0	112.4	M400 R401 A406 R407 Q408	M400-D404 WeakPolarHBondContact O-CB 3.18Å; M400-D404 PolarHBondContact O-N 3.37Å; R401-D404 PolarHBondContact O-N 2.81Å; D404-A406 VanDerWaalsContact C-N 3.34Å; D404-A406 PolarHBondContact O-N 2.84Å; D404-R407 PolarHBondContact O-N 2.85Å; D404-R407 IonicContact OD1-CZ 2.63Å; D404-R407 IonicContact OD1-NE 2.82Å; D404-R407 PolarHBondContact OD1-NE 2.99Å; D404-R407 IonicContact OD1-NH2 2.91Å; D404-R407 PolarHBondContact OD1-NH2 3.4Å; D404-Q408 WeakPolarHBondContact O-CB 3.49Å; D404-Q408 WeakPolarHBondContact O-CG 3.42Å; D404-Q408 PolarHBondContact O-N 3Å; D404-Q408 PolarHBondContact OD2-NE2 3.21Å
405	V	96.3	Very high	93.7	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-61.3	-43.3	172.8	171.2	0	0	0	0	110.9	L386 R401 R407 T409 L433 V439 L498	L386-V405 HydrophobicContact CD1-CG1 4.26Å; L386-V405 HydrophobicContact CD2-CG1 4.23Å; R401-V405 HydrophobicContact CG-CG2 4.43Å; R401-V405 WeakPolarHBondContact O-CG2 3.45Å; R401-V405 PolarHBondContact O-N 3.08Å; V405-R407 PolarHBondContact O-N 3.32Å; V405-T409 WeakPolarHBondContact O-CB 3.33Å; V405-T409 PolarHBondContact O-N 3.39Å; V405-T409 PolarHBondContact O-OG1 3.44Å; V405-L433 HydrophobicContact CG1-CD2 4.05Å; V405-L433 HydrophobicContact CG2-CD2 3.91Å; V405-V439 HydrophobicContact CB-CG2 4.34Å; V405-V439 HydrophobicContact CG1-CG2 3.94Å; V405-V439 HydrophobicContact CG2-CG2 4.43Å; V405-L498 HydrophobicContact CB-CD2 4.43Å; V405-L498 HydrophobicContact CG1-CD1 4.23Å; V405-L498 HydrophobicContact CG1-CD2 4.05Å
406	A	97.2	Very high	93.9	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-58.6	-47.3	174.7	0	0	0	0	0	111.7	R402 I403 D404 T409 A410 Y491 L495 L498	R402-A406 WeakPolarHBondContact O-CB 3.45Å; R402-A406 PolarHBondContact O-N 3.37Å; I403-A406 WeakPolarHBondContact O-CB 3.37Å; I403-A406 PolarHBondContact O-N 3.22Å; D404-A406 VanDerWaalsContact C-N 3.34Å; D404-A406 PolarHBondContact O-N 2.84Å; A406-T409 PolarHBondContact O-N 2.98Å; A406-A410 PolarHBondContact O-N 3.41Å; A406-Y491 PolarHBondContact O-OH 3.31Å; A406-L495 HydrophobicContact CB-CD2 3.45Å; A406-L495 VanDerWaalsContact CB-CD2 3.45Å; A406-L498 HydrophobicContact CB-CD1 4.12Å
407	R	97.3	Very high	94.4	Very high	40 Å²	40	26.3 Å²	26.3	15%	0.151	12%	0.122	C	C	.	.	H	α-helix	trans	-60.8	-53.1	178.3	-172.3	-172.4	63.1	73.2	8.7	111.5	I403 D404 V405 T409 A410 Q411 I563	I403-R407 WeakPolarHBondContact O-CB 3.38Å; I403-R407 PolarHBondContact O-N 3.02Å; D404-R407 PolarHBondContact O-N 2.85Å; D404-R407 IonicContact OD1-CZ 2.63Å; D404-R407 IonicContact OD1-NE 2.82Å; D404-R407 PolarHBondContact OD1-NE 2.99Å; D404-R407 IonicContact OD1-NH2 2.91Å; D404-R407 PolarHBondContact OD1-NH2 3.4Å; V405-R407 PolarHBondContact O-N 3.32Å; R407-T409 VanDerWaalsContact C-N 3.28Å; R407-T409 PolarHBondContact O-N 3.23Å; R407-A410 WeakPolarHBondContact O-CB 3.43Å; R407-A410 PolarHBondContact O-N 2.68Å; R407-A410 VanDerWaalsContact O-N 3.11Å; R407-Q411 WeakPolarHBondContact O-CG 3.39Å; R407-Q411 PolarHBondContact O-N 2.74Å; R407-I563 HydrophobicContact CB-CG2 3.66Å; R407-I563 HydrophobicContact CG-CG2 4.11Å
408	Q	98.1	Very high	94.8	Very high	17 Å²	17	29.7 Å²	29.7	8%	0.079	15%	0.153	C	C	.	.	H	α-helix	trans	-60.6	-37.5	179.8	-72.4	-170.9	58.5	0	0	112.1	N361 D404 Q411 G412 W437 V439	N361-Q408 WeakPolarHBondContact CB-O 3.5Å; N361-Q408 VanDerWaalsContact CG-O 3.3Å; N361-Q408 PolarHBondContact ND2-OE1 2.89Å; N361-Q408 PolarHBondContact OD1-O 3.47Å; D404-Q408 WeakPolarHBondContact O-CB 3.49Å; D404-Q408 WeakPolarHBondContact O-CG 3.42Å; D404-Q408 PolarHBondContact O-N 3Å; D404-Q408 PolarHBondContact OD2-NE2 3.21Å; Q408-Q411 PolarHBondContact O-N 3.15Å; Q408-G412 PolarHBondContact O-N 3.04Å; Q408-G412 VanDerWaalsContact O-N 3.09Å; Q408-W437 PolarHBondContact NE2-O 3.34Å; Q408-V439 HydrophobicContact CB-CB 3.75Å; Q408-V439 HydrophobicContact CB-CG2 3.63Å; Q408-V439 HydrophobicContact CG-CG2 4.5Å
409	T	98.4	Very high	94.9	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-63.6	-45.2	173.7	-56	0	0	0	0	111	V405 A406 R407 Q411 G412 M413 I431 I441 Y491	V405-T409 WeakPolarHBondContact O-CB 3.33Å; V405-T409 PolarHBondContact O-N 3.39Å; V405-T409 PolarHBondContact O-OG1 3.44Å; A406-T409 PolarHBondContact O-N 2.98Å; R407-T409 VanDerWaalsContact C-N 3.28Å; R407-T409 PolarHBondContact O-N 3.23Å; T409-Q411 VanDerWaalsContact C-N 3.28Å; T409-Q411 PolarHBondContact O-N 3.33Å; T409-G412 PolarHBondContact O-N 3.19Å; T409-M413 WeakPolarHBondContact O-CG 3.46Å; T409-M413 PolarHBondContact O-N 3.37Å; T409-I431 HydrophobicContact CG2-CD1 3.7Å; T409-I431 HydrophobicContact CG2-CG1 4.39Å; T409-I441 HydrophobicContact CG2-CD1 4.12Å; T409-I441 WeakPolarHBondContact O-CD1 3.44Å; T409-Y491 HydrophobicContact CG2-CD2 3.87Å; T409-Y491 HydrophobicContact CG2-CE2 3.72Å
410	A	98.4	Very high	95.1	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-62	-35.2	175	0	0	0	0	0	112.3	A406 R407 M413 D414 Y491 F556 I559 L560 I563	A406-A410 PolarHBondContact O-N 3.41Å; R407-A410 WeakPolarHBondContact O-CB 3.43Å; R407-A410 PolarHBondContact O-N 2.68Å; R407-A410 VanDerWaalsContact O-N 3.11Å; A410-M413 PolarHBondContact O-N 3.43Å; A410-D414 WeakPolarHBondContact O-CB 3.48Å; A410-D414 PolarHBondContact O-N 2.95Å; A410-Y491 HydrophobicContact CB-CE2 4.32Å; A410-F556 HydrophobicContact CB-CD1 3.99Å; A410-F556 HydrophobicContact CB-CE1 4.33Å; A410-I559 HydrophobicContact CB-CG2 4.18Å; A410-L560 HydrophobicContact CB-CD2 3.56Å; A410-L560 HydrophobicContact CB-CG 4Å; A410-I563 HydrophobicContact CB-CD1 4.04Å
411	Q	98.2	Very high	95.1	Very high	45 Å²	45	33.4 Å²	33.4	21%	0.21	17%	0.167	C	C	.	.	H	α-helix	trans	-64.8	-44.3	177	-71.6	-177.2	-51.5	0	0	111.7	R407 Q408 T409 Y415 L560	R407-Q411 WeakPolarHBondContact O-CG 3.39Å; R407-Q411 PolarHBondContact O-N 2.74Å; Q408-Q411 PolarHBondContact O-N 3.15Å; T409-Q411 VanDerWaalsContact C-N 3.28Å; T409-Q411 PolarHBondContact O-N 3.33Å; Q411-Y415 PolarHBondContact O-N 3.28Å; Q411-Y415 VanDerWaalsContact O-N 3.11Å; Q411-L560 HydrophobicContact CB-CD2 4.36Å; Q411-L560 HydrophobicContact CG-CD1 4.44Å; Q411-L560 HydrophobicContact CG-CD2 3.53Å
412	G	97.5	Very high	95	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-61.6	-44.5	174.5	0	0	0	0	0	112.2	I362 Q408 T409 Y415 L416	I362-G412 WeakPolarHBondContact CD1-O 3.04Å; Q408-G412 PolarHBondContact O-N 3.04Å; Q408-G412 VanDerWaalsContact O-N 3.09Å; T409-G412 PolarHBondContact O-N 3.19Å; G412-Y415 WeakPolarHBondContact O-CB 3.43Å; G412-Y415 PolarHBondContact O-N 3.3Å; G412-L416 PolarHBondContact O-N 3.44Å; G412-L416 VanDerWaalsContact O-N 3.08Å
413	M	98	Very high	94.9	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-68.8	-38.5	179.8	-72.1	-52.4	-63.5	0	0	113.5	T409 A410 Y415 L416 H417 H423 L426 I441 D487 F556	T409-M413 WeakPolarHBondContact O-CG 3.46Å; T409-M413 PolarHBondContact O-N 3.37Å; A410-M413 PolarHBondContact O-N 3.43Å; M413-Y415 VanDerWaalsContact C-N 3.3Å; M413-Y415 PolarHBondContact O-N 2.92Å; M413-L416 PolarHBondContact O-N 3.01Å; M413-L416 HydrophobicContact SD-CD1 3.94Å; M413-H417 PolarHBondContact O-N 3.45Å; M413-H423 HydrophobicContact CE-CB 3.7Å; M413-H423 HydrophobicContact SD-CB 4.29Å; M413-L426 HydrophobicContact CE-CD2 4.06Å; M413-L426 HydrophobicContact CG-CD1 4.4Å; M413-L426 HydrophobicContact CG-CD2 3.91Å; M413-L426 HydrophobicContact SD-CD1 3.9Å; M413-L426 HydrophobicContact SD-CD2 3.97Å; M413-L426 HydrophobicContact SD-CG 4.46Å; M413-I441 HydrophobicContact CG-CD1 3.85Å; M413-I441 HydrophobicContact SD-CD1 3.97Å; M413-I441 HydrophobicContact SD-CG2 4.4Å; M413-D487 HydrophobicContact CE-CB 3.81Å; M413-D487 WeakPolarHBondContact CE-OD2 2.98Å; M413-F556 HydrophobicContact CB-CD1 3.66Å; M413-F556 HydrophobicContact CB-CD2 3.77Å; M413-F556 HydrophobicContact CB-CE1 3.38Å; M413-F556 HydrophobicContact CB-CE2 3.49Å; M413-F556 VanDerWaalsContact CB-CE2 3.49Å; M413-F556 HydrophobicContact CB-CG 3.85Å; M413-F556 HydrophobicContact CB-CZ 3.28Å; M413-F556 HydrophobicContact CE-CE2 4.08Å; M413-F556 HydrophobicContact CE-CZ 4.29Å; M413-F556 HydrophobicContact CG-CE1 3.9Å; M413-F556 HydrophobicContact CG-CE2 4.12Å; M413-F556 HydrophobicContact CG-CZ 3.6Å
414	D	97.8	Very high	94.7	Very high	44 Å²	44	31.6 Å²	31.6	24%	0.235	16%	0.162	C	C	.	.	H	α-helix	trans	-58.2	-45.2	172.6	-169.9	47.8	0	0	0	111.1	A410 L416 H417 A418 F556 P557 L560	A410-D414 WeakPolarHBondContact O-CB 3.48Å; A410-D414 PolarHBondContact O-N 2.95Å; D414-L416 VanDerWaalsContact C-N 3.35Å; D414-L416 PolarHBondContact O-N 2.94Å; D414-H417 PolarHBondContact O-N 3.5Å; D414-A418 VanDerWaalsContact O-CB 3.3Å; D414-A418 WeakPolarHBondContact O-CB 3.27Å; D414-A418 PolarHBondContact O-N 2.93Å; D414-F556 HydrophobicContact CB-CB 3.8Å; D414-P557 WeakPolarHBondContact OD1-CD 3.41Å; D414-P557 VanDerWaalsContact OD1-CG 3.23Å; D414-P557 WeakPolarHBondContact OD1-CG 3.35Å; D414-L560 HydrophobicContact CB-CD1 3.59Å
415	Y	96.8	Very high	94.3	Very high	41 Å²	41	31.5 Å²	31.5	16%	0.161	16%	0.162	C	C	.	.	H	α-helix	trans	-57.8	-44.6	174.7	172.9	-88.9	0	0	0	112.4	K356 T357 R358 H359 I362 Q411 G412 M413 K419	K356-Y415 PolarHBondContact O-OH 3.16Å; T357-Y415 WeakPolarHBondContact CA-OH 3.49Å; T357-Y415 HydrophobicContact CG2-CE1 4.28Å; R358-Y415 PolarHBondContact N-OH 3.48Å; H359-Y415 HydrophobicContact CB-CD1 3.72Å; H359-Y415 HydrophobicContact CB-CD2 3.86Å; H359-Y415 HydrophobicContact CB-CE1 3.99Å; H359-Y415 HydrophobicContact CB-CE2 4.09Å; H359-Y415 HydrophobicContact CB-CG 3.68Å; H359-Y415 AromaticContact CD2-CD2 3.82Å; H359-Y415 AromaticContact CD2-CG 3.95Å; H359-Y415 AromaticContact CG-CG 3.79Å; I362-Y415 HydrophobicContact CG1-CD1 3.95Å; Q411-Y415 PolarHBondContact O-N 3.28Å; Q411-Y415 VanDerWaalsContact O-N 3.11Å; G412-Y415 WeakPolarHBondContact O-CB 3.43Å; G412-Y415 PolarHBondContact O-N 3.3Å; M413-Y415 VanDerWaalsContact C-N 3.3Å; M413-Y415 PolarHBondContact O-N 2.92Å; Y415-K419 HydrophobicContact CE1-CG 4.22Å; Y415-K419 HydrophobicContact CE2-CG 4.47Å; Y415-K419 WeakPolarHBondContact O-CG 3.32Å; Y415-K419 PolarHBondContact O-N 3.13Å; Y415-K419 WeakPolarHBondContact OH-CE 3.36Å
416	L	94.3	Very high	94.2	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-63.8	-46.2	178	-69.7	178.2	0	0	0	111.4	T357 I362 G412 M413 D414 A418 K419 N420 I421 F444	T357-L416 HydrophobicContact CG2-CD2 4.2Å; I362-L416 HydrophobicContact CD1-CD1 3.81Å; I362-L416 HydrophobicContact CD1-CD2 4.05Å; I362-L416 HydrophobicContact CD1-CG 3.73Å; I362-L416 HydrophobicContact CG1-CD2 4.36Å; I362-L416 HydrophobicContact CG1-CG 4.42Å; G412-L416 PolarHBondContact O-N 3.44Å; G412-L416 VanDerWaalsContact O-N 3.08Å; M413-L416 PolarHBondContact O-N 3.01Å; M413-L416 HydrophobicContact SD-CD1 3.94Å; D414-L416 VanDerWaalsContact C-N 3.35Å; D414-L416 PolarHBondContact O-N 2.94Å; L416-A418 PolarHBondContact O-N 3.38Å; L416-K419 CarbonylContact O-C 3.56Å; L416-K419 WeakPolarHBondContact O-CA 3.27Å; L416-K419 WeakPolarHBondContact O-CB 3.28Å; L416-K419 PolarHBondContact O-N 2.79Å; L416-N420 PolarHBondContact O-N 3.12Å; L416-I421 CarbonylContact C-O 3.45Å; L416-I421 HydrophobicContact CB-CB 4.28Å; L416-I421 HydrophobicContact CD2-CB 4.4Å; L416-I421 HydrophobicContact CD2-CD1 4.23Å; L416-I421 HydrophobicContact CD2-CG2 4.29Å; L416-I421 WeakPolarHBondContact O-CB 3.32Å; L416-I421 PolarHBondContact O-N 3.41Å; L416-F444 HydrophobicContact CD1-CB 4.08Å; L416-F444 HydrophobicContact CD1-CD2 4.34Å; L416-F444 HydrophobicContact CD1-CG 4.08Å; L416-F444 HydrophobicContact CD2-CD2 3.81Å; L416-F444 HydrophobicContact CD2-CE2 3.89Å; L416-F444 HydrophobicContact CD2-CG 4.32Å; L416-F444 HydrophobicContact CD2-CZ 4.48Å
417	H	94.8	Very high	94	Very high	17 Å²	17	32.6 Å²	32.6	8%	0.079	17%	0.167	C	C	.	.	H	α-helix	trans	-66.6	-37.1	-179.6	-74.1	-163.2	0	0	0	112	M413 D414 K419 N420 I421 F484 D487 F556	M413-H417 PolarHBondContact O-N 3.45Å; D414-H417 PolarHBondContact O-N 3.5Å; H417-K419 PolarHBondContact O-N 3.19Å; H417-N420 WeakPolarHBondContact O-CA 3.44Å; H417-N420 PolarHBondContact O-N 2.81Å; H417-I421 PolarHBondContact CD2-O 3.15Å; H417-I421 VanDerWaalsContact CD2-O 3.31Å; H417-F484 HydrophobicContact CB-CD1 4.18Å; H417-F484 HydrophobicContact CB-CE1 4.22Å; H417-F484 HydrophobicContact CB-CG 4.48Å; H417-F484 AromaticContact CD2-CD1 3.66Å; H417-F484 VanDerWaalsContact CE1-CA 3.44Å; H417-F484 WeakPolarHBondContact CE1-CA 3.44Å; H417-F484 VanDerWaalsContact CE1-CB 3.5Å; H417-F484 WeakPolarHBondContact CE1-CB 3.46Å; H417-F484 AromaticContact CE1-CD1 3.73Å; H417-F484 AromaticContact CE1-CG 3.89Å; H417-F484 PolarHBondContact CE1-O 2.97Å; H417-F484 AromaticContact CG-CD1 3.57Å; H417-F484 AromaticContact CG-CG 3.95Å; H417-F484 WeakPolarHBondContact ND1-CB 3.42Å; H417-F484 AromaticContact ND1-CD1 3.61Å; H417-F484 AromaticContact ND1-CG 3.58Å; H417-F484 AromaticContact NE2-CD1 3.75Å; H417-D487 IonicContact CD2-OD2 3.81Å; H417-D487 IonicContact CE1-OD2 2.78Å; H417-D487 IonicContact NE2-OD2 3.92Å; H417-D487 PolarHBondContact NE2-OD2 2.92Å; H417-F556 AromaticContact CE1-CD2 3.46Å; H417-F556 VanDerWaalsContact CE1-CD2 3.46Å; H417-F556 WeakPolarHBondContact CE1-CD2 3.32Å; H417-F556 AromaticContact CE1-CE2 3.44Å; H417-F556 VanDerWaalsContact CE1-CE2 3.44Å; H417-F556 WeakPolarHBondContact CE1-CE2 3.47Å; H417-F556 AromaticContact ND1-CD2 3.39Å; H417-F556 WeakPolarHBondContact ND1-CD2 3.24Å; H417-F556 AromaticContact ND1-CE2 3.9Å
418	A	93.8	Very high	93.9	Very high	85 Å²	85	30.7 Å²	30.7	70%	0.702	16%	0.16	S	C	*	.	H	α-helix	trans	-62.4	-26.5	172.4	0	0	0	0	0	112.9	D414 L416 N420	D414-A418 VanDerWaalsContact O-CB 3.3Å; D414-A418 WeakPolarHBondContact O-CB 3.27Å; D414-A418 PolarHBondContact O-N 2.93Å; L416-A418 PolarHBondContact O-N 3.38Å; A418-N420 VanDerWaalsContact C-N 3.3Å
419	K	90.4	Very high	93.7	Very high	117 Å²	117	32.4 Å²	32.4	51%	0.509	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.6	6.7	171.7	-66.8	-73.6	179.8	177.2	0	113.2	Y415 L416 H417 I421	Y415-K419 HydrophobicContact CE1-CG 4.22Å; Y415-K419 HydrophobicContact CE2-CG 4.47Å; Y415-K419 WeakPolarHBondContact O-CG 3.32Å; Y415-K419 PolarHBondContact O-N 3.13Å; Y415-K419 WeakPolarHBondContact OH-CE 3.36Å; L416-K419 CarbonylContact O-C 3.56Å; L416-K419 WeakPolarHBondContact O-CA 3.27Å; L416-K419 WeakPolarHBondContact O-CB 3.28Å; L416-K419 PolarHBondContact O-N 2.79Å; H417-K419 PolarHBondContact O-N 3.19Å; K419-I421 VanDerWaalsContact C-N 3.3Å; K419-I421 HydrophobicContact CB-CD1 3.94Å; K419-I421 HydrophobicContact CB-CG1 4.09Å; K419-I421 PolarHBondContact O-N 3.45Å
420	N	89.6	Confident	93.4	Very high	129 Å²	129	32.9 Å²	32.9	69%	0.69	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.7	36.7	-176	-159.5	56.1	0	0	0	113.4	L416 H417 A418 F484	L416-N420 PolarHBondContact O-N 3.12Å; H417-N420 WeakPolarHBondContact O-CA 3.44Å; H417-N420 PolarHBondContact O-N 2.81Å; A418-N420 VanDerWaalsContact C-N 3.3Å; N420-F484 WeakPolarHBondContact OD1-CZ 3.49Å
421	I	88.6	Confident	93.3	Very high	15 Å²	15	32.9 Å²	32.9	8%	0.077	17%	0.172	C	C	.	.			trans	-107.5	122	177.9	-58.1	172.5	0	0	0	108.6	V353 T357 L416 H417 K419 F444	V353-I421 HydrophobicContact CG1-CD1 3.6Å; V353-I421 HydrophobicContact CG1-CG1 3.72Å; T357-I421 HydrophobicContact CG2-CD1 3.62Å; L416-I421 CarbonylContact C-O 3.45Å; L416-I421 HydrophobicContact CB-CB 4.28Å; L416-I421 HydrophobicContact CD2-CB 4.4Å; L416-I421 HydrophobicContact CD2-CD1 4.23Å; L416-I421 HydrophobicContact CD2-CG2 4.29Å; L416-I421 WeakPolarHBondContact O-CB 3.32Å; L416-I421 PolarHBondContact O-N 3.41Å; H417-I421 PolarHBondContact CD2-O 3.15Å; H417-I421 VanDerWaalsContact CD2-O 3.31Å; K419-I421 VanDerWaalsContact C-N 3.3Å; K419-I421 HydrophobicContact CB-CD1 3.94Å; K419-I421 HydrophobicContact CB-CG1 4.09Å; K419-I421 PolarHBondContact O-N 3.45Å; I421-F444 HydrophobicContact CG2-CD2 4.35Å
422	I	89.6	Confident	93.2	Very high	31 Å²	31	33.3 Å²	33.3	16%	0.159	17%	0.173	C	C	.	.			trans	-94.4	128.8	171.6	-53.5	169.4	0	0	0	107.6	R424 Y482 F484 D487	I422-R424 HydrophobicContact CB-CG 4.14Å; I422-R424 HydrophobicContact CG2-CG 3.66Å; I422-Y482 WeakPolarHBondContact CD1-O 3.39Å; I422-F484 HydrophobicContact CG1-CD1 3.79Å; I422-F484 HydrophobicContact CG1-CE1 3.76Å; I422-D487 WeakPolarHBondContact CG2-OD2 3.45Å
423	H	91.3	Very high	93.1	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.174	C	C	.	.			trans	-72	-44.4	-178.5	-173.8	-39.8	0	0	0	112	M413 D425 L426 I441 G442 F444 D487	M413-H423 HydrophobicContact CE-CB 3.7Å; M413-H423 HydrophobicContact SD-CB 4.29Å; H423-D425 VanDerWaalsContact CE1-C 3.46Å; H423-D425 PolarHBondContact CE1-O 3.39Å; H423-D425 VanDerWaalsContact CE1-O 3.24Å; H423-D425 PolarHBondContact ND1-N 3.14Å; H423-D425 PolarHBondContact O-N 3Å; H423-D425 VanDerWaalsContact O-N 3.11Å; H423-L426 PolarHBondContact ND1-N 3.45Å; H423-I441 WeakPolarHBondContact NE2-CG2 3.42Å; H423-G442 PolarHBondContact CE1-O 3.33Å; H423-G442 PolarHBondContact NE2-O 3.34Å; H423-G442 VanDerWaalsContact NE2-O 3.1Å; H423-F444 HydrophobicContact CB-CB 4.28Å; H423-D487 PolarHBondContact N-OD1 3.06Å; H423-D487 PolarHBondContact N-OD2 3.42Å
424	R	88.1	Confident	92.6	Very high	54 Å²	54	35.7 Å²	35.7	20%	0.204	18%	0.184	C	C	.	.	S	Bend	trans	68.2	-7.7	177.1	-48.3	177.3	178.7	-157.4	-3.3	117.2	I422 A447 T448 Y482 D487	I422-R424 HydrophobicContact CB-CG 4.14Å; I422-R424 HydrophobicContact CG2-CG 3.66Å; R424-A447 HydrophobicContact CB-CB 3.61Å; R424-A447 HydrophobicContact CG-CB 4.33Å; R424-T448 PolarHBondContact NE-OG1 3.47Å; R424-T448 PolarHBondContact NH1-OG1 2.82Å; R424-Y482 HydrophobicContact CB-CD1 3.62Å; R424-Y482 HydrophobicContact CB-CE1 3.91Å; R424-Y482 HydrophobicContact CB-CG 4.37Å; R424-Y482 HydrophobicContact CG-CD1 3.82Å; R424-Y482 HydrophobicContact CG-CG 4.11Å; R424-D487 PolarHBondContact N-OD1 3.49Å
425	D	86.7	Confident	92	Very high	27 Å²	27	39.7 Å²	39.7	14%	0.144	20%	0.202	C	C	.	.			trans	-146.6	40.2	179.2	-169.6	39.2	0	0	0	109.9	H423 K427 N430	H423-D425 VanDerWaalsContact CE1-C 3.46Å; H423-D425 PolarHBondContact CE1-O 3.39Å; H423-D425 VanDerWaalsContact CE1-O 3.24Å; H423-D425 PolarHBondContact ND1-N 3.14Å; H423-D425 PolarHBondContact O-N 3Å; H423-D425 VanDerWaalsContact O-N 3.11Å; D425-K427 PolarHBondContact O-N 2.75Å; D425-K427 IonicContact OD1-NZ 2.87Å; D425-K427 PolarHBondContact OD1-NZ 3.32Å; D425-K427 WeakPolarHBondContact OD2-CE 3.41Å; D425-K427 IonicContact OD2-NZ 3.92Å; D425-K427 PolarHBondContact OD2-NZ 2.9Å; D425-N430 PolarHBondContact O-ND2 2.98Å; D425-N430 PolarHBondContact OD2-ND2 3.08Å
426	L	93.8	Very high	91.3	Very high	6 Å²	6	41 Å²	41	3%	0.031	23%	0.227	C	C	.	.			trans	-71.3	119.4	177.3	-178.4	66.7	0	0	0	109.4	M413 H423 I431 I441 Y491	M413-L426 HydrophobicContact CE-CD2 4.06Å; M413-L426 HydrophobicContact CG-CD1 4.4Å; M413-L426 HydrophobicContact CG-CD2 3.91Å; M413-L426 HydrophobicContact SD-CD1 3.9Å; M413-L426 HydrophobicContact SD-CD2 3.97Å; M413-L426 HydrophobicContact SD-CG 4.46Å; H423-L426 PolarHBondContact ND1-N 3.45Å; L426-I431 HydrophobicContact CD1-CD1 4.16Å; L426-I431 HydrophobicContact CD1-CG1 4.24Å; L426-I441 HydrophobicContact CD1-CG2 4.21Å; L426-Y491 HydrophobicContact CD2-CD2 4.35Å
427	K	93.4	Very high	91	Very high	17 Å²	17	45.2 Å²	45.2	7%	0.074	24%	0.243	C	C	.	.	S	Bend	trans	-159.1	163	-180	60.7	-171.3	174.1	-149.3	0	110.7	D425 N429 N430 I431 S465 W468	D425-K427 PolarHBondContact O-N 2.75Å; D425-K427 IonicContact OD1-NZ 2.87Å; D425-K427 PolarHBondContact OD1-NZ 3.32Å; D425-K427 WeakPolarHBondContact OD2-CE 3.41Å; D425-K427 IonicContact OD2-NZ 3.92Å; D425-K427 PolarHBondContact OD2-NZ 2.9Å; K427-N429 HydrophobicContact CD-CB 4.3Å; K427-N429 HydrophobicContact CG-CB 4.12Å; K427-N429 PolarHBondContact O-N 3.13Å; K427-N429 VanDerWaalsContact O-N 3.1Å; K427-N430 WeakPolarHBondContact CE-ND2 3.21Å; K427-N430 HydrophobicContact CG-CB 4.27Å; K427-N430 PolarHBondContact O-N 2.66Å; K427-I431 PolarHBondContact O-N 3.12Å; K427-S465 WeakPolarHBondContact CD-OG 3.3Å; K427-S465 PolarHBondContact NZ-OG 3.4Å; K427-W468 HydrophobicContact CB-CB 4.39Å; K427-W468 HydrophobicContact CB-CD2 3.51Å; K427-W468 HydrophobicContact CB-CE3 4.04Å; K427-W468 HydrophobicContact CB-CG 3.67Å; K427-W468 HydrophobicContact CB-CZ2 4.21Å; K427-W468 HydrophobicContact CD-CE3 4.49Å
428	S	95.3	Very high	91	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-61.2	-21.3	-178.9	58.6	0	0	0	0	113.9	L386 Y387 N430 W468 E497	L386-S428 PolarHBondContact N-O 3.29Å; Y387-S428 WeakPolarHBondContact CD2-OG 3.39Å; Y387-S428 PolarHBondContact N-O 3.26Å; S428-N430 VanDerWaalsContact C-N 3.34Å; S428-W468 WeakPolarHBondContact OG-CZ2 3.5Å; S428-E497 WeakPolarHBondContact CB-OE1 3.39Å; S428-E497 PolarHBondContact OG-OE1 2.87Å; S428-E497 PolarHBondContact OG-OE2 3.48Å
429	N	92.3	Very high	91.2	Very high	53 Å²	53	42.2 Å²	42.2	28%	0.283	22%	0.218	S	C	.	.	G	3₁₀ helix	trans	-69.6	-28.5	172.3	-59.4	87.3	0	0	0	113.7	S385 Y387 K427	S385-N429 WeakPolarHBondContact CB-O 3.42Å; Y387-N429 WeakPolarHBondContact CD2-OD1 3.39Å; Y387-N429 VanDerWaalsContact CG-ND2 3.3Å; K427-N429 HydrophobicContact CD-CB 4.3Å; K427-N429 HydrophobicContact CG-CB 4.12Å; K427-N429 PolarHBondContact O-N 3.13Å; K427-N429 VanDerWaalsContact O-N 3.1Å
430	N	93.2	Very high	91.5	Very high	9 Å²	9	37.7 Å²	37.7	5%	0.048	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-97.5	1.8	-176.6	-68.2	-10	0	0	0	112.3	D425 K427 S428 G442 D443	D425-N430 PolarHBondContact O-ND2 2.98Å; D425-N430 PolarHBondContact OD2-ND2 3.08Å; K427-N430 WeakPolarHBondContact CE-ND2 3.21Å; K427-N430 HydrophobicContact CG-CB 4.27Å; K427-N430 PolarHBondContact O-N 2.66Å; S428-N430 VanDerWaalsContact C-N 3.34Å; N430-G442 PolarHBondContact O-N 2.78Å; N430-D443 HydrophobicContact CB-CB 4.46Å
431	I	96.6	Very high	91.8	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	118.1	174.8	-61.6	169.4	0	0	0	107	S385 L386 T409 L426 K427 V439 V494	S385-I431 CarbonylContact C-O 3.51Å; S385-I431 VanDerWaalsContact CA-O 3.32Å; S385-I431 WeakPolarHBondContact CA-O 3.48Å; L386-I431 HydrophobicContact CB-CB 4.11Å; L386-I431 HydrophobicContact CB-CG2 4.1Å; L386-I431 HydrophobicContact CD2-CB 4.44Å; L386-I431 HydrophobicContact CD2-CD1 4.33Å; L386-I431 HydrophobicContact CD2-CG2 4.16Å; L386-I431 PolarHBondContact N-O 3.31Å; T409-I431 HydrophobicContact CG2-CD1 3.7Å; T409-I431 HydrophobicContact CG2-CG1 4.39Å; L426-I431 HydrophobicContact CD1-CD1 4.16Å; L426-I431 HydrophobicContact CD1-CG1 4.24Å; K427-I431 PolarHBondContact O-N 3.12Å; I431-V439 HydrophobicContact CG2-CG1 3.74Å; I431-V494 HydrophobicContact CD1-CB 4.47Å; I431-V494 HydrophobicContact CD1-CG1 3.73Å; I431-V494 HydrophobicContact CD1-CG2 3.99Å
432	F	95.4	Very high	91.9	Very high	54 Å²	54	30.9 Å²	30.9	24%	0.237	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	140.2	179.9	-59.7	-92.1	0	0	0	110.3	V439 K440	F432-V439 CarbonylContact O-C 3.54Å; F432-V439 WeakPolarHBondContact O-CA 3.38Å; F432-K440 HydrophobicContact CB-CB 4.3Å; F432-K440 PolarHBondContact N-O 3.02Å; F432-K440 PolarHBondContact O-N 3.32Å
433	L	94.5	Very high	91.5	Very high	5 Å²	5	31.6 Å²	31.6	3%	0.026	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	97.9	170.6	-58.5	-177.9	0	0	0	107.2	G383 S384 L386 F397 V405 W437 V439	G383-L433 VanDerWaalsContact CA-O 3.28Å; G383-L433 WeakPolarHBondContact CA-O 3.42Å; S384-L433 PolarHBondContact O-N 2.91Å; L386-L433 HydrophobicContact CD1-CD1 4.1Å; F397-L433 HydrophobicContact CE1-CD1 3.93Å; F397-L433 HydrophobicContact CZ-CD1 3.71Å; V405-L433 HydrophobicContact CG1-CD2 4.05Å; V405-L433 HydrophobicContact CG2-CD2 3.91Å; L433-W437 HydrophobicContact CB-CE3 4.38Å; L433-W437 HydrophobicContact CD1-CE3 3.86Å; L433-W437 HydrophobicContact CD1-CZ3 3.85Å; L433-V439 HydrophobicContact CD2-CG2 3.9Å
434	H	88.5	Confident	90.7	Very high	46 Å²	46	32.1 Å²	32.1	21%	0.213	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	176.1	177.4	-171.1	54.7	0	0	0	110.9	G436 W437 T438 K440	H434-G436 PolarHBondContact O-N 2.94Å; H434-W437 WeakPolarHBondContact O-CA 3.25Å; H434-W437 PolarHBondContact O-N 3.15Å; H434-T438 WeakPolarHBondContact CB-O 3.36Å; H434-T438 PolarHBondContact N-O 3.2Å; H434-T438 PolarHBondContact O-N 3.15Å; H434-K440 HydrophobicContact CB-CG 3.97Å
435	E	84.5	Confident	89.5	Confident	128 Å²	128	29.7 Å²	29.7	60%	0.598	16%	0.16	S	C	*	.	G	3₁₀ helix	trans	-46.2	141.1	177.8	-65.3	-174.9	174.4	0	0	112	E382 W437 T438	E382-E435 HydrophobicContact CB-CG 4.3Å; E435-W437 PolarHBondContact O-N 3.47Å; E435-T438 PolarHBondContact O-N 2.77Å; E435-T438 PolarHBondContact O-OG1 2.87Å
436	G	81.9	Confident	88.4	Confident	68 Å²	68	28.8 Å²	28.8	70%	0.701	16%	0.155	S	C	*	.	G	3₁₀ helix	trans	69.3	13.6	-173.6	0	0	0	0	0	114.9	H434 T438	H434-G436 PolarHBondContact O-N 2.94Å; G436-T438 VanDerWaalsContact C-N 3.27Å; G436-T438 PolarHBondContact O-N 3.45Å
437	W	89	Confident	86.7	Confident	89 Å²	89	29.3 Å²	29.3	34%	0.337	16%	0.16	S	C	.	.	G	3₁₀ helix	trans	63.7	28.9	-174.8	-53.5	92	0	0	0	113.9	T395 F397 R401 Q408 L433 H434 E435 V439	T395-W437 HydrophobicContact CG2-CH2 4.21Å; F397-W437 HydrophobicContact CD1-CZ3 4.33Å; F397-W437 AromaticContact CE1-CE3 3.93Å; F397-W437 HydrophobicContact CE1-CE3 3.93Å; F397-W437 AromaticContact CE1-CH2 3.97Å; F397-W437 HydrophobicContact CE1-CH2 3.97Å; F397-W437 AromaticContact CE1-CZ3 3.34Å; F397-W437 HydrophobicContact CE1-CZ3 3.34Å; F397-W437 AromaticContact CZ-CZ3 3.93Å; F397-W437 HydrophobicContact CZ-CZ3 3.93Å; R401-W437 VanDerWaalsContact CZ-CD1 3.41Å; Q408-W437 PolarHBondContact NE2-O 3.34Å; L433-W437 HydrophobicContact CB-CE3 4.38Å; L433-W437 HydrophobicContact CD1-CE3 3.86Å; L433-W437 HydrophobicContact CD1-CZ3 3.85Å; H434-W437 WeakPolarHBondContact O-CA 3.25Å; H434-W437 PolarHBondContact O-N 3.15Å; E435-W437 PolarHBondContact O-N 3.47Å; W437-V439 PolarHBondContact O-N 3.42Å
438	T	94.9	Very high	85.1	Confident	39 Å²	39	29 Å²	29	24%	0.239	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	122.5	174.1	-57.5	0	0	0	0	109.3	V360 H434 E435 G436	V360-T438 HydrophobicContact CG2-CG2 4Å; H434-T438 WeakPolarHBondContact CB-O 3.36Å; H434-T438 PolarHBondContact N-O 3.2Å; H434-T438 PolarHBondContact O-N 3.15Å; E435-T438 PolarHBondContact O-N 2.77Å; E435-T438 PolarHBondContact O-OG1 2.87Å; G436-T438 VanDerWaalsContact C-N 3.27Å; G436-T438 PolarHBondContact O-N 3.45Å
439	V	97.5	Very high	83.3	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70	136.5	175.5	171.3	0	0	0	0	109.9	N361 V405 Q408 I431 F432 L433 W437 I441	N361-V439 WeakPolarHBondContact CA-O 3.45Å; N361-V439 PolarHBondContact ND2-O 3.01Å; N361-V439 VanDerWaalsContact ND2-O 3.1Å; V405-V439 HydrophobicContact CB-CG2 4.34Å; V405-V439 HydrophobicContact CG1-CG2 3.94Å; V405-V439 HydrophobicContact CG2-CG2 4.43Å; Q408-V439 HydrophobicContact CB-CB 3.75Å; Q408-V439 HydrophobicContact CB-CG2 3.63Å; Q408-V439 HydrophobicContact CG-CG2 4.5Å; I431-V439 HydrophobicContact CG2-CG1 3.74Å; F432-V439 CarbonylContact O-C 3.54Å; F432-V439 WeakPolarHBondContact O-CA 3.38Å; L433-V439 HydrophobicContact CD2-CG2 3.9Å; W437-V439 PolarHBondContact O-N 3.42Å; V439-I441 HydrophobicContact CG1-CG1 4.2Å
440	K	96.2	Very high	81.7	Confident	22 Å²	22	28.7 Å²	28.7	10%	0.096	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	115.9	169.9	-62.4	-70.5	-178.7	174.9	0	109.6	V360 L363 F432 H434	V360-K440 WeakPolarHBondContact O-CD 3.48Å; V360-K440 VanDerWaalsContact O-CE 3.24Å; V360-K440 WeakPolarHBondContact O-CE 3.39Å; V360-K440 PolarHBondContact O-NZ 3.1Å; L363-K440 HydrophobicContact CD1-CB 4.13Å; F432-K440 HydrophobicContact CB-CB 4.3Å; F432-K440 PolarHBondContact N-O 3.02Å; F432-K440 PolarHBondContact O-N 3.32Å; H434-K440 HydrophobicContact CB-CG 3.97Å
441	I	95.8	Very high	80	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	120.4	176.1	-54.4	173.5	0	0	0	108.8	N361 I362 L363 T409 M413 H423 L426 V439	N361-I441 WeakPolarHBondContact O-CG1 3.37Å; N361-I441 PolarHBondContact O-N 3.26Å; I362-I441 HydrophobicContact CD1-CB 3.96Å; I362-I441 HydrophobicContact CD1-CD1 4.24Å; I362-I441 HydrophobicContact CD1-CG1 4.5Å; L363-I441 VanDerWaalsContact CB-O 3.26Å; L363-I441 WeakPolarHBondContact CB-O 3.32Å; L363-I441 PolarHBondContact N-O 2.84Å; T409-I441 HydrophobicContact CG2-CD1 4.12Å; T409-I441 WeakPolarHBondContact O-CD1 3.44Å; M413-I441 HydrophobicContact CG-CD1 3.85Å; M413-I441 HydrophobicContact SD-CD1 3.97Å; M413-I441 HydrophobicContact SD-CG2 4.4Å; H423-I441 WeakPolarHBondContact NE2-CG2 3.42Å; L426-I441 HydrophobicContact CD1-CG2 4.21Å; V439-I441 HydrophobicContact CG1-CG1 4.2Å
442	G	90.5	Very high	78.1	Confident	0 Å²	0	42 Å²	42	0%	0	21%	0.206	C	C	.	.			trans	-113.4	179.4	179.9	0	0	0	0	0	113	H423 N430 F444	H423-G442 PolarHBondContact CE1-O 3.33Å; H423-G442 PolarHBondContact NE2-O 3.34Å; H423-G442 VanDerWaalsContact NE2-O 3.1Å; N430-G442 PolarHBondContact O-N 2.78Å; G442-F444 PolarHBondContact O-N 3.07Å
443	D	82.1	Confident	76.3	Confident	47 Å²	47	41 Å²	41	25%	0.251	20%	0.201	S	C	.	.	S	Bend	trans	58	12.7	174.2	-77.7	-7	0	0	0	116.7	K332 N430 L446	K332-D443 IonicContact NZ-OD1 2.8Å; K332-D443 PolarHBondContact NZ-OD1 3.46Å; K332-D443 IonicContact NZ-OD2 2.79Å; K332-D443 PolarHBondContact NZ-OD2 3.47Å; N430-D443 HydrophobicContact CB-CB 4.46Å; D443-L446 HydrophobicContact CB-CD1 4.11Å; D443-L446 VanDerWaalsContact OD1-CD1 3.3Å; D443-L446 WeakPolarHBondContact OD1-CD1 3.49Å
444	F	73.8	Confident	74.3	Confident	11 Å²	11	42.5 Å²	42.5	5%	0.048	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	146.6	170.1	63.3	-84	0	0	0	111.2	L354 T357 I362 L416 I421 H423 G442 L446	L354-F444 HydrophobicContact CD2-CD2 3.53Å; L354-F444 HydrophobicContact CD2-CE2 3.25Å; L354-F444 HydrophobicContact CD2-CZ 4.04Å; T357-F444 HydrophobicContact CG2-CE2 3.8Å; T357-F444 HydrophobicContact CG2-CZ 4.29Å; I362-F444 HydrophobicContact CG2-CD1 4.34Å; I362-F444 HydrophobicContact CG2-CE1 3.36Å; I362-F444 HydrophobicContact CG2-CE2 4.34Å; I362-F444 HydrophobicContact CG2-CZ 3.35Å; L416-F444 HydrophobicContact CD1-CB 4.08Å; L416-F444 HydrophobicContact CD1-CD2 4.34Å; L416-F444 HydrophobicContact CD1-CG 4.08Å; L416-F444 HydrophobicContact CD2-CD2 3.81Å; L416-F444 HydrophobicContact CD2-CE2 3.89Å; L416-F444 HydrophobicContact CD2-CG 4.32Å; L416-F444 HydrophobicContact CD2-CZ 4.48Å; I421-F444 HydrophobicContact CG2-CD2 4.35Å; H423-F444 HydrophobicContact CB-CB 4.28Å; G442-F444 PolarHBondContact O-N 3.07Å; F444-L446 PolarHBondContact O-N 2.87Å; F444-L446 VanDerWaalsContact O-N 3.14Å
445	G	63	Low	72.2	Confident	3 Å²	3	42.4 Å²	42.4	3%	0.031	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	79	-20.7	179.7	0	0	0	0	0	115.6	A447 T448 V449	G445-A447 PolarHBondContact O-N 2.96Å; G445-T448 PolarHBondContact O-N 2.86Å; G445-V449 WeakPolarHBondContact O-CG2 3.46Å; G445-V449 PolarHBondContact O-N 2.87Å
446	L	64.2	Low	70.1	Confident	8 Å²	8	42.6 Å²	42.6	4%	0.042	24%	0.239	C	C	.	.	H	α-helix	trans	-67.8	-21.2	179.2	-56.6	-175.4	0	0	0	114	F317 K332 I376 D443 F444 V449 K450	F317-L446 HydrophobicContact CD1-CB 4.33Å; K332-L446 HydrophobicContact CD-CD1 3.99Å; I376-L446 HydrophobicContact CD1-CD2 3.17Å; D443-L446 HydrophobicContact CB-CD1 4.11Å; D443-L446 VanDerWaalsContact OD1-CD1 3.3Å; D443-L446 WeakPolarHBondContact OD1-CD1 3.49Å; F444-L446 PolarHBondContact O-N 2.87Å; F444-L446 VanDerWaalsContact O-N 3.14Å; L446-V449 WeakPolarHBondContact O-CB 3.43Å; L446-K450 PolarHBondContact O-N 3.42Å
447	A	58.7	Low	68	Low	16 Å²	16	48 Å²	48	13%	0.132	25%	0.246	C	C	.	.	H	α-helix	trans	-71.7	-35	174.4	0	0	0	0	0	112.6	R424 G445 V449 K450 Y451	R424-A447 HydrophobicContact CB-CB 3.61Å; R424-A447 HydrophobicContact CG-CB 4.33Å; G445-A447 PolarHBondContact O-N 2.96Å; A447-V449 VanDerWaalsContact C-N 3.31Å; A447-K450 PolarHBondContact O-N 3.47Å; A447-Y451 WeakPolarHBondContact O-CB 3.38Å; A447-Y451 PolarHBondContact O-N 3.1Å
448	T	59	Low	65.7	Low	12 Å²	12	50.2 Å²	50.2	7%	0.074	26%	0.26	C	S	.	.	H	α-helix	trans	-67.6	-39.8	174.2	-43	0	0	0	0	110.7	E350 R424 G445 Y451 R452	E350-T448 VanDerWaalsContact OE1-CB 3.26Å; E350-T448 WeakPolarHBondContact OE1-CB 3.38Å; E350-T448 WeakPolarHBondContact OE1-CG2 3.23Å; R424-T448 PolarHBondContact NE-OG1 3.47Å; R424-T448 PolarHBondContact NH1-OG1 2.82Å; G445-T448 PolarHBondContact O-N 2.86Å; T448-Y451 PolarHBondContact O-N 3.21Å; T448-R452 PolarHBondContact O-N 2.85Å
449	V	57.4	Low	63.1	Low	1 Å²	1	55.1 Å²	55.1	1%	0.006	29%	0.29	C	S	.	.	H	α-helix	trans	-57	-50.6	174.1	179.6	0	0	0	0	109.7	F347 E350 G445 L446 A447 R452 W453	F347-V449 HydrophobicContact CD2-CG1 4.38Å; E350-V449 HydrophobicContact CB-CG2 3.49Å; E350-V449 VanDerWaalsContact CB-CG2 3.49Å; E350-V449 HydrophobicContact CG-CG2 3.44Å; E350-V449 VanDerWaalsContact CG-CG2 3.44Å; G445-V449 WeakPolarHBondContact O-CG2 3.46Å; G445-V449 PolarHBondContact O-N 2.87Å; L446-V449 WeakPolarHBondContact O-CB 3.43Å; A447-V449 VanDerWaalsContact C-N 3.31Å; V449-R452 PolarHBondContact O-N 3.04Å; V449-W453 HydrophobicContact CB-CH2 4.32Å; V449-W453 HydrophobicContact CB-CZ2 4.33Å; V449-W453 HydrophobicContact CB-CZ3 4.44Å; V449-W453 HydrophobicContact CG1-CD2 3.49Å; V449-W453 VanDerWaalsContact CG1-CD2 3.49Å; V449-W453 HydrophobicContact CG1-CE3 3.58Å; V449-W453 HydrophobicContact CG1-CG 4.48Å; V449-W453 HydrophobicContact CG1-CH2 2.94Å; V449-W453 HydrophobicContact CG1-CZ2 2.86Å; V449-W453 HydrophobicContact CG1-CZ3 3.31Å; V449-W453 VanDerWaalsContact O-CB 3.32Å; V449-W453 WeakPolarHBondContact O-CB 3.45Å; V449-W453 PolarHBondContact O-N 3.25Å
450	K	58.9	Low	60.6	Low	44 Å²	44	58.1 Å²	58.1	19%	0.191	30%	0.304	C	S	.	.	H	α-helix	trans	-58.3	-50.5	173.3	-168.8	-169.1	-174.2	-151.4	0	112.7	F317 L446 A447 R452 W453 S454 E460	F317-K450 HydrophobicContact CD1-CB 4.15Å; F317-K450 HydrophobicContact CD1-CD 4.3Å; F317-K450 HydrophobicContact CE1-CB 3.74Å; F317-K450 HydrophobicContact CE1-CD 3.69Å; F317-K450 HydrophobicContact CE1-CG 4.2Å; F317-K450 HydrophobicContact CZ-CD 4.42Å; L446-K450 PolarHBondContact O-N 3.42Å; A447-K450 PolarHBondContact O-N 3.47Å; K450-R452 VanDerWaalsContact C-N 3.3Å; K450-R452 PolarHBondContact O-N 2.8Å; K450-W453 PolarHBondContact O-N 3.32Å; K450-S454 PolarHBondContact O-N 3.1Å; K450-S454 PolarHBondContact O-OG 3.41Å; K450-E460 WeakPolarHBondContact CE-OE2 3.32Å; K450-E460 IonicContact NZ-OE1 3.86Å; K450-E460 IonicContact NZ-OE2 2.67Å; K450-E460 PolarHBondContact NZ-OE2 3.45Å
451	Y	57.3	Low	58.1	Low	155 Å²	155	64.2 Å²	64.2	61%	0.608	33%	0.333	S	S	*	.	H	α-helix	trans	-55.9	-42.6	-179.4	177.5	-96.4	0	0	0	112.8	A447 T448 W453	A447-Y451 WeakPolarHBondContact O-CB 3.38Å; A447-Y451 PolarHBondContact O-N 3.1Å; T448-Y451 PolarHBondContact O-N 3.21Å; Y451-W453 VanDerWaalsContact C-N 3.33Å
452	R	56.2	Low	55.8	Low	133 Å²	133	65.7 Å²	65.7	50%	0.502	34%	0.342	S	S	.	.	H	α-helix	trans	-76.4	-21.6	177.9	-70.6	-172.4	177.1	138.8	1.9	113.1	A346 E350 T448 V449 K450	A346-R452 HydrophobicContact CB-CB 4.37Å; E350-R452 IonicContact OE1-CZ 3.76Å; E350-R452 IonicContact OE1-NH1 3.85Å; E350-R452 PolarHBondContact OE1-NH1 3.28Å; T448-R452 PolarHBondContact O-N 2.85Å; V449-R452 PolarHBondContact O-N 3.04Å; K450-R452 VanDerWaalsContact C-N 3.3Å; K450-R452 PolarHBondContact O-N 2.8Å
453	W	58.7	Low	53.5	Low	33 Å²	33	69.4 Å²	69.4	13%	0.125	37%	0.368	C	S	.	.	H	α-helix	trans	-83.4	-30.4	179.9	-68.6	-17.4	0	0	0	113.9	L334 V336 Q343 F347 F374 V449 K450 Y451 G455	L334-W453 HydrophobicContact CB-CH2 4.32Å; L334-W453 HydrophobicContact CD1-CH2 3.54Å; L334-W453 HydrophobicContact CD1-CZ2 4.3Å; L334-W453 HydrophobicContact CD1-CZ3 4.48Å; L334-W453 HydrophobicContact CD2-CH2 4.26Å; L334-W453 HydrophobicContact CD2-CZ3 4.49Å; L334-W453 HydrophobicContact CG-CH2 4.22Å; V336-W453 HydrophobicContact CG2-CE3 4.31Å; V336-W453 HydrophobicContact CG2-CH2 4.46Å; V336-W453 HydrophobicContact CG2-CZ3 4.22Å; Q343-W453 HydrophobicContact CG-CG 4.49Å; Q343-W453 PolarHBondContact NE2-O 3.16Å; Q343-W453 PolarHBondContact O-NE1 2.87Å; F347-W453 HydrophobicContact CB-CZ2 4.06Å; F347-W453 HydrophobicContact CD2-CH2 4.26Å; F347-W453 AromaticContact CD2-CZ2 3.7Å; F347-W453 HydrophobicContact CD2-CZ2 3.7Å; F347-W453 HydrophobicContact CG-CZ2 4.2Å; F374-W453 HydrophobicContact CD2-CZ2 4.41Å; V449-W453 HydrophobicContact CB-CH2 4.32Å; V449-W453 HydrophobicContact CB-CZ2 4.33Å; V449-W453 HydrophobicContact CB-CZ3 4.44Å; V449-W453 HydrophobicContact CG1-CD2 3.49Å; V449-W453 VanDerWaalsContact CG1-CD2 3.49Å; V449-W453 HydrophobicContact CG1-CE3 3.58Å; V449-W453 HydrophobicContact CG1-CG 4.48Å; V449-W453 HydrophobicContact CG1-CH2 2.94Å; V449-W453 HydrophobicContact CG1-CZ2 2.86Å; V449-W453 HydrophobicContact CG1-CZ3 3.31Å; V449-W453 VanDerWaalsContact O-CB 3.32Å; V449-W453 WeakPolarHBondContact O-CB 3.45Å; V449-W453 PolarHBondContact O-N 3.25Å; K450-W453 PolarHBondContact O-N 3.32Å; Y451-W453 VanDerWaalsContact C-N 3.33Å; W453-G455 PolarHBondContact O-N 2.69Å
454	S	52.7	Low	52.3	Low	37 Å²	37	69 Å²	69	26%	0.259	38%	0.375	S	S	.	.	S	Bend	trans	-72.9	-4.2	-177.1	-45.8	0	0	0	0	114.6	K450 E460	K450-S454 PolarHBondContact O-N 3.1Å; K450-S454 PolarHBondContact O-OG 3.41Å; S454-E460 WeakPolarHBondContact CB-OE1 3.35Å; S454-E460 PolarHBondContact OG-OE1 3.49Å
455	G	44.9	Very low	52.2	Low	44 Å²	44	70.2 Å²	70.2	45%	0.454	39%	0.385	S	S	.	.			trans	68.2	160.7	-173	0	0	0	0	0	112.5	W453 Q457	W453-G455 PolarHBondContact O-N 2.69Å; G455-Q457 PolarHBondContact O-N 2.78Å
456	S	39.8	Very low	53.3	Low	132 Å²	132	70.9 Å²	70.9	92%	0.923	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	7.5	-179.2	48.5	0	0	0	0	115.2
457	Q	37.6	Very low	54.7	Low	181 Å²	181	72 Å²	72	85%	0.846	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.4	0	-169.5	-85.4	-174.6	-8.4	0	0	116.1	G455	G455-Q457 PolarHBondContact O-N 2.78Å
458	Q	40	Very low	56.4	Low	137 Å²	137	72.2 Å²	72.2	64%	0.64	39%	0.391	S	S	*	.			trans	-103.1	101.4	163.6	-73.5	-168.2	-10.7	0	0	109.4	E460	Q458-E460 HydrophobicContact CB-CG 4.08Å; Q458-E460 PolarHBondContact O-N 2.76Å
459	V	41.2	Very low	57.9	Low	142 Å²	142	72.9 Å²	72.9	86%	0.861	39%	0.393	S	S	*	.			trans	-59.4	79.5	149.3	-178	0	0	0	0	105.3	Q461	V459-Q461 PolarHBondContact O-N 2.77Å
460	E	45.6	Very low	59.7	Low	62 Å²	62	72.9 Å²	72.9	29%	0.29	39%	0.394	S	S	.	.			trans	-61.9	110.1	176.1	-78.2	-172	-177.7	0	0	105.8	K450 S454 Q458	K450-E460 WeakPolarHBondContact CE-OE2 3.32Å; K450-E460 IonicContact NZ-OE1 3.86Å; K450-E460 IonicContact NZ-OE2 2.67Å; K450-E460 PolarHBondContact NZ-OE2 3.45Å; S454-E460 WeakPolarHBondContact CB-OE1 3.35Å; S454-E460 PolarHBondContact OG-OE1 3.49Å; Q458-E460 HydrophobicContact CB-CG 4.08Å; Q458-E460 PolarHBondContact O-N 2.76Å
461	Q	43.7	Very low	61.4	Low	151 Å²	151	70.8 Å²	70.8	71%	0.706	39%	0.385	S	S	*	.			trans	-41.5	139.8	158.4	-75.8	-161.3	2.2	0	0	107.9	V459 S463	V459-Q461 PolarHBondContact O-N 2.77Å; Q461-S463 WeakPolarHBondContact O-CA 3.26Å; Q461-S463 WeakPolarHBondContact O-CB 3.47Å; Q461-S463 PolarHBondContact O-N 3.1Å
462	P	45.9	Very low	63.1	Low	30 Å²	30	63.7 Å²	63.7	20%	0.195	36%	0.357	C	S	.	.			trans	-46.8	79.1	-177.4	-31.1	36.1	0	0	0	113.7	G464 M469 R511 L515	P462-G464 PolarHBondContact O-N 3.31Å; P462-M469 HydrophobicContact CB-CE 3.82Å; P462-M469 HydrophobicContact CB-SD 3.82Å; P462-M469 HydrophobicContact CG-CE 4.41Å; P462-R511 PolarHBondContact O-NH2 2.94Å; P462-L515 HydrophobicContact CB-CD1 4.47Å; P462-L515 HydrophobicContact CB-CD2 4.2Å; P462-L515 HydrophobicContact CG-CD2 4.39Å
463	S	42	Very low	64.7	Low	78 Å²	78	57.5 Å²	57.5	55%	0.545	33%	0.334	S	S	.	.			trans	-94.5	89.6	-172.8	-170	0	0	0	0	106.2	Q461	Q461-S463 WeakPolarHBondContact O-CA 3.26Å; Q461-S463 WeakPolarHBondContact O-CB 3.47Å; Q461-S463 PolarHBondContact O-N 3.1Å
464	G	56.8	Low	66.2	Low	38 Å²	38	57 Å²	57	39%	0.392	33%	0.334	S	S	.	.	S	Bend	trans	-179.1	-174.5	-171.9	0	0	0	0	0	111.9	P462 I466	P462-G464 PolarHBondContact O-N 3.31Å; G464-I466 VanDerWaalsContact C-N 3.34Å; G464-I466 PolarHBondContact O-N 3.12Å
465	S	73.1	Confident	67.8	Low	37 Å²	37	59.9 Å²	59.9	26%	0.259	34%	0.339	S	S	.	.			trans	-76.3	85.9	176.8	-58.3	0	0	0	0	109	K427 L467 W468	K427-S465 WeakPolarHBondContact CD-OG 3.3Å; K427-S465 PolarHBondContact NZ-OG 3.4Å; S465-L467 PolarHBondContact O-N 3.05Å; S465-W468 VanDerWaalsContact CB-CE3 3.45Å; S465-W468 PolarHBondContact O-N 2.91Å
466	I	85.8	Confident	69.7	Low	17 Å²	17	61.9 Å²	61.9	9%	0.087	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-57.8	-24.5	-169	61.3	150.4	0	0	0	114.6	G464 W468 M469 R511 I514 L515	G464-I466 VanDerWaalsContact C-N 3.34Å; G464-I466 PolarHBondContact O-N 3.12Å; I466-W468 PolarHBondContact O-N 2.99Å; I466-M469 HydrophobicContact CG2-SD 4.41Å; I466-M469 PolarHBondContact O-N 3.31Å; I466-M469 VanDerWaalsContact O-N 3.16Å; I466-R511 HydrophobicContact CD1-CB 4.31Å; I466-R511 HydrophobicContact CD1-CG 3.51Å; I466-R511 HydrophobicContact CG1-CG 4.23Å; I466-R511 HydrophobicContact CG2-CG 4.39Å; I466-I514 HydrophobicContact CD1-CB 3.93Å; I466-I514 HydrophobicContact CD1-CD1 4.37Å; I466-I514 HydrophobicContact CD1-CG2 3.86Å; I466-L515 HydrophobicContact CB-CD2 3.89Å; I466-L515 HydrophobicContact CB-CG 4.39Å; I466-L515 HydrophobicContact CD1-CG 4.18Å; I466-L515 HydrophobicContact CG2-CD1 4.2Å; I466-L515 HydrophobicContact CG2-CD2 3.73Å; I466-L515 HydrophobicContact CG2-CG 4.13Å
467	L	92.3	Very high	71.8	Confident	33 Å²	33	62.4 Å²	62.4	17%	0.173	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-65.5	-23.9	-174	-54.3	178.3	0	0	0	113.1	S465 L503 P504 Y505 I514	S465-L467 PolarHBondContact O-N 3.05Å; L467-L503 HydrophobicContact CD1-CB 4.29Å; L467-L503 HydrophobicContact CD1-CD1 4.27Å; L467-L503 HydrophobicContact CD1-CD2 4.16Å; L467-L503 HydrophobicContact CD1-CG 4.48Å; L467-P504 HydrophobicContact CB-CG 3.92Å; L467-Y505 HydrophobicContact CD2-CD2 3.78Å; L467-Y505 HydrophobicContact CD2-CE2 4.37Å; L467-I514 HydrophobicContact CD2-CD1 4.27Å
468	W	94.6	Very high	73.8	Confident	19 Å²	19	56.7 Å²	56.7	7%	0.072	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-100.6	-2.9	179.9	-63.4	-95.7	0	0	0	113	Y387 K427 S428 S465 I466 G490 V493 E497 L503	Y387-W468 HydrophobicContact CD2-CH2 4.36Å; Y387-W468 HydrophobicContact CE2-CH2 4.29Å; K427-W468 HydrophobicContact CB-CB 4.39Å; K427-W468 HydrophobicContact CB-CD2 3.51Å; K427-W468 HydrophobicContact CB-CE3 4.04Å; K427-W468 HydrophobicContact CB-CG 3.67Å; K427-W468 HydrophobicContact CB-CZ2 4.21Å; K427-W468 HydrophobicContact CD-CE3 4.49Å; S428-W468 WeakPolarHBondContact OG-CZ2 3.5Å; S465-W468 VanDerWaalsContact CB-CE3 3.45Å; S465-W468 PolarHBondContact O-N 2.91Å; I466-W468 PolarHBondContact O-N 2.99Å; W468-G490 WeakPolarHBondContact O-CA 3.35Å; W468-V493 VanDerWaalsContact CD1-CG1 3.48Å; W468-V493 HydrophobicContact CD2-CG1 4.42Å; W468-V493 HydrophobicContact CG-CB 4.29Å; W468-V493 HydrophobicContact CG-CG1 4Å; W468-E497 VanDerWaalsContact CE2-OE2 3.29Å; W468-E497 WeakPolarHBondContact CZ2-OE1 3.43Å; W468-E497 WeakPolarHBondContact CZ2-OE2 3.42Å; W468-E497 PolarHBondContact NE1-OE2 3.34Å; W468-L503 HydrophobicContact CH2-CD2 3.88Å; W468-L503 HydrophobicContact CZ2-CD2 3.96Å
469	M	92.2	Very high	75.5	Confident	26 Å²	26	56.2 Å²	56.2	13%	0.128	31%	0.312	C	S	.	.			trans	-76.7	129.9	-175	-67.4	-175.3	68	0	0	111	P462 I466 V473 I474 Y489	P462-M469 HydrophobicContact CB-CE 3.82Å; P462-M469 HydrophobicContact CB-SD 3.82Å; P462-M469 HydrophobicContact CG-CE 4.41Å; I466-M469 HydrophobicContact CG2-SD 4.41Å; I466-M469 PolarHBondContact O-N 3.31Å; I466-M469 VanDerWaalsContact O-N 3.16Å; M469-V473 HydrophobicContact CE-CB 4.33Å; M469-V473 HydrophobicContact CE-CG1 3.53Å; M469-I474 HydrophobicContact CB-CD1 4.12Å; M469-I474 HydrophobicContact CB-CG1 3.74Å; M469-I474 HydrophobicContact CE-CG1 4.43Å; M469-Y489 VanDerWaalsContact O-CE1 3.27Å; M469-Y489 WeakPolarHBondContact O-CE1 3.5Å
470	A	94	Very high	77.4	Confident	2 Å²	2	53.1 Å²	53.1	2%	0.017	29%	0.291	C	S	.	.			trans	-66.4	149.1	175.3	0	0	0	0	0	111.3	E472 V473 I474 Y489	A470-E472 VanDerWaalsContact C-N 3.27Å; A470-E472 VanDerWaalsContact CB-CD 3.47Å; A470-E472 VanDerWaalsContact CB-OE1 3.3Å; A470-E472 WeakPolarHBondContact CB-OE1 3.39Å; A470-E472 WeakPolarHBondContact CB-OE2 3.3Å; A470-E472 PolarHBondContact O-N 3.2Å; A470-V473 HydrophobicContact CB-CB 4.49Å; A470-V473 HydrophobicContact CB-CG2 4.05Å; A470-V473 WeakPolarHBondContact O-CA 3.08Å; A470-V473 WeakPolarHBondContact O-CB 3.45Å; A470-V473 PolarHBondContact O-N 2.91Å; A470-I474 PolarHBondContact O-N 3.35Å; A470-Y489 VanDerWaalsContact CA-CD1 3.44Å; A470-Y489 HydrophobicContact CB-CD1 3.93Å; A470-Y489 HydrophobicContact CB-CD2 4.43Å; A470-Y489 HydrophobicContact CB-CG 3.76Å
471	P	93.9	Very high	79.3	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-52.4	-41.4	-179.9	-27.4	33	0	0	0	114	V473 I474 R475 Y489 V518 F548	P471-V473 VanDerWaalsContact C-N 3.32Å; P471-V473 PolarHBondContact O-N 3.24Å; P471-I474 PolarHBondContact O-N 2.66Å; P471-R475 WeakPolarHBondContact O-CG 3.06Å; P471-R475 PolarHBondContact O-N 2.7Å; P471-R475 PolarHBondContact O-NH1 2.77Å; P471-Y489 HydrophobicContact CG-CE2 4.21Å; P471-V518 HydrophobicContact CG-CG1 4.12Å; P471-F548 HydrophobicContact CB-CD1 4.25Å; P471-F548 HydrophobicContact CG-CD1 3.6Å; P471-F548 HydrophobicContact CG-CE1 4.13Å
472	E	93.1	Very high	81.4	Confident	5 Å²	5	46 Å²	46	2%	0.023	26%	0.256	C	S	.	.	H	α-helix	trans	-67.6	-30.7	177	69	-80.7	-169.3	0	0	113.4	A470 M476 P481 R553	A470-E472 VanDerWaalsContact C-N 3.27Å; A470-E472 VanDerWaalsContact CB-CD 3.47Å; A470-E472 VanDerWaalsContact CB-OE1 3.3Å; A470-E472 WeakPolarHBondContact CB-OE1 3.39Å; A470-E472 WeakPolarHBondContact CB-OE2 3.3Å; A470-E472 PolarHBondContact O-N 3.2Å; E472-M476 PolarHBondContact O-N 3.42Å; E472-P481 WeakPolarHBondContact O-CB 3.47Å; E472-R553 IonicContact OE1-CZ 3.35Å; E472-R553 IonicContact OE1-NH1 3.92Å; E472-R553 PolarHBondContact OE1-NH1 2.9Å; E472-R553 IonicContact OE1-NH2 3.18Å; E472-R553 IonicContact OE2-CZ 3Å; E472-R553 IonicContact OE2-NH1 2.79Å; E472-R553 PolarHBondContact OE2-NH1 3.38Å; E472-R553 IonicContact OE2-NH2 3.09Å; E472-R553 PolarHBondContact OE2-NH2 2.88Å
473	V	90.3	Very high	83.6	Confident	4 Å²	4	45.6 Å²	45.6	2%	0.024	25%	0.253	C	S	.	.	H	α-helix	trans	-75.3	-33.6	174.3	-174.9	0	0	0	0	110.7	M469 A470 P471 M476 P481 Y482	M469-V473 HydrophobicContact CE-CB 4.33Å; M469-V473 HydrophobicContact CE-CG1 3.53Å; A470-V473 HydrophobicContact CB-CB 4.49Å; A470-V473 HydrophobicContact CB-CG2 4.05Å; A470-V473 WeakPolarHBondContact O-CA 3.08Å; A470-V473 WeakPolarHBondContact O-CB 3.45Å; A470-V473 PolarHBondContact O-N 2.91Å; P471-V473 VanDerWaalsContact C-N 3.32Å; P471-V473 PolarHBondContact O-N 3.24Å; V473-M476 WeakPolarHBondContact O-CG 3.27Å; V473-P481 HydrophobicContact CG2-CB 4.3Å; V473-Y482 HydrophobicContact CG1-CD1 4.13Å; V473-Y482 HydrophobicContact CG1-CE1 3.48Å; V473-Y482 VanDerWaalsContact CG1-CE1 3.48Å; V473-Y482 HydrophobicContact CG1-CE2 4Å; V473-Y482 WeakPolarHBondContact CG1-OH 3.37Å; V473-Y482 HydrophobicContact CG2-CD1 4.29Å; V473-Y482 HydrophobicContact CG2-CE1 4.4Å
474	I	89.8	Confident	86.2	Confident	23 Å²	23	44.2 Å²	44.2	12%	0.118	24%	0.238	C	C	.	.	H	α-helix	trans	-67.1	-42.6	173.5	-67.1	169.5	0	0	0	110.9	M469 A470 P471 M476 L515 V518	M469-I474 HydrophobicContact CB-CD1 4.12Å; M469-I474 HydrophobicContact CB-CG1 3.74Å; M469-I474 HydrophobicContact CE-CG1 4.43Å; A470-I474 PolarHBondContact O-N 3.35Å; P471-I474 PolarHBondContact O-N 2.66Å; I474-M476 PolarHBondContact O-N 3.4Å; I474-L515 HydrophobicContact CD1-CD2 4.06Å; I474-L515 HydrophobicContact CG1-CD2 3.91Å; I474-L515 HydrophobicContact CG2-CB 4.26Å; I474-L515 HydrophobicContact CG2-CD2 3.89Å; I474-L515 WeakPolarHBondContact CG2-O 3.47Å; I474-V518 HydrophobicContact CD1-CB 3.89Å; I474-V518 HydrophobicContact CD1-CG1 3.63Å
475	R	87.9	Confident	88.1	Confident	97 Å²	97	44.9 Å²	44.9	37%	0.366	23%	0.231	S	C	.	.	H	α-helix	trans	-69.4	-29.7	-178.5	-72	-168.4	-57.8	-81.5	-3.4	113.7	P471 Q477 G519	P471-R475 WeakPolarHBondContact O-CG 3.06Å; P471-R475 PolarHBondContact O-N 2.7Å; P471-R475 PolarHBondContact O-NH1 2.77Å; R475-Q477 HydrophobicContact CB-CG 4.08Å; R475-Q477 PolarHBondContact O-N 2.98Å; R475-G519 WeakPolarHBondContact CD-O 3.42Å; R475-G519 PolarHBondContact NH1-O 2.91Å
476	M	83.6	Confident	89.2	Confident	85 Å²	85	43.4 Å²	43.4	42%	0.419	22%	0.221	S	C	.	.			trans	50.2	28.5	-177.9	-62.4	-69.8	-79.7	0	0	114.1	E472 V473 I474 P481	E472-M476 PolarHBondContact O-N 3.42Å; V473-M476 WeakPolarHBondContact O-CG 3.27Å; I474-M476 PolarHBondContact O-N 3.4Å; M476-P481 HydrophobicContact SD-CG 3.65Å
477	Q	83.4	Confident	89.7	Confident	143 Å²	143	42.8 Å²	42.8	67%	0.668	22%	0.217	S	C	*	.			trans	-81.5	-28.9	-178	-74.6	169.5	-11.6	0	0	112.6	R475	R475-Q477 HydrophobicContact CB-CG 4.08Å; R475-Q477 PolarHBondContact O-N 2.98Å
478	D	81.4	Confident	90	Very high	62 Å²	62	41.2 Å²	41.2	33%	0.332	21%	0.209	S	C	.	.	S	Bend	trans	-81.3	150.4	179.3	-67.9	4.9	0	0	0	110.5	N480 P481 R550	D478-N480 PolarHBondContact O-N 2.98Å; D478-P481 HydrophobicContact CB-CB 4.5Å; D478-R550 IonicContact OD2-CZ 3.67Å; D478-R550 IonicContact OD2-NH1 3.82Å; D478-R550 PolarHBondContact OD2-NH1 3.33Å; D478-R550 IonicContact OD2-NH2 2.84Å; D478-R550 PolarHBondContact OD2-NH2 3.36Å
479	S	74.7	Confident	90.1	Very high	127 Å²	127	40.3 Å²	40.3	89%	0.888	21%	0.206	S	C	*	.	S	Bend	trans	-59.5	-32.6	174.5	57.7	0	0	0	0	113
480	N	80.7	Confident	90.3	Very high	77 Å²	77	39.2 Å²	39.2	41%	0.412	20%	0.201	S	C	.	.			trans	-139.1	90.8	172.1	-177.8	46.9	0	0	0	110.7	D478 Y482	D478-N480 PolarHBondContact O-N 2.98Å; N480-Y482 VanDerWaalsContact C-N 3.3Å; N480-Y482 PolarHBondContact ND2-O 3.34Å; N480-Y482 PolarHBondContact O-N 3.01Å; N480-Y482 PolarHBondContact OD1-O 3.4Å
481	P	85.7	Confident	90.5	Very high	8 Å²	8	39.1 Å²	39.1	5%	0.052	20%	0.2	C	C	.	.			trans	-75.7	-21.9	-178	29.7	-33	0	0	0	112.6	E472 V473 M476 D478 T483	E472-P481 WeakPolarHBondContact O-CB 3.47Å; V473-P481 HydrophobicContact CG2-CB 4.3Å; M476-P481 HydrophobicContact SD-CG 3.65Å; D478-P481 HydrophobicContact CB-CB 4.5Å; P481-T483 PolarHBondContact O-N 2.89Å
482	Y	88.3	Confident	90.7	Very high	54 Å²	54	39.1 Å²	39.1	21%	0.212	20%	0.2	C	C	.	.			trans	-78.9	116.7	177	-66.2	-83.5	0	0	0	110.8	I422 R424 V473 N480	I422-Y482 WeakPolarHBondContact CD1-O 3.39Å; R424-Y482 HydrophobicContact CB-CD1 3.62Å; R424-Y482 HydrophobicContact CB-CE1 3.91Å; R424-Y482 HydrophobicContact CB-CG 4.37Å; R424-Y482 HydrophobicContact CG-CD1 3.82Å; R424-Y482 HydrophobicContact CG-CG 4.11Å; V473-Y482 HydrophobicContact CG1-CD1 4.13Å; V473-Y482 HydrophobicContact CG1-CE1 3.48Å; V473-Y482 VanDerWaalsContact CG1-CE1 3.48Å; V473-Y482 HydrophobicContact CG1-CE2 4Å; V473-Y482 WeakPolarHBondContact CG1-OH 3.37Å; V473-Y482 HydrophobicContact CG2-CD1 4.29Å; V473-Y482 HydrophobicContact CG2-CE1 4.4Å; N480-Y482 VanDerWaalsContact C-N 3.3Å; N480-Y482 PolarHBondContact ND2-O 3.34Å; N480-Y482 PolarHBondContact O-N 3.01Å; N480-Y482 PolarHBondContact OD1-O 3.4Å
483	T	92.7	Very high	90.9	Very high	22 Å²	22	38.9 Å²	38.9	14%	0.135	20%	0.199	C	C	.	.			trans	-139.2	174.4	-175	58.7	0	0	0	0	110.3	P481 Q485 S486 D487	P481-T483 PolarHBondContact O-N 2.89Å; T483-Q485 PolarHBondContact O-N 3.43Å; T483-Q485 PolarHBondContact OG1-N 3.48Å; T483-S486 PolarHBondContact N-OG 2.73Å; T483-S486 PolarHBondContact O-N 2.91Å; T483-S486 PolarHBondContact O-OG 3.2Å; T483-S486 PolarHBondContact OG1-N 2.94Å; T483-S486 VanDerWaalsContact OG1-N 3.15Å; T483-D487 PolarHBondContact O-N 2.92Å
484	F	95.6	Very high	91.3	Very high	50 Å²	50	38.7 Å²	38.7	22%	0.219	20%	0.198	C	C	.	.	H	α-helix	trans	-57.9	-36.9	169.2	-62.9	-27.8	0	0	0	111.6	H417 N420 I422 S486 D487 V488 L555	H417-F484 HydrophobicContact CB-CD1 4.18Å; H417-F484 HydrophobicContact CB-CE1 4.22Å; H417-F484 HydrophobicContact CB-CG 4.48Å; H417-F484 AromaticContact CD2-CD1 3.66Å; H417-F484 VanDerWaalsContact CE1-CA 3.44Å; H417-F484 WeakPolarHBondContact CE1-CA 3.44Å; H417-F484 VanDerWaalsContact CE1-CB 3.5Å; H417-F484 WeakPolarHBondContact CE1-CB 3.46Å; H417-F484 AromaticContact CE1-CD1 3.73Å; H417-F484 AromaticContact CE1-CG 3.89Å; H417-F484 PolarHBondContact CE1-O 2.97Å; H417-F484 AromaticContact CG-CD1 3.57Å; H417-F484 AromaticContact CG-CG 3.95Å; H417-F484 WeakPolarHBondContact ND1-CB 3.42Å; H417-F484 AromaticContact ND1-CD1 3.61Å; H417-F484 AromaticContact ND1-CG 3.58Å; H417-F484 AromaticContact NE2-CD1 3.75Å; N420-F484 WeakPolarHBondContact OD1-CZ 3.49Å; I422-F484 HydrophobicContact CG1-CD1 3.79Å; I422-F484 HydrophobicContact CG1-CE1 3.76Å; F484-S486 VanDerWaalsContact C-N 3.34Å; F484-S486 PolarHBondContact O-N 2.91Å; F484-D487 WeakPolarHBondContact O-CB 3.35Å; F484-D487 PolarHBondContact O-N 3.14Å; F484-V488 VanDerWaalsContact O-CG2 3.29Å; F484-V488 WeakPolarHBondContact O-CG2 3.29Å; F484-V488 PolarHBondContact O-N 2.88Å; F484-L555 HydrophobicContact CB-CD2 3.98Å
485	Q	97.2	Very high	91.7	Very high	51 Å²	51	37.6 Å²	37.6	24%	0.238	19%	0.192	C	C	.	.	H	α-helix	trans	-71.3	-26.5	179.4	-63.8	84.7	-9.8	0	0	113	T483 V488 Y489 R550 R553 L555	T483-Q485 PolarHBondContact O-N 3.43Å; T483-Q485 PolarHBondContact OG1-N 3.48Å; Q485-V488 PolarHBondContact O-N 3.2Å; Q485-Y489 PolarHBondContact O-N 3.39Å; Q485-Y489 VanDerWaalsContact O-N 3.1Å; Q485-R550 HydrophobicContact CB-CB 3.85Å; Q485-R550 WeakPolarHBondContact CG-O 3.44Å; Q485-R553 WeakPolarHBondContact O-CD 3.32Å; Q485-R553 PolarHBondContact O-NH1 2.71Å; Q485-L555 HydrophobicContact CG-CD2 4.33Å
486	S	94.9	Very high	92.1	Very high	7 Å²	7	33.1 Å²	33.1	5%	0.049	18%	0.175	C	C	.	.	H	α-helix	trans	-70.4	-37.5	171.8	67.1	0	0	0	0	111.7	T483 F484 V488 Y489 G490	T483-S486 PolarHBondContact N-OG 2.73Å; T483-S486 PolarHBondContact O-N 2.91Å; T483-S486 PolarHBondContact O-OG 3.2Å; T483-S486 PolarHBondContact OG1-N 2.94Å; T483-S486 VanDerWaalsContact OG1-N 3.15Å; F484-S486 VanDerWaalsContact C-N 3.34Å; F484-S486 PolarHBondContact O-N 2.91Å; S486-V488 VanDerWaalsContact C-N 3.32Å; S486-Y489 PolarHBondContact O-N 2.86Å; S486-G490 PolarHBondContact O-N 2.99Å
487	D	96.6	Very high	92.6	Very high	3 Å²	3	29 Å²	29	2%	0.016	16%	0.155	C	C	.	.	H	α-helix	trans	-64.6	-38.3	171.6	-77.7	-12.8	0	0	0	111.3	M413 H417 I422 H423 R424 T483 F484 Y489 G490 Y491 F556	M413-D487 HydrophobicContact CE-CB 3.81Å; M413-D487 WeakPolarHBondContact CE-OD2 2.98Å; H417-D487 IonicContact CD2-OD2 3.81Å; H417-D487 IonicContact CE1-OD2 2.78Å; H417-D487 IonicContact NE2-OD2 3.92Å; H417-D487 PolarHBondContact NE2-OD2 2.92Å; I422-D487 WeakPolarHBondContact CG2-OD2 3.45Å; H423-D487 PolarHBondContact N-OD1 3.06Å; H423-D487 PolarHBondContact N-OD2 3.42Å; R424-D487 PolarHBondContact N-OD1 3.49Å; T483-D487 PolarHBondContact O-N 2.92Å; F484-D487 WeakPolarHBondContact O-CB 3.35Å; F484-D487 PolarHBondContact O-N 3.14Å; D487-Y489 VanDerWaalsContact C-N 3.29Å; D487-Y489 PolarHBondContact O-N 3.24Å; D487-G490 PolarHBondContact O-N 3.35Å; D487-Y491 WeakPolarHBondContact O-CB 3.48Å; D487-Y491 PolarHBondContact O-N 3.11Å; D487-F556 HydrophobicContact CB-CE2 4.45Å
488	V	98.4	Very high	93.2	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-60.7	-38.5	175.2	172.1	0	0	0	0	111.7	F484 Q485 S486 Y491 G492 C545 R553 P554 F556 I559	F484-V488 VanDerWaalsContact O-CG2 3.29Å; F484-V488 WeakPolarHBondContact O-CG2 3.29Å; F484-V488 PolarHBondContact O-N 2.88Å; Q485-V488 PolarHBondContact O-N 3.2Å; S486-V488 VanDerWaalsContact C-N 3.32Å; V488-Y491 WeakPolarHBondContact O-CB 3.47Å; V488-Y491 PolarHBondContact O-N 3.01Å; V488-G492 PolarHBondContact O-N 3.3Å; V488-C545 HydrophobicContact CG1-CB 3.96Å; V488-R553 HydrophobicContact CG1-CB 4.07Å; V488-P554 WeakPolarHBondContact CG1-O 3.43Å; V488-P554 WeakPolarHBondContact CG2-O 3.44Å; V488-F556 HydrophobicContact CG2-CD2 4.1Å; V488-F556 HydrophobicContact CG2-CE2 3.82Å; V488-F556 HydrophobicContact CG2-CZ 4.37Å; V488-I559 HydrophobicContact CB-CD1 4.48Å; V488-I559 HydrophobicContact CG1-CD1 3.76Å; V488-I559 HydrophobicContact CG2-CD1 4.04Å
489	Y	97.8	Very high	93.7	Very high	1 Å²	1	19.3 Å²	19.3	0%	0.004	11%	0.108	C	C	.	.	H	α-helix	trans	-63.3	-47.7	174.6	-173.6	-85.4	0	0	0	111.7	M469 A470 P471 Q485 S486 D487 Y491 G492 V493 L546	M469-Y489 VanDerWaalsContact O-CE1 3.27Å; M469-Y489 WeakPolarHBondContact O-CE1 3.5Å; A470-Y489 VanDerWaalsContact CA-CD1 3.44Å; A470-Y489 HydrophobicContact CB-CD1 3.93Å; A470-Y489 HydrophobicContact CB-CD2 4.43Å; A470-Y489 HydrophobicContact CB-CG 3.76Å; P471-Y489 HydrophobicContact CG-CE2 4.21Å; Q485-Y489 PolarHBondContact O-N 3.39Å; Q485-Y489 VanDerWaalsContact O-N 3.1Å; S486-Y489 PolarHBondContact O-N 2.86Å; D487-Y489 VanDerWaalsContact C-N 3.29Å; D487-Y489 PolarHBondContact O-N 3.24Å; Y489-Y491 PolarHBondContact O-N 2.9Å; Y489-G492 WeakPolarHBondContact O-CA 3.41Å; Y489-G492 PolarHBondContact O-N 2.79Å; Y489-V493 HydrophobicContact CD1-CG2 4.2Å; Y489-V493 HydrophobicContact CE1-CG2 3.88Å; Y489-V493 PolarHBondContact O-N 2.96Å; Y489-L546 HydrophobicContact CD2-CD2 4.18Å; Y489-L546 HydrophobicContact CE1-CD2 4.39Å; Y489-L546 HydrophobicContact CE2-CB 4.47Å; Y489-L546 HydrophobicContact CE2-CD2 3.93Å
490	G	96.8	Very high	94.6	Very high	3 Å²	3	14 Å²	14	3%	0.031	7%	0.071	C	C	.	.	H	α-helix	trans	-57.6	-38.9	174.9	0	0	0	0	0	112.1	W468 S486 D487 V493 V494	W468-G490 WeakPolarHBondContact O-CA 3.35Å; S486-G490 PolarHBondContact O-N 2.99Å; D487-G490 PolarHBondContact O-N 3.35Å; G490-V493 PolarHBondContact O-N 3.16Å; G490-V494 WeakPolarHBondContact O-CG2 3.39Å; G490-V494 PolarHBondContact O-N 2.88Å
491	Y	98.4	Very high	95.1	Very high	0 Å²	0	11.8 Å²	11.8	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-64	-41.2	172	180	-105.7	0	0	0	112.9	A406 T409 A410 L426 D487 V488 Y489 V493 V494 L495 F556 I559 I563	A406-Y491 PolarHBondContact O-OH 3.31Å; T409-Y491 HydrophobicContact CG2-CD2 3.87Å; T409-Y491 HydrophobicContact CG2-CE2 3.72Å; A410-Y491 HydrophobicContact CB-CE2 4.32Å; L426-Y491 HydrophobicContact CD2-CD2 4.35Å; D487-Y491 WeakPolarHBondContact O-CB 3.48Å; D487-Y491 PolarHBondContact O-N 3.11Å; V488-Y491 WeakPolarHBondContact O-CB 3.47Å; V488-Y491 PolarHBondContact O-N 3.01Å; Y489-Y491 PolarHBondContact O-N 2.9Å; Y491-V493 VanDerWaalsContact C-N 3.27Å; Y491-V493 PolarHBondContact O-N 2.93Å; Y491-V494 CarbonylContact O-C 3.59Å; Y491-V494 WeakPolarHBondContact O-CA 3.49Å; Y491-V494 WeakPolarHBondContact O-CB 3.48Å; Y491-V494 PolarHBondContact O-N 2.76Å; Y491-V494 VanDerWaalsContact O-N 3.08Å; Y491-L495 HydrophobicContact CD1-CD1 4.03Å; Y491-L495 HydrophobicContact CD1-CG 4.13Å; Y491-L495 HydrophobicContact CE1-CD1 3.48Å; Y491-L495 VanDerWaalsContact CE1-CD1 3.48Å; Y491-L495 HydrophobicContact CE1-CD2 3.99Å; Y491-L495 HydrophobicContact CE1-CG 3.66Å; Y491-L495 HydrophobicContact CE2-CD2 4.29Å; Y491-L495 HydrophobicContact CE2-CG 4.42Å; Y491-L495 PolarHBondContact O-N 3.04Å; Y491-L495 WeakPolarHBondContact OH-CD2 3.29Å; Y491-F556 AromaticContact CD1-CE1 3.9Å; Y491-F556 HydrophobicContact CD1-CE1 3.9Å; Y491-F556 HydrophobicContact CD1-CZ 4.39Å; Y491-F556 AromaticContact CD2-CE1 3.99Å; Y491-F556 HydrophobicContact CD2-CE1 3.99Å; Y491-F556 HydrophobicContact CD2-CZ 4.39Å; Y491-F556 HydrophobicContact CE1-CE1 4.31Å; Y491-F556 HydrophobicContact CE2-CE1 4.4Å; Y491-F556 AromaticContact CG-CE1 3.72Å; Y491-F556 HydrophobicContact CG-CE1 3.72Å; Y491-F556 AromaticContact CG-CZ 3.94Å; Y491-F556 HydrophobicContact CG-CZ 3.94Å; Y491-I559 HydrophobicContact CD1-CD1 4.37Å; Y491-I559 HydrophobicContact CD1-CG2 4.26Å; Y491-I559 HydrophobicContact CE1-CG2 3.53Å; Y491-I563 HydrophobicContact CE1-CD1 4.4Å; Y491-I563 WeakPolarHBondContact OH-CD1 3.46Å
492	G	97.9	Very high	95.3	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-57.9	-38.9	173.9	0	0	0	0	0	112.6	V488 Y489 L495 F496	V488-G492 PolarHBondContact O-N 3.3Å; Y489-G492 WeakPolarHBondContact O-CA 3.41Å; Y489-G492 PolarHBondContact O-N 2.79Å; G492-L495 PolarHBondContact O-N 2.84Å; G492-F496 PolarHBondContact O-N 2.8Å
493	V	97.6	Very high	95.5	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-67.4	-40.7	173.4	178.8	0	0	0	0	111.2	W468 Y489 G490 Y491 L495 F496 E497 P504 L546	W468-V493 VanDerWaalsContact CD1-CG1 3.48Å; W468-V493 HydrophobicContact CD2-CG1 4.42Å; W468-V493 HydrophobicContact CG-CB 4.29Å; W468-V493 HydrophobicContact CG-CG1 4Å; Y489-V493 HydrophobicContact CD1-CG2 4.2Å; Y489-V493 HydrophobicContact CE1-CG2 3.88Å; Y489-V493 PolarHBondContact O-N 2.96Å; G490-V493 PolarHBondContact O-N 3.16Å; Y491-V493 VanDerWaalsContact C-N 3.27Å; Y491-V493 PolarHBondContact O-N 2.93Å; V493-L495 VanDerWaalsContact C-N 3.33Å; V493-L495 PolarHBondContact O-N 2.94Å; V493-F496 VanDerWaalsContact O-CB 3.32Å; V493-F496 WeakPolarHBondContact O-CB 3.5Å; V493-F496 PolarHBondContact O-N 3.13Å; V493-F496 VanDerWaalsContact O-N 3.16Å; V493-E497 WeakPolarHBondContact O-CG 3.3Å; V493-E497 PolarHBondContact O-N 2.95Å; V493-P504 HydrophobicContact CG1-CG 3.89Å; V493-L546 HydrophobicContact CG2-CD2 3.68Å
494	V	97.9	Very high	95.5	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-61.6	-40.5	173.7	170.6	0	0	0	0	111.9	L386 I431 G490 Y491 F496 E497 L498	L386-V494 HydrophobicContact CD2-CG1 3.96Å; I431-V494 HydrophobicContact CD1-CB 4.47Å; I431-V494 HydrophobicContact CD1-CG1 3.73Å; I431-V494 HydrophobicContact CD1-CG2 3.99Å; G490-V494 WeakPolarHBondContact O-CG2 3.39Å; G490-V494 PolarHBondContact O-N 2.88Å; Y491-V494 CarbonylContact O-C 3.59Å; Y491-V494 WeakPolarHBondContact O-CA 3.49Å; Y491-V494 WeakPolarHBondContact O-CB 3.48Å; Y491-V494 PolarHBondContact O-N 2.76Å; Y491-V494 VanDerWaalsContact O-N 3.08Å; V494-F496 VanDerWaalsContact C-N 3.32Å; V494-E497 WeakPolarHBondContact CA-OE2 3.47Å; V494-E497 PolarHBondContact O-N 3.46Å; V494-L498 HydrophobicContact CG1-CD1 4.15Å; V494-L498 WeakPolarHBondContact O-CG 3.42Å; V494-L498 PolarHBondContact O-N 3.04Å
495	L	97.3	Very high	95.3	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-63.2	-40.3	174	-70.2	-176.9	0	0	0	111.8	A406 Y491 G492 V493 L498 M499 M538 L541 I542	A406-L495 HydrophobicContact CB-CD2 3.45Å; A406-L495 VanDerWaalsContact CB-CD2 3.45Å; Y491-L495 HydrophobicContact CD1-CD1 4.03Å; Y491-L495 HydrophobicContact CD1-CG 4.13Å; Y491-L495 HydrophobicContact CE1-CD1 3.48Å; Y491-L495 VanDerWaalsContact CE1-CD1 3.48Å; Y491-L495 HydrophobicContact CE1-CD2 3.99Å; Y491-L495 HydrophobicContact CE1-CG 3.66Å; Y491-L495 HydrophobicContact CE2-CD2 4.29Å; Y491-L495 HydrophobicContact CE2-CG 4.42Å; Y491-L495 PolarHBondContact O-N 3.04Å; Y491-L495 WeakPolarHBondContact OH-CD2 3.29Å; G492-L495 PolarHBondContact O-N 2.84Å; V493-L495 VanDerWaalsContact C-N 3.33Å; V493-L495 PolarHBondContact O-N 2.94Å; L495-L498 PolarHBondContact O-N 3.22Å; L495-M499 WeakPolarHBondContact O-CB 3.47Å; L495-M499 WeakPolarHBondContact O-CG 3.35Å; L495-M499 PolarHBondContact O-N 3.09Å; L495-M538 HydrophobicContact CD2-SD 4.43Å; L495-L541 HydrophobicContact CD1-CD2 4.26Å; L495-L541 HydrophobicContact CD1-CG 4.25Å; L495-I542 HydrophobicContact CB-CD1 4.12Å; L495-I542 HydrophobicContact CB-CG1 3.6Å; L495-I542 HydrophobicContact CD1-CG1 3.99Å; L495-I542 HydrophobicContact CG-CG1 4.47Å
496	F	96.3	Very high	94.8	Very high	2 Å²	2	11.4 Å²	11.4	1%	0.009	8%	0.077	C	C	.	.	H	α-helix	trans	-59.1	-46.7	173.4	174.6	-90.7	0	0	0	111.4	G492 V493 V494 L498 M499 S500 P504 P525 D526 K529 L530 I542	G492-F496 PolarHBondContact O-N 2.8Å; V493-F496 VanDerWaalsContact O-CB 3.32Å; V493-F496 WeakPolarHBondContact O-CB 3.5Å; V493-F496 PolarHBondContact O-N 3.13Å; V493-F496 VanDerWaalsContact O-N 3.16Å; V494-F496 VanDerWaalsContact C-N 3.32Å; F496-L498 PolarHBondContact O-N 3.4Å; F496-M499 PolarHBondContact O-N 3.36Å; F496-S500 WeakPolarHBondContact CE1-OG 3.42Å; F496-S500 WeakPolarHBondContact O-CB 3.46Å; F496-S500 PolarHBondContact O-N 2.89Å; F496-S500 PolarHBondContact O-OG 3.31Å; F496-P504 HydrophobicContact CD1-CB 4.24Å; F496-P504 HydrophobicContact CE1-CB 4.14Å; F496-P525 HydrophobicContact CD1-CB 4.42Å; F496-P525 HydrophobicContact CD2-CB 3.89Å; F496-P525 HydrophobicContact CE2-CB 4.1Å; F496-P525 HydrophobicContact CG-CB 4.07Å; F496-P525 HydrophobicContact CZ-CB 4.45Å; F496-D526 WeakPolarHBondContact CE2-O 3.46Å; F496-K529 HydrophobicContact CZ-CB 4.25Å; F496-L530 HydrophobicContact CD2-CD2 3.72Å; F496-L530 HydrophobicContact CE2-CD2 4.06Å; F496-I542 HydrophobicContact CB-CG2 4.48Å
497	E	95.8	Very high	94.4	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-60.4	-44.8	176.4	-68	174.7	83.6	0	0	111.8	L390 H391 S428 W468 V493 V494 M499 G501 L503	L390-E497 HydrophobicContact CD1-CB 3.94Å; H391-E497 IonicContact CD2-OE1 2.76Å; H391-E497 IonicContact CE1-OE1 2.91Å; H391-E497 IonicContact NE2-OE1 2.73Å; H391-E497 PolarHBondContact NE2-OE1 2.9Å; S428-E497 WeakPolarHBondContact CB-OE1 3.39Å; S428-E497 PolarHBondContact OG-OE1 2.87Å; S428-E497 PolarHBondContact OG-OE2 3.48Å; W468-E497 VanDerWaalsContact CE2-OE2 3.29Å; W468-E497 WeakPolarHBondContact CZ2-OE1 3.43Å; W468-E497 WeakPolarHBondContact CZ2-OE2 3.42Å; W468-E497 PolarHBondContact NE1-OE2 3.34Å; V493-E497 WeakPolarHBondContact O-CG 3.3Å; V493-E497 PolarHBondContact O-N 2.95Å; V494-E497 WeakPolarHBondContact CA-OE2 3.47Å; V494-E497 PolarHBondContact O-N 3.46Å; E497-M499 VanDerWaalsContact C-N 3.32Å; E497-M499 PolarHBondContact O-N 2.88Å; E497-G501 VanDerWaalsContact O-CA 3.25Å; E497-G501 WeakPolarHBondContact O-CA 3.27Å; E497-G501 PolarHBondContact O-N 3.37Å; E497-L503 HydrophobicContact CG-CD2 4.31Å
498	L	94.9	Very high	94	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-61.5	-39.5	178.5	-80	166.4	0	0	0	112.3	L386 L390 R402 V405 A406 V494 L495 F496	L386-L498 HydrophobicContact CD1-CD2 3.8Å; L386-L498 HydrophobicContact CD2-CD1 4.4Å; L386-L498 HydrophobicContact CD2-CD2 4.06Å; L386-L498 HydrophobicContact CD2-CG 4.19Å; L386-L498 HydrophobicContact CG-CD2 4.47Å; L390-L498 HydrophobicContact CD1-CD2 4.28Å; L390-L498 HydrophobicContact CD1-CG 4.44Å; L390-L498 HydrophobicContact CD2-CD2 4.49Å; R402-L498 VanDerWaalsContact CD-O 3.28Å; R402-L498 WeakPolarHBondContact CD-O 3.33Å; R402-L498 PolarHBondContact NH1-O 2.85Å; V405-L498 HydrophobicContact CB-CD2 4.43Å; V405-L498 HydrophobicContact CG1-CD1 4.23Å; V405-L498 HydrophobicContact CG1-CD2 4.05Å; A406-L498 HydrophobicContact CB-CD1 4.12Å; V494-L498 HydrophobicContact CG1-CD1 4.15Å; V494-L498 WeakPolarHBondContact O-CG 3.42Å; V494-L498 PolarHBondContact O-N 3.04Å; L495-L498 PolarHBondContact O-N 3.22Å; F496-L498 PolarHBondContact O-N 3.4Å
499	M	93.3	Very high	93.5	Very high	1 Å²	1	25.4 Å²	25.4	1%	0.005	15%	0.152	C	C	.	.	H	α-helix	trans	-92	-21.6	-173.4	-63.9	-58.2	141.8	0	0	114	R402 L495 F496 E497 L530 C531 M538 I542	R402-M499 HydrophobicContact CB-CE 3.53Å; R402-M499 HydrophobicContact CB-SD 4.4Å; L495-M499 WeakPolarHBondContact O-CB 3.47Å; L495-M499 WeakPolarHBondContact O-CG 3.35Å; L495-M499 PolarHBondContact O-N 3.09Å; F496-M499 PolarHBondContact O-N 3.36Å; E497-M499 VanDerWaalsContact C-N 3.32Å; E497-M499 PolarHBondContact O-N 2.88Å; M499-L530 HydrophobicContact CB-CD2 3.85Å; M499-C531 WeakPolarHBondContact O-CB 3.36Å; M499-C531 PolarHBondContact O-N 2.84Å; M499-C531 PolarHBondContact O-SG 2.79Å; M499-M538 HydrophobicContact CE-CE 4.5Å; M499-M538 HydrophobicContact CE-CG 4.32Å; M499-M538 HydrophobicContact CG-CG 4.05Å; M499-M538 HydrophobicContact SD-CG 4.13Å; M499-I542 HydrophobicContact CB-CD1 4.09Å; M499-I542 HydrophobicContact CG-CD1 3.88Å
500	S	91.9	Very high	93	Very high	15 Å²	15	29.3 Å²	29.3	11%	0.105	17%	0.172	C	C	.	.	H	α-helix	trans	-99.1	-26.1	173.7	71	0	0	0	0	113.1	F496 T502 K529	F496-S500 WeakPolarHBondContact CE1-OG 3.42Å; F496-S500 WeakPolarHBondContact O-CB 3.46Å; F496-S500 PolarHBondContact O-N 2.89Å; F496-S500 PolarHBondContact O-OG 3.31Å; S500-T502 PolarHBondContact O-N 3.34Å; S500-T502 PolarHBondContact OG-N 3Å; S500-T502 PolarHBondContact OG-O 2.97Å; S500-T502 PolarHBondContact OG-OG1 2.73Å; S500-K529 WeakPolarHBondContact CA-O 3.34Å; S500-K529 VanDerWaalsContact CB-O 3.27Å; S500-K529 WeakPolarHBondContact CB-O 3.5Å
501	G	91.2	Very high	92.6	Very high	31 Å²	31	34.4 Å²	34.4	32%	0.32	19%	0.191	S	C	.	.	S	Bend	trans	71.2	10.8	-169.1	0	0	0	0	0	113.6	E497	E497-G501 VanDerWaalsContact O-CA 3.25Å; E497-G501 WeakPolarHBondContact O-CA 3.27Å; E497-G501 PolarHBondContact O-N 3.37Å
502	T	91.6	Very high	92.1	Very high	50 Å²	50	39.2 Å²	39.2	31%	0.307	22%	0.217	S	C	.	.	S	Bend	trans	-130.3	155	-176.3	63.9	0	0	0	0	111.4	S500	S500-T502 PolarHBondContact O-N 3.34Å; S500-T502 PolarHBondContact OG-N 3Å; S500-T502 PolarHBondContact OG-O 2.97Å; S500-T502 PolarHBondContact OG-OG1 2.73Å
503	L	92.6	Very high	91.8	Very high	40 Å²	40	42.8 Å²	42.8	21%	0.209	23%	0.233	C	C	.	.			trans	-72.6	147.4	169.2	-70.6	172	0	0	0	110.8	Y387 L467 W468 E497	Y387-L503 HydrophobicContact CE2-CD1 4.12Å; Y387-L503 HydrophobicContact CE2-CD2 4.03Å; L467-L503 HydrophobicContact CD1-CB 4.29Å; L467-L503 HydrophobicContact CD1-CD1 4.27Å; L467-L503 HydrophobicContact CD1-CD2 4.16Å; L467-L503 HydrophobicContact CD1-CG 4.48Å; W468-L503 HydrophobicContact CH2-CD2 3.88Å; W468-L503 HydrophobicContact CZ2-CD2 3.96Å; E497-L503 HydrophobicContact CG-CD2 4.31Å
504	P	92.3	Very high	91.5	Very high	3 Å²	3	43.3 Å²	43.3	2%	0.019	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	154.2	174.7	32.7	-38.8	0	0	0	110.4	L467 V493 F496 S506 P525	L467-P504 HydrophobicContact CB-CG 3.92Å; V493-P504 HydrophobicContact CG1-CG 3.89Å; F496-P504 HydrophobicContact CD1-CB 4.24Å; F496-P504 HydrophobicContact CE1-CB 4.14Å; P504-S506 PolarHBondContact O-N 3.43Å; P504-P525 HydrophobicContact CB-CB 4.15Å; P504-P525 HydrophobicContact CB-CG 4.15Å
505	Y	91.3	Very high	91.1	Very high	11 Å²	11	44.2 Å²	44.2	4%	0.043	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.4	28.6	174.9	-31	-55.3	0	0	0	114.3	L467 N507 I508 I514 V518 L523 P525	L467-Y505 HydrophobicContact CD2-CD2 3.78Å; L467-Y505 HydrophobicContact CD2-CE2 4.37Å; Y505-N507 PolarHBondContact O-N 3.23Å; Y505-I508 PolarHBondContact O-N 3.31Å; Y505-I514 HydrophobicContact CD2-CD1 4.42Å; Y505-I514 HydrophobicContact CD2-CG2 3.65Å; Y505-I514 HydrophobicContact CE2-CG2 3.97Å; Y505-I514 HydrophobicContact CG-CG2 4.36Å; Y505-V518 HydrophobicContact CE1-CG2 4.36Å; Y505-V518 HydrophobicContact CE2-CG2 4.07Å; Y505-L523 HydrophobicContact CD1-CD1 3.88Å; Y505-L523 HydrophobicContact CD1-CD2 3.56Å; Y505-L523 HydrophobicContact CD1-CG 3.57Å; Y505-L523 HydrophobicContact CE1-CD1 4.21Å; Y505-L523 HydrophobicContact CE1-CD2 3.9Å; Y505-L523 HydrophobicContact CE1-CG 3.59Å; Y505-L523 HydrophobicContact CG-CD2 3.89Å; Y505-L523 HydrophobicContact CG-CG 4.39Å; Y505-P525 HydrophobicContact CE1-CG 4.19Å
506	S	86.2	Confident	90.8	Very high	73 Å²	73	49.9 Å²	49.9	51%	0.51	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-13.9	-178.5	71	0	0	0	0	115	P504 K529	P504-S506 PolarHBondContact O-N 3.43Å; S506-K529 PolarHBondContact OG-NZ 3.21Å
507	N	87.1	Confident	90.7	Very high	120 Å²	120	51.8 Å²	51.8	64%	0.642	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-2.7	176.8	60.4	-51.4	0	0	0	113.9	Y505	Y505-N507 PolarHBondContact O-N 3.23Å
508	I	88.3	Confident	90.5	Very high	24 Å²	24	52 Å²	52	12%	0.123	28%	0.276	C	S	.	.			trans	-120.4	117	-178.1	-56.6	175	0	0	0	109	Y505 Q513 I514 M517 L523	Y505-I508 PolarHBondContact O-N 3.31Å; I508-Q513 HydrophobicContact CG2-CB 4.34Å; I508-Q513 HydrophobicContact CG2-CG 4.21Å; I508-I514 HydrophobicContact CB-CD1 4.31Å; I508-I514 HydrophobicContact CB-CG1 4.06Å; I508-I514 HydrophobicContact CG2-CD1 4.22Å; I508-I514 HydrophobicContact CG2-CG1 3.66Å; I508-M517 HydrophobicContact CD1-SD 4.34Å; I508-L523 HydrophobicContact CD1-CD1 3.99Å; I508-L523 HydrophobicContact CD1-CD2 3.62Å; I508-L523 HydrophobicContact CD1-CG 4.49Å
509	N	86.1	Confident	90.3	Very high	160 Å²	160	52.2 Å²	52.2	86%	0.856	28%	0.278	S	S	*	.			trans	-93.8	-12.5	-176.1	-62.8	-8.3	0	0	0	113
510	N	89.2	Confident	90.2	Very high	82 Å²	82	59.8 Å²	59.8	44%	0.439	31%	0.307	S	S	.	.			trans	-93.4	117	-178.4	-174.5	-26.7	0	0	0	111.3	D512 Q513 I514	N510-D512 PolarHBondContact O-N 3.48Å; N510-D512 PolarHBondContact OD1-N 2.98Å; N510-Q513 HydrophobicContact CB-CB 3.79Å; N510-Q513 WeakPolarHBondContact O-CB 3.37Å; N510-Q513 PolarHBondContact O-N 3.29Å; N510-Q513 PolarHBondContact OD1-N 3.27Å; N510-I514 WeakPolarHBondContact O-CG1 3.3Å; N510-I514 PolarHBondContact O-N 3.13Å; N510-I514 VanDerWaalsContact O-N 3.14Å
511	R	87.3	Confident	90.1	Very high	110 Å²	110	60.5 Å²	60.5	42%	0.415	32%	0.317	S	S	.	.	H	α-helix	trans	-58.9	-46.3	178.9	-177.2	-169.1	171.1	173.4	-8.5	113	P462 I466 Q513 I514 L515	P462-R511 PolarHBondContact O-NH2 2.94Å; I466-R511 HydrophobicContact CD1-CB 4.31Å; I466-R511 HydrophobicContact CD1-CG 3.51Å; I466-R511 HydrophobicContact CG1-CG 4.23Å; I466-R511 HydrophobicContact CG2-CG 4.39Å; R511-Q513 VanDerWaalsContact C-N 3.3Å; R511-I514 PolarHBondContact O-N 3.35Å; R511-L515 HydrophobicContact CG-CD1 4.4Å; R511-L515 PolarHBondContact O-N 3.16Å
512	D	88.3	Confident	90	Very high	102 Å²	102	66.9 Å²	66.9	55%	0.545	33%	0.332	S	S	.	.	H	α-helix	trans	-71.7	-32.7	-175.1	-62.5	-33.6	0	0	0	110.9	N510 L515 F516	N510-D512 PolarHBondContact O-N 3.48Å; N510-D512 PolarHBondContact OD1-N 2.98Å; D512-L515 PolarHBondContact O-N 3.03Å; D512-F516 WeakPolarHBondContact O-CB 3.46Å; D512-F516 PolarHBondContact O-N 2.79Å
513	Q	92	Very high	89.9	Confident	74 Å²	74	65.5 Å²	65.5	35%	0.346	32%	0.323	S	S	.	.	H	α-helix	trans	-61	-46.8	170.6	-174.4	179	15.4	0	0	111.3	I508 N510 R511 F516 M517	I508-Q513 HydrophobicContact CG2-CB 4.34Å; I508-Q513 HydrophobicContact CG2-CG 4.21Å; N510-Q513 HydrophobicContact CB-CB 3.79Å; N510-Q513 WeakPolarHBondContact O-CB 3.37Å; N510-Q513 PolarHBondContact O-N 3.29Å; N510-Q513 PolarHBondContact OD1-N 3.27Å; R511-Q513 VanDerWaalsContact C-N 3.3Å; Q513-F516 PolarHBondContact O-N 3.47Å; Q513-M517 HydrophobicContact CG-CG 4.29Å; Q513-M517 HydrophobicContact CG-SD 3.7Å; Q513-M517 WeakPolarHBondContact O-CB 3.4Å; Q513-M517 VanDerWaalsContact O-CG 3.23Å; Q513-M517 WeakPolarHBondContact O-CG 3.42Å; Q513-M517 PolarHBondContact O-N 3.26Å
514	I	90.5	Very high	89.8	Confident	11 Å²	11	66.5 Å²	66.5	6%	0.056	33%	0.333	C	S	.	.	H	α-helix	trans	-60	-49.2	176.3	-65.6	169.3	0	0	0	110.2	I466 L467 Y505 I508 N510 R511 F516 M517 V518 L523	I466-I514 HydrophobicContact CD1-CB 3.93Å; I466-I514 HydrophobicContact CD1-CD1 4.37Å; I466-I514 HydrophobicContact CD1-CG2 3.86Å; L467-I514 HydrophobicContact CD2-CD1 4.27Å; Y505-I514 HydrophobicContact CD2-CD1 4.42Å; Y505-I514 HydrophobicContact CD2-CG2 3.65Å; Y505-I514 HydrophobicContact CE2-CG2 3.97Å; Y505-I514 HydrophobicContact CG-CG2 4.36Å; I508-I514 HydrophobicContact CB-CD1 4.31Å; I508-I514 HydrophobicContact CB-CG1 4.06Å; I508-I514 HydrophobicContact CG2-CD1 4.22Å; I508-I514 HydrophobicContact CG2-CG1 3.66Å; N510-I514 WeakPolarHBondContact O-CG1 3.3Å; N510-I514 PolarHBondContact O-N 3.13Å; N510-I514 VanDerWaalsContact O-N 3.14Å; R511-I514 PolarHBondContact O-N 3.35Å; I514-F516 VanDerWaalsContact C-N 3.34Å; I514-F516 PolarHBondContact O-N 2.79Å; I514-M517 PolarHBondContact O-N 2.98Å; I514-V518 HydrophobicContact CG2-CG2 4.01Å; I514-V518 WeakPolarHBondContact O-CB 3.31Å; I514-V518 VanDerWaalsContact O-CG2 3.27Å; I514-V518 WeakPolarHBondContact O-CG2 3.34Å; I514-V518 PolarHBondContact O-N 2.96Å; I514-L523 HydrophobicContact CG1-CD2 4.47Å; I514-L523 HydrophobicContact CG2-CD2 4.38Å
515	L	90.6	Very high	89.8	Confident	20 Å²	20	66.5 Å²	66.5	11%	0.105	33%	0.333	C	S	.	.	H	α-helix	trans	-56.7	-48.3	178.7	-75	172.1	0	0	0	111.6	P462 I466 I474 R511 D512 G519	P462-L515 HydrophobicContact CB-CD1 4.47Å; P462-L515 HydrophobicContact CB-CD2 4.2Å; P462-L515 HydrophobicContact CG-CD2 4.39Å; I466-L515 HydrophobicContact CB-CD2 3.89Å; I466-L515 HydrophobicContact CB-CG 4.39Å; I466-L515 HydrophobicContact CD1-CG 4.18Å; I466-L515 HydrophobicContact CG2-CD1 4.2Å; I466-L515 HydrophobicContact CG2-CD2 3.73Å; I466-L515 HydrophobicContact CG2-CG 4.13Å; I474-L515 HydrophobicContact CD1-CD2 4.06Å; I474-L515 HydrophobicContact CG1-CD2 3.91Å; I474-L515 HydrophobicContact CG2-CB 4.26Å; I474-L515 HydrophobicContact CG2-CD2 3.89Å; I474-L515 WeakPolarHBondContact CG2-O 3.47Å; R511-L515 HydrophobicContact CG-CD1 4.4Å; R511-L515 PolarHBondContact O-N 3.16Å; D512-L515 PolarHBondContact O-N 3.03Å; L515-G519 WeakPolarHBondContact O-CA 3.47Å; L515-G519 PolarHBondContact O-N 2.83Å
516	F	90.4	Very high	89.6	Confident	119 Å²	119	69 Å²	69	52%	0.522	35%	0.347	S	S	.	.	H	α-helix	trans	-61.5	-50.9	179	178.9	-96.9	0	0	0	111.8	D512 Q513 I514 G519 R520 Y522	D512-F516 WeakPolarHBondContact O-CB 3.46Å; D512-F516 PolarHBondContact O-N 2.79Å; Q513-F516 PolarHBondContact O-N 3.47Å; I514-F516 VanDerWaalsContact C-N 3.34Å; I514-F516 PolarHBondContact O-N 2.79Å; F516-G519 PolarHBondContact O-N 2.83Å; F516-R520 HydrophobicContact CD2-CG 4.3Å; F516-R520 HydrophobicContact CE1-CG 4.27Å; F516-R520 HydrophobicContact CE2-CG 4.03Å; F516-R520 HydrophobicContact CZ-CG 4.02Å; F516-R520 VanDerWaalsContact O-CB 3.3Å; F516-R520 WeakPolarHBondContact O-CB 3.33Å; F516-R520 VanDerWaalsContact O-CG 3.24Å; F516-R520 WeakPolarHBondContact O-CG 3.23Å; F516-R520 PolarHBondContact O-N 3.4Å; F516-Y522 HydrophobicContact CE1-CD2 4.5Å; F516-Y522 HydrophobicContact CE1-CE2 4.38Å
517	M	93.2	Very high	89.6	Confident	42 Å²	42	66.8 Å²	66.8	21%	0.207	33%	0.329	C	S	.	.	H	α-helix	trans	-68.6	-41.4	-175.3	-64.4	177.8	73	0	0	112.2	I508 Q513 I514 G521 Y522 L523	I508-M517 HydrophobicContact CD1-SD 4.34Å; Q513-M517 HydrophobicContact CG-CG 4.29Å; Q513-M517 HydrophobicContact CG-SD 3.7Å; Q513-M517 WeakPolarHBondContact O-CB 3.4Å; Q513-M517 VanDerWaalsContact O-CG 3.23Å; Q513-M517 WeakPolarHBondContact O-CG 3.42Å; Q513-M517 PolarHBondContact O-N 3.26Å; I514-M517 PolarHBondContact O-N 2.98Å; M517-G521 PolarHBondContact O-N 3.29Å; M517-G521 VanDerWaalsContact O-N 3.13Å; M517-Y522 PolarHBondContact O-N 2.94Å; M517-L523 HydrophobicContact CB-CB 3.52Å; M517-L523 HydrophobicContact CB-CD2 4.15Å; M517-L523 HydrophobicContact CB-CG 4.47Å; M517-L523 HydrophobicContact CE-CB 4.32Å; M517-L523 PolarHBondContact O-N 3.4Å
518	V	92.7	Very high	89.4	Confident	3 Å²	3	62.5 Å²	62.5	2%	0.018	31%	0.314	C	S	.	.	H	α-helix	trans	-67.2	-46	175.6	177.4	0	0	0	0	110.3	P471 I474 Y505 I514 R520 G521 L523	P471-V518 HydrophobicContact CG-CG1 4.12Å; I474-V518 HydrophobicContact CD1-CB 3.89Å; I474-V518 HydrophobicContact CD1-CG1 3.63Å; Y505-V518 HydrophobicContact CE1-CG2 4.36Å; Y505-V518 HydrophobicContact CE2-CG2 4.07Å; I514-V518 HydrophobicContact CG2-CG2 4.01Å; I514-V518 WeakPolarHBondContact O-CB 3.31Å; I514-V518 VanDerWaalsContact O-CG2 3.27Å; I514-V518 WeakPolarHBondContact O-CG2 3.34Å; I514-V518 PolarHBondContact O-N 2.96Å; V518-R520 VanDerWaalsContact C-N 3.27Å; V518-R520 PolarHBondContact O-N 3.42Å; V518-G521 PolarHBondContact O-N 3.18Å; V518-G521 VanDerWaalsContact O-N 3.09Å; V518-L523 HydrophobicContact CG2-CB 4.05Å; V518-L523 HydrophobicContact CG2-CD2 3.99Å; V518-L523 HydrophobicContact CG2-CG 4.16Å
519	G	90.6	Very high	89.3	Confident	5 Å²	5	64.7 Å²	64.7	5%	0.052	32%	0.323	C	S	.	.	H	α-helix	trans	-60.6	-35	179.8	0	0	0	0	0	113.2	R475 L515 F516	R475-G519 WeakPolarHBondContact CD-O 3.42Å; R475-G519 PolarHBondContact NH1-O 2.91Å; L515-G519 WeakPolarHBondContact O-CA 3.47Å; L515-G519 PolarHBondContact O-N 2.83Å; F516-G519 PolarHBondContact O-N 2.83Å
520	R	90.6	Very high	89.3	Confident	160 Å²	160	57.5 Å²	57.5	60%	0.604	28%	0.284	S	S	*	.	H	α-helix	trans	-83.1	-12.2	176.3	-70.2	-68.1	-175.6	176	0.5	114.7	F516 V518 Y522	F516-R520 HydrophobicContact CD2-CG 4.3Å; F516-R520 HydrophobicContact CE1-CG 4.27Å; F516-R520 HydrophobicContact CE2-CG 4.03Å; F516-R520 HydrophobicContact CZ-CG 4.02Å; F516-R520 VanDerWaalsContact O-CB 3.3Å; F516-R520 WeakPolarHBondContact O-CB 3.33Å; F516-R520 VanDerWaalsContact O-CG 3.24Å; F516-R520 WeakPolarHBondContact O-CG 3.23Å; F516-R520 PolarHBondContact O-N 3.4Å; V518-R520 VanDerWaalsContact C-N 3.27Å; V518-R520 PolarHBondContact O-N 3.42Å; R520-Y522 HydrophobicContact CB-CD2 3.69Å; R520-Y522 HydrophobicContact CB-CE1 4.46Å; R520-Y522 HydrophobicContact CB-CE2 3.64Å; R520-Y522 HydrophobicContact CB-CG 4.15Å; R520-Y522 HydrophobicContact CG-CD2 4.49Å; R520-Y522 HydrophobicContact CG-CE2 4.17Å
521	G	89.2	Confident	88.8	Confident	30 Å²	30	55.5 Å²	55.5	31%	0.309	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.2	12.6	-178.3	0	0	0	0	0	115	M517 V518 F548	M517-G521 PolarHBondContact O-N 3.29Å; M517-G521 VanDerWaalsContact O-N 3.13Å; V518-G521 PolarHBondContact O-N 3.18Å; V518-G521 VanDerWaalsContact O-N 3.09Å; G521-F548 VanDerWaalsContact CA-CE1 3.43Å; G521-F548 WeakPolarHBondContact O-CZ 3.48Å
522	Y	89.7	Confident	88.3	Confident	165 Å²	165	55.7 Å²	55.7	65%	0.647	29%	0.294	S	S	*	.			trans	-89	-17.7	-179	-56.7	-30.3	0	0	0	113.5	F516 M517 R520	F516-Y522 HydrophobicContact CE1-CD2 4.5Å; F516-Y522 HydrophobicContact CE1-CE2 4.38Å; M517-Y522 PolarHBondContact O-N 2.94Å; R520-Y522 HydrophobicContact CB-CD2 3.69Å; R520-Y522 HydrophobicContact CB-CE1 4.46Å; R520-Y522 HydrophobicContact CB-CE2 3.64Å; R520-Y522 HydrophobicContact CB-CG 4.15Å; R520-Y522 HydrophobicContact CG-CD2 4.49Å; R520-Y522 HydrophobicContact CG-CE2 4.17Å
523	L	90.5	Very high	87.6	Confident	22 Å²	22	55.3 Å²	55.3	12%	0.115	30%	0.296	C	S	.	.			trans	-127.8	129	-177.3	-175.6	65.5	0	0	0	111.2	Y505 I508 I514 M517 V518 F548	Y505-L523 HydrophobicContact CD1-CD1 3.88Å; Y505-L523 HydrophobicContact CD1-CD2 3.56Å; Y505-L523 HydrophobicContact CD1-CG 3.57Å; Y505-L523 HydrophobicContact CE1-CD1 4.21Å; Y505-L523 HydrophobicContact CE1-CD2 3.9Å; Y505-L523 HydrophobicContact CE1-CG 3.59Å; Y505-L523 HydrophobicContact CG-CD2 3.89Å; Y505-L523 HydrophobicContact CG-CG 4.39Å; I508-L523 HydrophobicContact CD1-CD1 3.99Å; I508-L523 HydrophobicContact CD1-CD2 3.62Å; I508-L523 HydrophobicContact CD1-CG 4.49Å; I514-L523 HydrophobicContact CG1-CD2 4.47Å; I514-L523 HydrophobicContact CG2-CD2 4.38Å; M517-L523 HydrophobicContact CB-CB 3.52Å; M517-L523 HydrophobicContact CB-CD2 4.15Å; M517-L523 HydrophobicContact CB-CG 4.47Å; M517-L523 HydrophobicContact CE-CB 4.32Å; M517-L523 PolarHBondContact O-N 3.4Å; V518-L523 HydrophobicContact CG2-CB 4.05Å; V518-L523 HydrophobicContact CG2-CD2 3.99Å; V518-L523 HydrophobicContact CG2-CG 4.16Å; L523-F548 VanDerWaalsContact O-CZ 3.29Å; L523-F548 WeakPolarHBondContact O-CZ 3.2Å
524	S	90.3	Very high	87	Confident	61 Å²	61	52.2 Å²	52.2	43%	0.427	28%	0.282	S	S	.	.			trans	-134.3	155.3	173.3	65.3	0	0	0	0	109.8	D526	S524-D526 PolarHBondContact O-N 3.24Å
525	P	91.1	Very high	86.6	Confident	3 Å²	3	53 Å²	53	2%	0.019	29%	0.288	C	S	.	.			trans	-55.8	134.5	178.6	-28.4	38.1	0	0	0	111.6	F496 P504 Y505 L527 L546	F496-P525 HydrophobicContact CD1-CB 4.42Å; F496-P525 HydrophobicContact CD2-CB 3.89Å; F496-P525 HydrophobicContact CE2-CB 4.1Å; F496-P525 HydrophobicContact CG-CB 4.07Å; F496-P525 HydrophobicContact CZ-CB 4.45Å; P504-P525 HydrophobicContact CB-CB 4.15Å; P504-P525 HydrophobicContact CB-CG 4.15Å; Y505-P525 HydrophobicContact CE1-CG 4.19Å; P525-L527 PolarHBondContact O-N 3.06Å; P525-L527 VanDerWaalsContact O-N 3.1Å; P525-L546 HydrophobicContact CB-CD1 4.1Å; P525-L546 HydrophobicContact CG-CD1 3.79Å; P525-L546 HydrophobicContact CG-CD2 4.24Å
526	D	87.9	Confident	86.1	Confident	62 Å²	62	56.5 Å²	56.5	33%	0.332	30%	0.303	S	S	.	.			trans	-73.6	101	-175.8	174.1	13.4	0	0	0	111.7	F496 S524 G528 K529	F496-D526 WeakPolarHBondContact CE2-O 3.46Å; S524-D526 PolarHBondContact O-N 3.24Å; D526-G528 PolarHBondContact O-N 2.95Å; D526-G528 PolarHBondContact OD1-N 3.02Å; D526-K529 HydrophobicContact CB-CD 4.33Å; D526-K529 HydrophobicContact CB-CG 4.46Å; D526-K529 WeakPolarHBondContact O-CB 3.35Å; D526-K529 PolarHBondContact O-N 3.02Å; D526-K529 VanDerWaalsContact O-N 3.14Å; D526-K529 WeakPolarHBondContact OD2-CE 3.4Å
527	L	86.3	Confident	85.8	Confident	27 Å²	27	53.1 Å²	53.1	14%	0.141	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-68.8	-12.2	-176.9	-55.6	169	0	0	0	113.5	P525 K529 L530 I542 I543	P525-L527 PolarHBondContact O-N 3.06Å; P525-L527 VanDerWaalsContact O-N 3.1Å; L527-K529 PolarHBondContact O-N 2.86Å; L527-L530 HydrophobicContact CB-CD1 4.26Å; L527-L530 HydrophobicContact CD2-CD1 4.01Å; L527-L530 WeakPolarHBondContact O-CG 3.33Å; L527-L530 PolarHBondContact O-N 3.49Å; L527-I542 HydrophobicContact CD2-CG2 4.06Å; L527-I543 HydrophobicContact CD1-CD1 3.78Å; L527-I543 HydrophobicContact CD1-CG1 3.43Å; L527-I543 VanDerWaalsContact CD1-CG1 3.43Å; L527-I543 HydrophobicContact CD2-CG1 4.13Å; L527-I543 HydrophobicContact CG-CG1 4.42Å
528	G	82.5	Confident	85.5	Confident	31 Å²	31	51.1 Å²	51.1	32%	0.32	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-63.3	-28.6	170.8	0	0	0	0	0	112.2	D526 L530	D526-G528 PolarHBondContact O-N 2.95Å; D526-G528 PolarHBondContact OD1-N 3.02Å; G528-L530 VanDerWaalsContact C-N 3.27Å; G528-L530 PolarHBondContact O-N 2.82Å
529	K	86.4	Confident	85.3	Confident	69 Å²	69	52 Å²	52	30%	0.3	29%	0.287	S	S	.	.	G	3₁₀ helix	trans	-77	-5.9	179.7	-65	179.6	179.1	174.6	0	114.8	F496 S500 S506 D526 L527	F496-K529 HydrophobicContact CZ-CB 4.25Å; S500-K529 WeakPolarHBondContact CA-O 3.34Å; S500-K529 VanDerWaalsContact CB-O 3.27Å; S500-K529 WeakPolarHBondContact CB-O 3.5Å; S506-K529 PolarHBondContact OG-NZ 3.21Å; D526-K529 HydrophobicContact CB-CD 4.33Å; D526-K529 HydrophobicContact CB-CG 4.46Å; D526-K529 WeakPolarHBondContact O-CB 3.35Å; D526-K529 PolarHBondContact O-N 3.02Å; D526-K529 VanDerWaalsContact O-N 3.14Å; D526-K529 WeakPolarHBondContact OD2-CE 3.4Å; L527-K529 PolarHBondContact O-N 2.86Å
530	L	86.7	Confident	85.1	Confident	10 Å²	10	53.9 Å²	53.9	5%	0.052	29%	0.293	C	S	.	.	S	Bend	trans	-67.8	134.7	178	-62	178.7	0	0	0	110.1	F496 M499 L527 G528 S532 K539 I542	F496-L530 HydrophobicContact CD2-CD2 3.72Å; F496-L530 HydrophobicContact CE2-CD2 4.06Å; M499-L530 HydrophobicContact CB-CD2 3.85Å; L527-L530 HydrophobicContact CB-CD1 4.26Å; L527-L530 HydrophobicContact CD2-CD1 4.01Å; L527-L530 WeakPolarHBondContact O-CG 3.33Å; L527-L530 PolarHBondContact O-N 3.49Å; G528-L530 VanDerWaalsContact C-N 3.27Å; G528-L530 PolarHBondContact O-N 2.82Å; L530-S532 PolarHBondContact O-N 2.83Å; L530-K539 HydrophobicContact CD1-CB 4.26Å; L530-K539 HydrophobicContact CD1-CD 4.35Å; L530-K539 HydrophobicContact CD1-CG 3.92Å; L530-I542 HydrophobicContact CD1-CD1 4.23Å; L530-I542 HydrophobicContact CD2-CD1 4.07Å
531	C	79	Confident	85.1	Confident	39 Å²	39	46.6 Å²	46.6	26%	0.264	27%	0.266	S	S	.	.			trans	-52.6	136	179.6	-69.1	0	0	0	0	111.2	M499 T533 S534	M499-C531 WeakPolarHBondContact O-CB 3.36Å; M499-C531 PolarHBondContact O-N 2.84Å; M499-C531 PolarHBondContact O-SG 2.79Å; C531-T533 PolarHBondContact O-N 2.82Å; C531-T533 VanDerWaalsContact O-N 3.15Å; C531-S534 WeakPolarHBondContact O-CB 3.32Å; C531-S534 PolarHBondContact O-N 3.21Å; C531-S534 PolarHBondContact O-OG 3.46Å
532	S	75.4	Confident	85.4	Confident	114 Å²	114	45.2 Å²	45.2	80%	0.797	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-27.6	178.9	56	0	0	0	0	113	L530 S534	L530-S532 PolarHBondContact O-N 2.83Å; S532-S534 VanDerWaalsContact C-N 3.25Å; S532-S534 PolarHBondContact O-N 2.87Å
533	T	74.2	Confident	85.4	Confident	95 Å²	95	38.9 Å²	38.9	58%	0.583	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-5.7	175.2	56.1	0	0	0	0	114.3	C531	C531-T533 PolarHBondContact O-N 2.82Å; C531-T533 VanDerWaalsContact O-N 3.15Å
534	S	78.4	Confident	85.5	Confident	9 Å²	9	40.1 Å²	40.1	6%	0.063	24%	0.235	C	C	.	.	S	Bend	trans	-71.8	127.2	-179.6	-55	0	0	0	0	110.8	C531 S532 K536	C531-S534 WeakPolarHBondContact O-CB 3.32Å; C531-S534 PolarHBondContact O-N 3.21Å; C531-S534 PolarHBondContact O-OG 3.46Å; S532-S534 VanDerWaalsContact C-N 3.25Å; S532-S534 PolarHBondContact O-N 2.87Å; S534-K536 PolarHBondContact O-N 2.86Å
535	P	83.1	Confident	85.8	Confident	26 Å²	26	37.2 Å²	37.2	17%	0.169	22%	0.215	C	C	.	.			trans	-55.2	139.7	178.3	-27.6	35.8	0	0	0	112.5	I403 S537 M538 K539 V566 M570	I403-P535 HydrophobicContact CD1-CG 4.32Å; P535-S537 PolarHBondContact O-N 3.38Å; P535-S537 VanDerWaalsContact O-N 3.15Å; P535-M538 HydrophobicContact CB-CB 4.34Å; P535-M538 WeakPolarHBondContact O-CA 3.37Å; P535-M538 WeakPolarHBondContact O-CB 2.96Å; P535-M538 PolarHBondContact O-N 2.89Å; P535-K539 PolarHBondContact O-N 3.44Å; P535-K539 VanDerWaalsContact O-N 3.15Å; P535-V566 HydrophobicContact CB-CG1 3.77Å; P535-V566 HydrophobicContact CG-CG1 3.77Å; P535-M570 HydrophobicContact CG-SD 3.55Å; P535-M570 VanDerWaalsContact CG-SD 3.55Å
536	K	79.7	Confident	86	Confident	95 Å²	95	37.8 Å²	37.8	41%	0.413	22%	0.218	S	C	.	.	H	α-helix	trans	-54.3	-37.4	179.5	-68.3	-169.2	173.6	-163.1	0	112.5	D150 D152 S534 M538 K539 R540	D150-K536 IonicContact OD1-NZ 2.92Å; D150-K536 PolarHBondContact OD1-NZ 3.01Å; D150-K536 IonicContact OD2-NZ 3.63Å; D152-K536 WeakPolarHBondContact OD1-CE 3.26Å; D152-K536 IonicContact OD1-NZ 3.68Å; D152-K536 VanDerWaalsContact OD2-CE 3.24Å; D152-K536 WeakPolarHBondContact OD2-CE 3.48Å; D152-K536 IonicContact OD2-NZ 2.69Å; D152-K536 PolarHBondContact OD2-NZ 2.87Å; S534-K536 PolarHBondContact O-N 2.86Å; K536-M538 VanDerWaalsContact C-N 3.34Å; K536-K539 PolarHBondContact O-N 3.37Å; K536-R540 PolarHBondContact O-N 3.27Å; K536-R540 VanDerWaalsContact O-N 3.09Å
537	S	83.6	Confident	86.3	Confident	47 Å²	47	38.4 Å²	38.4	33%	0.329	22%	0.217	S	C	.	.	H	α-helix	trans	-63.3	-36.7	175.1	44.7	0	0	0	0	113	P535 R540 L541 V566	P535-S537 PolarHBondContact O-N 3.38Å; P535-S537 VanDerWaalsContact O-N 3.15Å; S537-R540 PolarHBondContact O-N 3.4Å; S537-L541 PolarHBondContact O-N 3.01Å; S537-V566 WeakPolarHBondContact OG-CG2 3.4Å
538	M	88.3	Confident	86.5	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-68.3	-44.2	175.8	-175.9	58.3	73.5	0	0	111.1	I403 L495 M499 P535 K536 R540 L541 I542 I563 V566	I403-M538 HydrophobicContact CG1-CE 4.03Å; L495-M538 HydrophobicContact CD2-SD 4.43Å; M499-M538 HydrophobicContact CE-CE 4.5Å; M499-M538 HydrophobicContact CE-CG 4.32Å; M499-M538 HydrophobicContact CG-CG 4.05Å; M499-M538 HydrophobicContact SD-CG 4.13Å; P535-M538 HydrophobicContact CB-CB 4.34Å; P535-M538 WeakPolarHBondContact O-CA 3.37Å; P535-M538 WeakPolarHBondContact O-CB 2.96Å; P535-M538 PolarHBondContact O-N 2.89Å; K536-M538 VanDerWaalsContact C-N 3.34Å; M538-R540 VanDerWaalsContact C-N 3.28Å; M538-R540 PolarHBondContact O-N 3.25Å; M538-L541 PolarHBondContact O-N 3.14Å; M538-L541 HydrophobicContact SD-CD2 4.32Å; M538-I542 HydrophobicContact CG-CD1 4.33Å; M538-I542 WeakPolarHBondContact O-CG1 3.21Å; M538-I542 PolarHBondContact O-N 3.42Å; M538-I563 HydrophobicContact CE-CG1 4.46Å; M538-V566 HydrophobicContact CB-CG1 4.35Å; M538-V566 HydrophobicContact CE-CG1 4.26Å
539	K	87.8	Confident	87	Confident	21 Å²	21	45.2 Å²	45.2	9%	0.091	24%	0.237	C	C	.	.	H	α-helix	trans	-57.5	-42.9	175.2	-62.1	-170.7	178.4	-175.6	0	111.5	L530 P535 K536 I542 I543	L530-K539 HydrophobicContact CD1-CB 4.26Å; L530-K539 HydrophobicContact CD1-CD 4.35Å; L530-K539 HydrophobicContact CD1-CG 3.92Å; P535-K539 PolarHBondContact O-N 3.44Å; P535-K539 VanDerWaalsContact O-N 3.15Å; K536-K539 PolarHBondContact O-N 3.37Å; K539-I542 PolarHBondContact O-N 2.83Å; K539-I543 WeakPolarHBondContact O-CD1 3.45Å; K539-I543 WeakPolarHBondContact O-CG1 3.37Å; K539-I543 PolarHBondContact O-N 2.89Å; K539-I543 VanDerWaalsContact O-N 3.13Å
540	R	86.2	Confident	87.3	Confident	45 Å²	45	44.8 Å²	44.8	17%	0.17	23%	0.233	C	C	.	.	H	α-helix	trans	-61.1	-46.5	175.7	-169.7	-177.5	-140.2	96.9	11	112.1	C132 M151 K536 S537 M538 I542 I543 D544	C132-R540 PolarHBondContact O-NH1 2.89Å; M151-R540 HydrophobicContact CE-CB 3.98Å; M151-R540 HydrophobicContact CE-CG 3.9Å; K536-R540 PolarHBondContact O-N 3.27Å; K536-R540 VanDerWaalsContact O-N 3.09Å; S537-R540 PolarHBondContact O-N 3.4Å; M538-R540 VanDerWaalsContact C-N 3.28Å; M538-R540 PolarHBondContact O-N 3.25Å; R540-I542 VanDerWaalsContact C-N 3.29Å; R540-I542 PolarHBondContact O-N 3.5Å; R540-I543 WeakPolarHBondContact O-CB 3.47Å; R540-I543 PolarHBondContact O-N 2.92Å; R540-I543 VanDerWaalsContact O-N 3.14Å; R540-D544 VanDerWaalsContact O-CG 3.3Å; R540-D544 PolarHBondContact O-N 3.36Å
541	L	91.6	Very high	87.6	Confident	8 Å²	8	50.1 Å²	50.1	4%	0.042	26%	0.258	C	S	.	.	H	α-helix	trans	-59.5	-41	178.5	-179.7	62.9	0	0	0	112.2	L495 S537 M538 I543 D544 C545 I559 A562 I563	L495-L541 HydrophobicContact CD1-CD2 4.26Å; L495-L541 HydrophobicContact CD1-CG 4.25Å; S537-L541 PolarHBondContact O-N 3.01Å; M538-L541 PolarHBondContact O-N 3.14Å; M538-L541 HydrophobicContact SD-CD2 4.32Å; L541-I543 VanDerWaalsContact C-N 3.35Å; L541-D544 PolarHBondContact O-N 2.92Å; L541-C545 PolarHBondContact O-N 3.18Å; L541-C545 PolarHBondContact O-SG 3.41Å; L541-I559 HydrophobicContact CD1-CB 4.46Å; L541-I559 HydrophobicContact CD1-CG1 4.22Å; L541-I559 HydrophobicContact CD1-CG2 4.3Å; L541-I559 HydrophobicContact CD2-CG2 4.25Å; L541-A562 HydrophobicContact CD1-CB 4Å; L541-A562 HydrophobicContact CD2-CB 4.25Å; L541-I563 HydrophobicContact CD2-CD1 3.93Å; L541-I563 HydrophobicContact CD2-CG1 3.31Å
542	I	94.3	Very high	88.2	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-58.2	-48.7	174.7	-68.8	168.8	0	0	0	110.4	L495 F496 M499 L527 L530 M538 K539 R540 D544 C545 L546	L495-I542 HydrophobicContact CB-CD1 4.12Å; L495-I542 HydrophobicContact CB-CG1 3.6Å; L495-I542 HydrophobicContact CD1-CG1 3.99Å; L495-I542 HydrophobicContact CG-CG1 4.47Å; F496-I542 HydrophobicContact CB-CG2 4.48Å; M499-I542 HydrophobicContact CB-CD1 4.09Å; M499-I542 HydrophobicContact CG-CD1 3.88Å; L527-I542 HydrophobicContact CD2-CG2 4.06Å; L530-I542 HydrophobicContact CD1-CD1 4.23Å; L530-I542 HydrophobicContact CD2-CD1 4.07Å; M538-I542 HydrophobicContact CG-CD1 4.33Å; M538-I542 WeakPolarHBondContact O-CG1 3.21Å; M538-I542 PolarHBondContact O-N 3.42Å; K539-I542 PolarHBondContact O-N 2.83Å; R540-I542 VanDerWaalsContact C-N 3.29Å; R540-I542 PolarHBondContact O-N 3.5Å; I542-D544 VanDerWaalsContact C-N 3.34Å; I542-D544 PolarHBondContact O-N 3.43Å; I542-C545 PolarHBondContact O-N 2.58Å; I542-L546 HydrophobicContact CG2-CD1 3.63Å; I542-L546 HydrophobicContact CG2-CG 4.44Å; I542-L546 WeakPolarHBondContact O-CB 3.49Å; I542-L546 VanDerWaalsContact O-CG 3.29Å; I542-L546 WeakPolarHBondContact O-CG 3.5Å; I542-L546 PolarHBondContact O-N 2.93Å
543	I	91.3	Very high	89.1	Confident	33 Å²	33	47.1 Å²	47.1	17%	0.169	23%	0.228	C	C	.	.	H	α-helix	trans	-59.1	-45	178.4	-68.3	161.7	0	0	0	111.5	M151 L527 K539 R540 L541 C545 L546 K547	M151-I543 HydrophobicContact CE-CD1 3.4Å; M151-I543 VanDerWaalsContact CE-CD1 3.4Å; M151-I543 HydrophobicContact SD-CD1 3.67Å; L527-I543 HydrophobicContact CD1-CD1 3.78Å; L527-I543 HydrophobicContact CD1-CG1 3.43Å; L527-I543 VanDerWaalsContact CD1-CG1 3.43Å; L527-I543 HydrophobicContact CD2-CG1 4.13Å; L527-I543 HydrophobicContact CG-CG1 4.42Å; K539-I543 WeakPolarHBondContact O-CD1 3.45Å; K539-I543 WeakPolarHBondContact O-CG1 3.37Å; K539-I543 PolarHBondContact O-N 2.89Å; K539-I543 VanDerWaalsContact O-N 3.13Å; R540-I543 WeakPolarHBondContact O-CB 3.47Å; R540-I543 PolarHBondContact O-N 2.92Å; R540-I543 VanDerWaalsContact O-N 3.14Å; L541-I543 VanDerWaalsContact C-N 3.35Å; I543-C545 VanDerWaalsContact C-N 3.33Å; I543-C545 PolarHBondContact O-N 3.02Å; I543-L546 PolarHBondContact O-N 2.82Å; I543-K547 PolarHBondContact O-N 2.95Å
544	D	91.3	Very high	90.2	Very high	48 Å²	48	43.1 Å²	43.1	26%	0.257	20%	0.203	S	C	.	.	H	α-helix	trans	-66.1	-36.2	-178.7	-65.8	-22.6	0	0	0	111.4	R540 L541 I542 L546 K547 P554	R540-D544 VanDerWaalsContact O-CG 3.3Å; R540-D544 PolarHBondContact O-N 3.36Å; L541-D544 PolarHBondContact O-N 2.92Å; I542-D544 VanDerWaalsContact C-N 3.34Å; I542-D544 PolarHBondContact O-N 3.43Å; D544-L546 VanDerWaalsContact C-N 3.35Å; D544-K547 WeakPolarHBondContact O-CG 3.19Å; D544-P554 HydrophobicContact CB-CG 4.39Å; D544-P554 WeakPolarHBondContact O-CD 3.38Å
545	C	97	Very high	91.1	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-70.2	-29.8	174.4	-63.4	0	0	0	0	112.9	V488 L541 I542 I543 R553	V488-C545 HydrophobicContact CG1-CB 3.96Å; L541-C545 PolarHBondContact O-N 3.18Å; L541-C545 PolarHBondContact O-SG 3.41Å; I542-C545 PolarHBondContact O-N 2.58Å; I543-C545 VanDerWaalsContact C-N 3.33Å; I543-C545 PolarHBondContact O-N 3.02Å; C545-R553 WeakPolarHBondContact O-CD 3.35Å
546	L	96.1	Very high	91.8	Very high	15 Å²	15	44.2 Å²	44.2	8%	0.079	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93	10	-175.9	-68.1	174.3	0	0	0	114.2	Y489 V493 P525 I542 I543 D544 F548	Y489-L546 HydrophobicContact CD2-CD2 4.18Å; Y489-L546 HydrophobicContact CE1-CD2 4.39Å; Y489-L546 HydrophobicContact CE2-CB 4.47Å; Y489-L546 HydrophobicContact CE2-CD2 3.93Å; V493-L546 HydrophobicContact CG2-CD2 3.68Å; P525-L546 HydrophobicContact CB-CD1 4.1Å; P525-L546 HydrophobicContact CG-CD1 3.79Å; P525-L546 HydrophobicContact CG-CD2 4.24Å; I542-L546 HydrophobicContact CG2-CD1 3.63Å; I542-L546 HydrophobicContact CG2-CG 4.44Å; I542-L546 WeakPolarHBondContact O-CB 3.49Å; I542-L546 VanDerWaalsContact O-CG 3.29Å; I542-L546 WeakPolarHBondContact O-CG 3.5Å; I542-L546 PolarHBondContact O-N 2.93Å; I543-L546 PolarHBondContact O-N 2.82Å; D544-L546 VanDerWaalsContact C-N 3.35Å; L546-F548 PolarHBondContact O-N 3.48Å
547	K	92.7	Very high	92.5	Very high	75 Å²	75	42.2 Å²	42.2	33%	0.326	20%	0.203	S	C	.	.			trans	-56.5	137.6	177.1	-69.1	-68.9	-175.5	173.1	0	111.9	I543 D544 E552 R553	I543-K547 PolarHBondContact O-N 2.95Å; D544-K547 WeakPolarHBondContact O-CG 3.19Å; K547-E552 HydrophobicContact CB-CB 4.05Å; K547-E552 HydrophobicContact CG-CB 4.12Å; K547-R553 HydrophobicContact CB-CG 4.05Å; K547-R553 PolarHBondContact O-NE 2.53Å; K547-R553 PolarHBondContact O-NH2 2.84Å
548	F	92.1	Very high	93	Very high	69 Å²	69	41.6 Å²	41.6	30%	0.303	20%	0.195	S	C	.	.	S	Bend	trans	-65.2	-41.9	179.7	-76.1	-72.3	0	0	0	112.8	P471 G521 L523 L546 R553	P471-F548 HydrophobicContact CB-CD1 4.25Å; P471-F548 HydrophobicContact CG-CD1 3.6Å; P471-F548 HydrophobicContact CG-CE1 4.13Å; G521-F548 VanDerWaalsContact CA-CE1 3.43Å; G521-F548 WeakPolarHBondContact O-CZ 3.48Å; L523-F548 VanDerWaalsContact O-CZ 3.29Å; L523-F548 WeakPolarHBondContact O-CZ 3.2Å; L546-F548 PolarHBondContact O-N 3.48Å; F548-R553 PolarHBondContact O-NH2 2.95Å
549	K	91.5	Very high	93.4	Very high	132 Å²	132	41.6 Å²	41.6	57%	0.574	20%	0.195	S	C	*	.	S	Bend	trans	-78.9	123.5	172.2	-63.9	-173.1	-167.6	163.3	0	108.9	E551 E552	K549-E551 VanDerWaalsContact C-N 3.26Å; K549-E551 PolarHBondContact O-N 3.38Å; K549-E552 HydrophobicContact CB-CG 4.04Å; K549-E552 WeakPolarHBondContact CD-OE1 3.03Å; K549-E552 IonicContact NZ-OE1 3.72Å; K549-E552 PolarHBondContact O-N 3.5Å
550	R	93.8	Very high	93.7	Very high	59 Å²	59	41.3 Å²	41.3	22%	0.223	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-66	-30.8	-174.9	68.7	176.9	173.6	-152	-11.2	112.3	D478 Q485 E552 R553	D478-R550 IonicContact OD2-CZ 3.67Å; D478-R550 IonicContact OD2-NH1 3.82Å; D478-R550 PolarHBondContact OD2-NH1 3.33Å; D478-R550 IonicContact OD2-NH2 2.84Å; D478-R550 PolarHBondContact OD2-NH2 3.36Å; Q485-R550 HydrophobicContact CB-CB 3.85Å; Q485-R550 WeakPolarHBondContact CG-O 3.44Å; R550-E552 PolarHBondContact O-N 2.89Å; R550-R553 WeakPolarHBondContact O-CB 3.32Å; R550-R553 PolarHBondContact O-N 3.32Å; R550-R553 VanDerWaalsContact O-N 3.11Å
551	E	92.9	Very high	93.9	Very high	122 Å²	122	39.7 Å²	39.7	57%	0.57	19%	0.189	S	C	*	.	G	3₁₀ helix	trans	-69.3	-19.9	-178	-59.4	72.3	-156.5	0	0	112.7	K549 R553	K549-E551 VanDerWaalsContact C-N 3.26Å; K549-E551 PolarHBondContact O-N 3.38Å; E551-R553 VanDerWaalsContact C-N 3.33Å
552	E	90.5	Very high	93.9	Very high	84 Å²	84	40.8 Å²	40.8	39%	0.393	20%	0.2	S	C	.	.	G	3₁₀ helix	trans	-84.4	-9.4	175.8	-62.4	-179.5	-174.1	0	0	112.5	K547 K549 R550	K547-E552 HydrophobicContact CB-CB 4.05Å; K547-E552 HydrophobicContact CG-CB 4.12Å; K549-E552 HydrophobicContact CB-CG 4.04Å; K549-E552 WeakPolarHBondContact CD-OE1 3.03Å; K549-E552 IonicContact NZ-OE1 3.72Å; K549-E552 PolarHBondContact O-N 3.5Å; R550-E552 PolarHBondContact O-N 2.89Å
553	R	96	Very high	93.8	Very high	7 Å²	7	40.8 Å²	40.8	3%	0.026	20%	0.2	C	C	.	.	S	Bend	trans	-81	138.2	-179.8	-58.5	178	-162.5	142.2	11.5	110.3	E472 Q485 V488 C545 K547 F548 R550 E551	E472-R553 IonicContact OE1-CZ 3.35Å; E472-R553 IonicContact OE1-NH1 3.92Å; E472-R553 PolarHBondContact OE1-NH1 2.9Å; E472-R553 IonicContact OE1-NH2 3.18Å; E472-R553 IonicContact OE2-CZ 3Å; E472-R553 IonicContact OE2-NH1 2.79Å; E472-R553 PolarHBondContact OE2-NH1 3.38Å; E472-R553 IonicContact OE2-NH2 3.09Å; E472-R553 PolarHBondContact OE2-NH2 2.88Å; Q485-R553 WeakPolarHBondContact O-CD 3.32Å; Q485-R553 PolarHBondContact O-NH1 2.71Å; V488-R553 HydrophobicContact CG1-CB 4.07Å; C545-R553 WeakPolarHBondContact O-CD 3.35Å; K547-R553 HydrophobicContact CB-CG 4.05Å; K547-R553 PolarHBondContact O-NE 2.53Å; K547-R553 PolarHBondContact O-NH2 2.84Å; F548-R553 PolarHBondContact O-NH2 2.95Å; R550-R553 WeakPolarHBondContact O-CB 3.32Å; R550-R553 PolarHBondContact O-N 3.32Å; R550-R553 VanDerWaalsContact O-N 3.11Å; E551-R553 VanDerWaalsContact C-N 3.33Å
554	P	95.8	Very high	93.7	Very high	10 Å²	10	42.8 Å²	42.8	7%	0.065	21%	0.209	C	C	.	.	P	Polyproline II helix	trans	-68.7	161.5	174.2	30.6	-35.1	0	0	0	111.2	V488 D544 Q558 I559	V488-P554 WeakPolarHBondContact CG1-O 3.43Å; V488-P554 WeakPolarHBondContact CG2-O 3.44Å; D544-P554 HydrophobicContact CB-CG 4.39Å; D544-P554 WeakPolarHBondContact O-CD 3.38Å; P554-Q558 HydrophobicContact CB-CB 4.1Å; P554-I559 HydrophobicContact CB-CG1 4.07Å; P554-I559 HydrophobicContact CG-CD1 4.19Å; P554-I559 HydrophobicContact CG-CG1 3.76Å
555	L	97.3	Very high	93.5	Very high	58 Å²	58	43.1 Å²	43.1	30%	0.304	21%	0.209	S	C	.	.	P	Polyproline II helix	trans	-93.4	161.4	169	-64	177.2	0	0	0	110.9	F484 Q485 P557 Q558 I559	F484-L555 HydrophobicContact CB-CD2 3.98Å; Q485-L555 HydrophobicContact CG-CD2 4.33Å; L555-P557 VanDerWaalsContact C-N 3.32Å; L555-P557 VanDerWaalsContact O-N 3.15Å; L555-Q558 WeakPolarHBondContact O-CB 3.28Å; L555-Q558 PolarHBondContact O-N 3.04Å; L555-I559 WeakPolarHBondContact O-CG1 3.47Å; L555-I559 PolarHBondContact O-N 2.94Å
556	F	97.8	Very high	93	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-53	-34.4	-177.9	-79	-76.3	0	0	0	116.2	A410 M413 D414 H417 D487 V488 Y491 Q558 I559 L560	A410-F556 HydrophobicContact CB-CD1 3.99Å; A410-F556 HydrophobicContact CB-CE1 4.33Å; M413-F556 HydrophobicContact CB-CD1 3.66Å; M413-F556 HydrophobicContact CB-CD2 3.77Å; M413-F556 HydrophobicContact CB-CE1 3.38Å; M413-F556 HydrophobicContact CB-CE2 3.49Å; M413-F556 VanDerWaalsContact CB-CE2 3.49Å; M413-F556 HydrophobicContact CB-CG 3.85Å; M413-F556 HydrophobicContact CB-CZ 3.28Å; M413-F556 HydrophobicContact CE-CE2 4.08Å; M413-F556 HydrophobicContact CE-CZ 4.29Å; M413-F556 HydrophobicContact CG-CE1 3.9Å; M413-F556 HydrophobicContact CG-CE2 4.12Å; M413-F556 HydrophobicContact CG-CZ 3.6Å; D414-F556 HydrophobicContact CB-CB 3.8Å; H417-F556 AromaticContact CE1-CD2 3.46Å; H417-F556 VanDerWaalsContact CE1-CD2 3.46Å; H417-F556 WeakPolarHBondContact CE1-CD2 3.32Å; H417-F556 AromaticContact CE1-CE2 3.44Å; H417-F556 VanDerWaalsContact CE1-CE2 3.44Å; H417-F556 WeakPolarHBondContact CE1-CE2 3.47Å; H417-F556 AromaticContact ND1-CD2 3.39Å; H417-F556 WeakPolarHBondContact ND1-CD2 3.24Å; H417-F556 AromaticContact ND1-CE2 3.9Å; D487-F556 HydrophobicContact CB-CE2 4.45Å; V488-F556 HydrophobicContact CG2-CD2 4.1Å; V488-F556 HydrophobicContact CG2-CE2 3.82Å; V488-F556 HydrophobicContact CG2-CZ 4.37Å; Y491-F556 AromaticContact CD1-CE1 3.9Å; Y491-F556 HydrophobicContact CD1-CE1 3.9Å; Y491-F556 HydrophobicContact CD1-CZ 4.39Å; Y491-F556 AromaticContact CD2-CE1 3.99Å; Y491-F556 HydrophobicContact CD2-CE1 3.99Å; Y491-F556 HydrophobicContact CD2-CZ 4.39Å; Y491-F556 HydrophobicContact CE1-CE1 4.31Å; Y491-F556 HydrophobicContact CE2-CE1 4.4Å; Y491-F556 AromaticContact CG-CE1 3.72Å; Y491-F556 HydrophobicContact CG-CE1 3.72Å; Y491-F556 AromaticContact CG-CZ 3.94Å; Y491-F556 HydrophobicContact CG-CZ 3.94Å; F556-Q558 VanDerWaalsContact C-N 3.26Å; F556-Q558 PolarHBondContact O-N 3.47Å; F556-I559 HydrophobicContact CD1-CD1 4.06Å; F556-I559 HydrophobicContact CD1-CG2 4.47Å; F556-I559 HydrophobicContact CE1-CD1 4.27Å; F556-I559 HydrophobicContact CG-CD1 4.37Å; F556-I559 PolarHBondContact O-N 3.17Å; F556-L560 WeakPolarHBondContact O-CB 3.32Å; F556-L560 WeakPolarHBondContact O-CG 3.47Å; F556-L560 PolarHBondContact O-N 3.43Å
557	P	94.8	Very high	92.4	Very high	54 Å²	54	45.7 Å²	45.7	35%	0.351	22%	0.22	S	C	.	.	H	α-helix	trans	-59.6	-34.6	173.1	-25.6	33.3	0	0	0	113.8	D414 L555 V561	D414-P557 WeakPolarHBondContact OD1-CD 3.41Å; D414-P557 VanDerWaalsContact OD1-CG 3.23Å; D414-P557 WeakPolarHBondContact OD1-CG 3.35Å; L555-P557 VanDerWaalsContact C-N 3.32Å; L555-P557 VanDerWaalsContact O-N 3.15Å; P557-V561 WeakPolarHBondContact O-CG2 3.48Å
558	Q	93.6	Very high	91.9	Very high	33 Å²	33	46.9 Å²	46.9	15%	0.154	23%	0.227	C	C	.	.	H	α-helix	trans	-79.4	-39.4	177.3	-68	145.8	5.6	0	0	111.2	Y115 H120 P554 L555 F556 L560 V561 A562	Y115-Q558 HydrophobicContact CD1-CG 4.09Å; Y115-Q558 HydrophobicContact CD2-CB 4.19Å; Y115-Q558 HydrophobicContact CD2-CG 3.74Å; Y115-Q558 HydrophobicContact CE1-CG 4.43Å; Y115-Q558 HydrophobicContact CE2-CG 4.06Å; Y115-Q558 HydrophobicContact CG-CG 3.75Å; H120-Q558 PolarHBondContact O-NE2 3.15Å; P554-Q558 HydrophobicContact CB-CB 4.1Å; L555-Q558 WeakPolarHBondContact O-CB 3.28Å; L555-Q558 PolarHBondContact O-N 3.04Å; F556-Q558 VanDerWaalsContact C-N 3.26Å; F556-Q558 PolarHBondContact O-N 3.47Å; Q558-L560 VanDerWaalsContact C-N 3.34Å; Q558-V561 PolarHBondContact O-N 3.32Å; Q558-A562 WeakPolarHBondContact O-CB 3.41Å; Q558-A562 PolarHBondContact O-N 3.31Å
559	I	96.6	Very high	91.3	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-59.5	-46.6	176.5	-64.7	171.9	0	0	0	110	A410 V488 Y491 L541 P554 L555 F556 V561 A562 I563	A410-I559 HydrophobicContact CB-CG2 4.18Å; V488-I559 HydrophobicContact CB-CD1 4.48Å; V488-I559 HydrophobicContact CG1-CD1 3.76Å; V488-I559 HydrophobicContact CG2-CD1 4.04Å; Y491-I559 HydrophobicContact CD1-CD1 4.37Å; Y491-I559 HydrophobicContact CD1-CG2 4.26Å; Y491-I559 HydrophobicContact CE1-CG2 3.53Å; L541-I559 HydrophobicContact CD1-CB 4.46Å; L541-I559 HydrophobicContact CD1-CG1 4.22Å; L541-I559 HydrophobicContact CD1-CG2 4.3Å; L541-I559 HydrophobicContact CD2-CG2 4.25Å; P554-I559 HydrophobicContact CB-CG1 4.07Å; P554-I559 HydrophobicContact CG-CD1 4.19Å; P554-I559 HydrophobicContact CG-CG1 3.76Å; L555-I559 WeakPolarHBondContact O-CG1 3.47Å; L555-I559 PolarHBondContact O-N 2.94Å; F556-I559 HydrophobicContact CD1-CD1 4.06Å; F556-I559 HydrophobicContact CD1-CG2 4.47Å; F556-I559 HydrophobicContact CE1-CD1 4.27Å; F556-I559 HydrophobicContact CG-CD1 4.37Å; F556-I559 PolarHBondContact O-N 3.17Å; I559-V561 PolarHBondContact O-N 3.04Å; I559-A562 WeakPolarHBondContact O-CB 3.27Å; I559-A562 PolarHBondContact O-N 3.29Å; I559-A562 VanDerWaalsContact O-N 3.14Å; I559-I563 HydrophobicContact CG2-CD1 3.75Å; I559-I563 HydrophobicContact CG2-CG1 4.4Å; I559-I563 WeakPolarHBondContact O-CG1 3.46Å; I559-I563 PolarHBondContact O-N 2.98Å
560	L	94.7	Very high	90.6	Very high	16 Å²	16	44.7 Å²	44.7	8%	0.084	22%	0.223	C	C	.	.	H	α-helix	trans	-57.2	-49.4	178.2	-82.4	173.9	0	0	0	112	A410 Q411 D414 F556 Q558 A562 I563 E564	A410-L560 HydrophobicContact CB-CD2 3.56Å; A410-L560 HydrophobicContact CB-CG 4Å; Q411-L560 HydrophobicContact CB-CD2 4.36Å; Q411-L560 HydrophobicContact CG-CD1 4.44Å; Q411-L560 HydrophobicContact CG-CD2 3.53Å; D414-L560 HydrophobicContact CB-CD1 3.59Å; F556-L560 WeakPolarHBondContact O-CB 3.32Å; F556-L560 WeakPolarHBondContact O-CG 3.47Å; F556-L560 PolarHBondContact O-N 3.43Å; Q558-L560 VanDerWaalsContact C-N 3.34Å; L560-A562 VanDerWaalsContact C-N 3.29Å; L560-A562 PolarHBondContact O-N 2.95Å; L560-I563 PolarHBondContact O-N 3.01Å; L560-E564 WeakPolarHBondContact O-CB 3.4Å; L560-E564 WeakPolarHBondContact O-CG 3.47Å; L560-E564 PolarHBondContact O-N 3.46Å
561	V	90.8	Very high	89.3	Confident	10 Å²	10	47 Å²	47	6%	0.061	25%	0.246	C	C	.	.	H	α-helix	trans	-60.2	-40.4	176.7	168.5	0	0	0	0	111.8	L113 Y115 P557 Q558 I559 Q565	L113-V561 HydrophobicContact CB-CG2 4.19Å; L113-V561 HydrophobicContact CD2-CG2 3.48Å; L113-V561 VanDerWaalsContact CD2-CG2 3.48Å; L113-V561 HydrophobicContact CG-CG2 3.81Å; L113-V561 WeakPolarHBondContact O-CG1 3.32Å; Y115-V561 HydrophobicContact CD2-CB 4.22Å; Y115-V561 HydrophobicContact CD2-CG1 4.22Å; Y115-V561 HydrophobicContact CD2-CG2 4.37Å; Y115-V561 HydrophobicContact CE2-CB 4Å; Y115-V561 HydrophobicContact CE2-CG1 4.33Å; Y115-V561 HydrophobicContact CE2-CG2 3.68Å; P557-V561 WeakPolarHBondContact O-CG2 3.48Å; Q558-V561 PolarHBondContact O-N 3.32Å; I559-V561 PolarHBondContact O-N 3.04Å; V561-Q565 WeakPolarHBondContact O-CB 3.31Å; V561-Q565 WeakPolarHBondContact O-CG 3.39Å; V561-Q565 PolarHBondContact O-N 2.83Å
562	A	91	Very high	87.7	Confident	31 Å²	31	49.6 Å²	49.6	26%	0.256	26%	0.255	S	S	.	.	H	α-helix	trans	-64.1	-41.3	177.1	0	0	0	0	0	112	L541 Q558 I559 L560 Q565 V566	L541-A562 HydrophobicContact CD1-CB 4Å; L541-A562 HydrophobicContact CD2-CB 4.25Å; Q558-A562 WeakPolarHBondContact O-CB 3.41Å; Q558-A562 PolarHBondContact O-N 3.31Å; I559-A562 WeakPolarHBondContact O-CB 3.27Å; I559-A562 PolarHBondContact O-N 3.29Å; I559-A562 VanDerWaalsContact O-N 3.14Å; L560-A562 VanDerWaalsContact C-N 3.29Å; L560-A562 PolarHBondContact O-N 2.95Å; A562-Q565 PolarHBondContact O-N 2.56Å; A562-V566 WeakPolarHBondContact O-CG2 3.43Å; A562-V566 PolarHBondContact O-N 2.99Å
563	I	92.4	Very high	86	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-70	-42.6	178.9	-65.1	170.7	0	0	0	111.5	I403 R407 A410 Y491 M538 L541 I559 L560 Q565 V566 Q567	I403-I563 HydrophobicContact CG2-CG2 4.16Å; R407-I563 HydrophobicContact CB-CG2 3.66Å; R407-I563 HydrophobicContact CG-CG2 4.11Å; A410-I563 HydrophobicContact CB-CD1 4.04Å; Y491-I563 HydrophobicContact CE1-CD1 4.4Å; Y491-I563 WeakPolarHBondContact OH-CD1 3.46Å; M538-I563 HydrophobicContact CE-CG1 4.46Å; L541-I563 HydrophobicContact CD2-CD1 3.93Å; L541-I563 HydrophobicContact CD2-CG1 3.31Å; I559-I563 HydrophobicContact CG2-CD1 3.75Å; I559-I563 HydrophobicContact CG2-CG1 4.4Å; I559-I563 WeakPolarHBondContact O-CG1 3.46Å; I559-I563 PolarHBondContact O-N 2.98Å; L560-I563 PolarHBondContact O-N 3.01Å; I563-Q565 VanDerWaalsContact C-N 3.29Å; I563-Q565 PolarHBondContact O-N 2.65Å; I563-V566 WeakPolarHBondContact O-CA 3.12Å; I563-V566 WeakPolarHBondContact O-CB 3.05Å; I563-V566 PolarHBondContact O-N 3.05Å; I563-Q567 PolarHBondContact O-N 2.84Å
564	E	89.2	Confident	83.5	Confident	76 Å²	76	60.6 Å²	60.6	36%	0.355	31%	0.31	S	S	.	.	H	α-helix	trans	-60.3	-41.6	176	-73	173.5	172	0	0	110.9	L560 V566 Q567 E568	L560-E564 WeakPolarHBondContact O-CB 3.4Å; L560-E564 WeakPolarHBondContact O-CG 3.47Å; L560-E564 PolarHBondContact O-N 3.46Å; E564-V566 VanDerWaalsContact C-N 3.31Å; E564-V566 PolarHBondContact O-N 2.67Å; E564-Q567 PolarHBondContact O-N 2.82Å; E564-E568 WeakPolarHBondContact O-CG 3.2Å; E564-E568 PolarHBondContact O-N 2.81Å
565	Q	86.6	Confident	81.1	Confident	55 Å²	55	70.8 Å²	70.8	26%	0.257	35%	0.347	S	S	.	.	H	α-helix	trans	-61.8	-38	172.4	-72.8	173	16.2	0	0	112.3	L113 V561 A562 I563 E568 L569	L113-Q565 PolarHBondContact O-NE2 2.73Å; V561-Q565 WeakPolarHBondContact O-CB 3.31Å; V561-Q565 WeakPolarHBondContact O-CG 3.39Å; V561-Q565 PolarHBondContact O-N 2.83Å; A562-Q565 PolarHBondContact O-N 2.56Å; I563-Q565 VanDerWaalsContact C-N 3.29Å; I563-Q565 PolarHBondContact O-N 2.65Å; Q565-E568 PolarHBondContact O-N 3.34Å; Q565-L569 WeakPolarHBondContact O-CD1 3.48Å; Q565-L569 VanDerWaalsContact O-CG 3.24Å; Q565-L569 WeakPolarHBondContact O-CG 3.3Å; Q565-L569 PolarHBondContact O-N 2.86Å
566	V	86	Confident	78.5	Confident	2 Å²	2	72.6 Å²	72.6	1%	0.012	37%	0.365	C	S	.	.	H	α-helix	trans	-62.4	-46.2	173.9	-179.6	0	0	0	0	110.3	I403 P535 S537 M538 A562 I563 E564 E568 L569 M570	I403-V566 HydrophobicContact CD1-CG1 4.03Å; P535-V566 HydrophobicContact CB-CG1 3.77Å; P535-V566 HydrophobicContact CG-CG1 3.77Å; S537-V566 WeakPolarHBondContact OG-CG2 3.4Å; M538-V566 HydrophobicContact CB-CG1 4.35Å; M538-V566 HydrophobicContact CE-CG1 4.26Å; A562-V566 WeakPolarHBondContact O-CG2 3.43Å; A562-V566 PolarHBondContact O-N 2.99Å; I563-V566 WeakPolarHBondContact O-CA 3.12Å; I563-V566 WeakPolarHBondContact O-CB 3.05Å; I563-V566 PolarHBondContact O-N 3.05Å; E564-V566 VanDerWaalsContact C-N 3.31Å; E564-V566 PolarHBondContact O-N 2.67Å; V566-E568 VanDerWaalsContact C-N 3.31Å; V566-E568 PolarHBondContact O-N 3.33Å; V566-L569 PolarHBondContact O-N 3.45Å; V566-L569 VanDerWaalsContact O-N 3.17Å; V566-M570 WeakPolarHBondContact O-CG 3.44Å; V566-M570 PolarHBondContact O-N 2.88Å
567	Q	85.4	Confident	75.9	Confident	66 Å²	66	84.6 Å²	84.6	31%	0.308	41%	0.41	S	S	.	.	H	α-helix	trans	-62.4	-37.2	-179.2	-170	177.1	6.5	0	0	112.4	I403 I563 E564 L569 M570	I403-Q567 HydrophobicContact CG2-CB 4.11Å; I403-Q567 HydrophobicContact CG2-CG 4.47Å; I563-Q567 PolarHBondContact O-N 2.84Å; E564-Q567 PolarHBondContact O-N 2.82Å; Q567-L569 VanDerWaalsContact C-N 3.32Å; Q567-L569 PolarHBondContact O-N 2.78Å; Q567-M570 WeakPolarHBondContact O-CB 3.48Å; Q567-M570 PolarHBondContact O-N 2.91Å
568	E	82.1	Confident	74	Confident	100 Å²	100	86.4 Å²	86.4	47%	0.467	42%	0.424	S	S	.	.	H	α-helix	trans	-69.1	-28	176.4	-72.1	-176.8	169.7	0	0	114	K112 E564 Q565 V566 M570	K112-E568 IonicContact NZ-OE1 2.64Å; K112-E568 PolarHBondContact NZ-OE1 2.9Å; K112-E568 IonicContact NZ-OE2 2.67Å; K112-E568 PolarHBondContact NZ-OE2 3.15Å; E564-E568 WeakPolarHBondContact O-CG 3.2Å; E564-E568 PolarHBondContact O-N 2.81Å; Q565-E568 PolarHBondContact O-N 3.34Å; V566-E568 VanDerWaalsContact C-N 3.31Å; V566-E568 PolarHBondContact O-N 3.33Å; E568-M570 VanDerWaalsContact C-N 3.34Å
569	L	77.9	Confident	71.4	Confident	125 Å²	125	93 Å²	93	65%	0.654	46%	0.455	S	S	*	.	H	α-helix	trans	-82.4	-14.6	178	-68.3	170.2	0	0	0	112.6	Q565 V566 Q567	Q565-L569 WeakPolarHBondContact O-CD1 3.48Å; Q565-L569 VanDerWaalsContact O-CG 3.24Å; Q565-L569 WeakPolarHBondContact O-CG 3.3Å; Q565-L569 PolarHBondContact O-N 2.86Å; V566-L569 PolarHBondContact O-N 3.45Å; V566-L569 VanDerWaalsContact O-N 3.17Å; Q567-L569 VanDerWaalsContact C-N 3.32Å; Q567-L569 PolarHBondContact O-N 2.78Å
570	M	76.6	Confident	68.8	Low	31 Å²	31	97.9 Å²	97.9	15%	0.153	49%	0.487	C	S	.	.	S	Bend	trans	-68.5	143.5	173.4	-66.4	-68.4	-77.2	0	0	109.4	T399 M400 I403 P535 V566 Q567 E568 K572	T399-M570 HydrophobicContact CG2-CE 3.52Å; T399-M570 HydrophobicContact CG2-SD 4.49Å; M400-M570 HydrophobicContact CE-CB 4.19Å; M400-M570 HydrophobicContact CG-CE 4.23Å; M400-M570 HydrophobicContact SD-CB 3.46Å; M400-M570 WeakPolarHBondContact SD-CB 3.47Å; M400-M570 HydrophobicContact SD-CE 3.65Å; M400-M570 HydrophobicContact SD-CG 3.65Å; I403-M570 HydrophobicContact CD1-CE 3.91Å; I403-M570 HydrophobicContact CD1-CG 3.78Å; I403-M570 HydrophobicContact CD1-SD 3.86Å; P535-M570 HydrophobicContact CG-SD 3.55Å; P535-M570 VanDerWaalsContact CG-SD 3.55Å; V566-M570 WeakPolarHBondContact O-CG 3.44Å; V566-M570 PolarHBondContact O-N 2.88Å; Q567-M570 WeakPolarHBondContact O-CB 3.48Å; Q567-M570 PolarHBondContact O-N 2.91Å; E568-M570 VanDerWaalsContact C-N 3.34Å; M570-K572 PolarHBondContact O-N 3.34Å
571	P	68.1	Low	66.7	Low	108 Å²	108	102.6 Å²	102.6	70%	0.701	52%	0.521	S	S	*	.			trans	-53	115.8	171.4	-19.1	29.3	0	0	0	107.8	I573	P571-I573 PolarHBondContact O-N 3.19Å
572	K	58	Low	64.6	Low	175 Å²	175	109.2 Å²	109.2	76%	0.761	56%	0.555	S	S	*	*			trans	-58.1	130.3	165.9	-66.6	-179	-178	179.5	0	104.7	M570 E574	M570-K572 PolarHBondContact O-N 3.34Å; K572-E574 PolarHBondContact O-N 3.06Å
573	I	55.4	Low	62.5	Low	140 Å²	140	116.5 Å²	116.5	72%	0.718	58%	0.583	S	S	*	*			trans	-59.1	96.8	169.6	-61.6	169.9	0	0	0	104.8	P571 R575	P571-I573 PolarHBondContact O-N 3.19Å; I573-R575 PolarHBondContact O-N 2.94Å
574	E	43.2	Very low	60.3	Low	183 Å²	183	128.3 Å²	128.3	86%	0.855	63%	0.628	S	S	*	*			trans	-61.2	99.2	155.7	-74.3	-173.3	173.8	0	0	102.6	K572 S576	K572-E574 PolarHBondContact O-N 3.06Å; E574-S576 VanDerWaalsContact C-N 3.35Å; E574-S576 PolarHBondContact O-N 2.91Å
575	R	45.4	Very low	58	Low	224 Å²	224	129.2 Å²	129.2	85%	0.845	65%	0.648	S	S	*	*			trans	-46.7	118	154.5	-76.9	-175.3	152.9	111.6	-2.3	103.5	I573 R577	I573-R575 PolarHBondContact O-N 2.94Å; R575-R577 PolarHBondContact O-N 3.21Å
576	S	42.7	Very low	55.8	Low	95 Å²	95	133.3 Å²	133.3	66%	0.664	68%	0.677	S	S	*	*			trans	-42.8	133.2	163.3	41.3	0	0	0	0	105.7	E574 S578	E574-S576 VanDerWaalsContact C-N 3.35Å; E574-S576 PolarHBondContact O-N 2.91Å; S576-S578 PolarHBondContact O-N 2.91Å
577	R	42.8	Very low	53.5	Low	252 Å²	252	142.4 Å²	142.4	95%	0.951	72%	0.719	S	S	*	*			trans	-65.3	65.1	167	-67.8	-178.7	179.3	177.5	-0.6	107.4	R575 E579	R575-R577 PolarHBondContact O-N 3.21Å; R577-E579 VanDerWaalsContact C-N 3.28Å; R577-E579 PolarHBondContact O-N 2.68Å; R577-E579 VanDerWaalsContact O-N 3.11Å
578	S	54.8	Low	51.3	Low	92 Å²	92	143.9 Å²	143.9	64%	0.643	74%	0.742	S	S	*	*			trans	-63.3	107.8	149.3	52.8	0	0	0	0	103.1	S576	S576-S578 PolarHBondContact O-N 2.91Å
579	E	40.5	Very low	49.5	Very low	173 Å²	173	147.6 Å²	147.6	81%	0.808	76%	0.76	S	S	*	*			trans	-41	130.4	167.3	-85.1	179.6	136.7	0	0	108.2	R577 S581	R577-E579 VanDerWaalsContact C-N 3.28Å; R577-E579 PolarHBondContact O-N 2.68Å; R577-E579 VanDerWaalsContact O-N 3.11Å; E579-S581 PolarHBondContact O-N 2.76Å
580	P	41.9	Very low	47.4	Very low	102 Å²	102	149.6 Å²	149.6	66%	0.662	77%	0.771	S	S	*	*			trans	-55.8	120.2	166.7	24.5	-29.6	0	0	0	105.8	L582	P580-L582 PolarHBondContact O-N 2.94Å
581	S	49.6	Very low	45.4	Very low	115 Å²	115	155.8 Å²	155.8	80%	0.804	80%	0.804	S	S	*	*			trans	-66.3	82.9	179	43.5	0	0	0	0	109.2	E579 H583	E579-S581 PolarHBondContact O-N 2.76Å; S581-H583 PolarHBondContact O-N 3.42Å
582	L	47.4	Very low	43.6	Very low	149 Å²	149	157.7 Å²	157.7	78%	0.78	81%	0.808	S	S	*	*			trans	-75.1	36.3	174.6	-77.6	172.3	0	0	0	112.1	P580	P580-L582 PolarHBondContact O-N 2.94Å
583	H	47.4	Very low	42.9	Very low	184 Å²	184	154.2 Å²	154.2	85%	0.852	80%	0.804	S	S	*	*			trans	-138.9	70.4	174.2	-75.1	85.7	0	0	0	109.9	S581	S581-H583 PolarHBondContact O-N 3.42Å
584	R	44.4	Very low	42	Very low	248 Å²	248	154.5 Å²	154.5	94%	0.936	81%	0.806	S	S	*	*	S	Bend	trans	-144.1	28.6	156.9	-150.8	-179.6	-114.8	168.1	-1.8	113.3
585	A	41.8	Very low	41.5	Very low	94 Å²	94	154.1 Å²	154.1	78%	0.777	81%	0.809	S	S	*	*	S	Bend	trans	-142	34.9	178.3	0	0	0	0	0	113.1
586	V	40	Very low	41	Very low	141 Å²	141	152.6 Å²	152.6	86%	0.855	81%	0.809	S	S	*	*	S	Bend	trans	-153.9	84.5	158.8	-168.9	0	0	0	0	107.6
587	Q	37.8	Very low	40.4	Very low	193 Å²	193	155.6 Å²	155.6	90%	0.902	81%	0.812	S	S	*	*			trans	175.6	60.5	153.7	-97	175.4	18.4	0	0	107
588	A	39.9	Very low	39.8	Very low	97 Å²	97	149.2 Å²	149.2	80%	0.802	80%	0.801	S	S	*	*			trans	-100.8	134.2	145.8	0	0	0	0	0	104.2
589	E	42.8	Very low	38.8	Very low	179 Å²	179	150.5 Å²	150.5	84%	0.836	81%	0.805	S	S	*	*			trans	91.6	78.9	-168.3	-55.2	-174.4	-173.3	0	0	113.9
590	D	34.5	Very low	38.5	Very low	166 Å²	166	152.9 Å²	152.9	89%	0.888	81%	0.807	S	S	*	*				-157.7	122.9	106	-94.7	-30	0	0	0	110.5
591	L	34.9	Very low	38.1	Very low	162 Å²	162	154.9 Å²	154.9	85%	0.848	81%	0.811	S	S	*	*			trans	-68.5	137	172.3	-80.4	131.5	0	0	0	110.1
592	N	30.7	Very low	37.3	Very low	147 Å²	147	157 Å²	157	79%	0.786	81%	0.81	S	S	*	*			trans	-137.2	112.9	142.1	-154.3	0.4	0	0	0	109.9	L594	N592-L594 PolarHBondContact O-N 3.2Å
593	P	42.8	Very low	37	Very low	102 Å²	102	154.8 Å²	154.8	66%	0.662	81%	0.805	S	S	*	*			trans	-98.6	64.7	-171.2	38.6	-32.9	0	0	0	111.2
594	L	35.9	Very low	36.6	Very low	147 Å²	147	157.8 Å²	157.8	77%	0.77	83%	0.826	S	S	*	*			trans	-149.8	96.2	172.5	-78.1	175.2	0	0	0	110.2	N592	N592-L594 PolarHBondContact O-N 3.2Å
595	L	34.2	Very low	36.2	Very low	175 Å²	175	153.3 Å²	153.3	92%	0.916	82%	0.82	S	S	*	*			trans	-175.9	72.8	138.6	-95.8	156.8	0	0	0	108.6	H597	L595-H597 PolarHBondContact O-N 2.74Å
596	F	33.8	Very low	35.9	Very low	192 Å²	192	156.4 Å²	156.4	84%	0.842	82%	0.823	S	S	*	*			trans	-65.4	119.9	148	-84.4	-89.4	0	0	0	107.5
597	H	30.7	Very low	35.6	Very low	158 Å²	158	157.2 Å²	157.2	73%	0.731	82%	0.821	S	S	*	*				154.1	133.3	125.2	-90.9	-72.2	0	0	0	111.8	L595	L595-H597 PolarHBondContact O-N 2.74Å
598	T	29.6	Very low	35.5	Very low	117 Å²	117	155.1 Å²	155.1	72%	0.718	82%	0.816	S	S	*	*			trans	66.4	128.3	147.3	52	0	0	0	0	116.2
599	T	34.8	Very low	35.2	Very low	120 Å²	120	158.8 Å²	158.8	74%	0.736	82%	0.817	S	S	*	*				-169.7	136.1	58.2	-28.8	0	0	0	0	111
600	R	34.3	Very low	34.7	Very low	222 Å²	222	157.4 Å²	157.4	84%	0.838	82%	0.816	S	S	*	*			trans	26.2	119.8	145.9	-69.1	177.5	175	-173.4	-2	119.5
601	L	33.4	Very low	34.7	Very low	144 Å²	144	156.8 Å²	156.8	75%	0.754	81%	0.81	S	S	*	*				64.7	118.4	84.9	-84.6	163.2	0	0	0	115.8
602	M	31.3	Very low	34.7	Very low	159 Å²	159	156.4 Å²	156.4	78%	0.783	81%	0.808	S	S	*	*			trans	89	159.2	136.3	-69.1	-85.3	157.5	0	0	117.5
603	P	41.6	Very low	35.1	Very low	103 Å²	103	157.2 Å²	157.2	67%	0.669	81%	0.809	S	S	*	*				-135.9	177.2	-91.4	35.3	-12.8	0	0	0	113
604	L	38.2	Very low	34.3	Very low	247 Å²	247	162.2 Å²	162.2	100%	1.293	82%	0.823	S	S	*	*				-168.6	0	129.6	-104.1	162.1	0	0	0	109.7

Retrieved 604 of 604 residues in 956.7 ms (Link to these results)

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