A0A077Z3I0_TRITR Loading...

ATP synthase subunit beta

Produces ATP from ADP in the presence of a proton gradient across the membrane.

AlphaFold DB , UniProt , Accession A0A077Z3I0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 508 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	34	Very low	31.7	Very low	241 Å²	241	174.4 Å²	174.4	100%	1.187	88%	0.883	S	S	*	*				0	137.5	0	-80.2	-179.6	-178.9	0	0	108.7
2	R	33.9	Very low	31.6	Very low	245 Å²	245	172 Å²	172	93%	0.925	87%	0.873	S	S	*	*			trans	87.6	57.2	-178	-56.5	-173	177.1	-175.3	-0.1	117.2
3	F	29.7	Very low	31.5	Very low	217 Å²	217	172.4 Å²	172.4	95%	0.952	87%	0.87	S	S	*	*			trans	-123.8	90.1	150.3	-86.9	-83.6	0	0	0	107.4
4	S	32.2	Very low	31.4	Very low	120 Å²	120	172.6 Å²	172.6	84%	0.839	86%	0.855	S	S	*	*			trans	-172.9	78.3	174.4	165.3	0	0	0	0	109.4
5	A	34	Very low	31.4	Very low	101 Å²	101	170.5 Å²	170.5	84%	0.835	86%	0.856	S	S	*	*			trans	-150.5	52.7	166.5	0	0	0	0	0	109.9
6	V	30.3	Very low	31.3	Very low	143 Å²	143	170.9 Å²	170.9	87%	0.867	85%	0.846	S	S	*	*			trans	-126.3	79.8	169.8	-175.1	0	0	0	0	107.3
7	R	31.2	Very low	31.3	Very low	237 Å²	237	166.9 Å²	166.9	89%	0.894	85%	0.845	S	S	*	*			trans	-178	96.4	162	-109.7	173.8	178.9	-159.5	-0.4	108.4
8	N	33.2	Very low	31.4	Very low	153 Å²	153	164.9 Å²	164.9	82%	0.818	84%	0.844	S	S	*	*			trans	-161.4	74.7	146.9	-93.5	-16.8	0	0	0	107.7	L10	N8-L10 PolarHBondContact O-N 3.03Å
9	L	27.4	Very low	31.3	Very low	175 Å²	175	161.9 Å²	161.9	92%	0.916	84%	0.838	S	S	*	*			trans	-69.2	99.8	154.7	-119.8	84.2	0	0	0	105.9
10	L	32.6	Very low	31.4	Very low	149 Å²	149	158.8 Å²	158.8	78%	0.78	84%	0.837	S	S	*	*			trans	-125.4	106.1	165.9	-104.5	156.6	0	0	0	108.6	N8 L12	N8-L10 PolarHBondContact O-N 3.03Å; L10-L12 PolarHBondContact O-N 3.13Å
11	I	30.7	Very low	31.5	Very low	137 Å²	137	155.4 Å²	155.4	70%	0.703	83%	0.832	S	S	*	*			trans	-44.8	113	170.2	-65.5	153.6	0	0	0	109.8	Q13	I11-Q13 HydrophobicContact CG2-CG 4.17Å
12	L	29.9	Very low	31.3	Very low	146 Å²	146	148.8 Å²	148.8	76%	0.764	81%	0.81	S	S	*	*			trans	-122.1	86	158.7	-137	90.5	0	0	0	107.8	L10 R14	L10-L12 PolarHBondContact O-N 3.13Å; L12-R14 VanDerWaalsContact C-N 3.29Å; L12-R14 HydrophobicContact CD2-CG 4.42Å; L12-R14 PolarHBondContact O-N 3.14Å
13	Q	30.3	Very low	31.3	Very low	177 Å²	177	143 Å²	143	83%	0.827	80%	0.804	S	S	*	*			trans	-64.3	89.9	166.6	-78.9	175.8	-27.9	0	0	108.5	I11	I11-Q13 HydrophobicContact CG2-CG 4.17Å
14	R	30.7	Very low	31.5	Very low	176 Å²	176	141.5 Å²	141.5	66%	0.664	80%	0.8	S	S	*	*			trans	-90.6	103.3	160.7	-86.6	-174.8	174.5	-171.7	-0.3	108	L12 Y16	L12-R14 VanDerWaalsContact C-N 3.29Å; L12-R14 HydrophobicContact CD2-CG 4.42Å; L12-R14 PolarHBondContact O-N 3.14Å; R14-Y16 VanDerWaalsContact C-N 3.3Å; R14-Y16 HydrophobicContact CB-CD2 4.06Å; R14-Y16 HydrophobicContact CB-CE2 3.96Å; R14-Y16 PolarHBondContact O-N 3.3Å
15	T	30.2	Very low	31.6	Very low	141 Å²	141	142.2 Å²	142.2	87%	0.865	80%	0.799	S	S	*	*			trans	-56.3	90.4	161.5	42	0	0	0	0	109.4
16	Y	30.8	Very low	31.6	Very low	177 Å²	177	141.9 Å²	141.9	69%	0.694	80%	0.797	S	S	*	*			trans	-85.9	105.6	160.4	-84.1	-84.6	0	0	0	107.1	R14 T18	R14-Y16 VanDerWaalsContact C-N 3.3Å; R14-Y16 HydrophobicContact CB-CD2 4.06Å; R14-Y16 HydrophobicContact CB-CE2 3.96Å; R14-Y16 PolarHBondContact O-N 3.3Å; Y16-T18 VanDerWaalsContact C-N 3.32Å; Y16-T18 PolarHBondContact O-N 2.66Å
17	A	31.1	Very low	31.9	Very low	102 Å²	102	140.1 Å²	140.1	84%	0.843	79%	0.791	S	S	*	*			trans	-62.3	97.8	163.4	0	0	0	0	0	107.5	S19	A17-S19 PolarHBondContact O-N 2.83Å; A17-S19 VanDerWaalsContact O-N 3.08Å
18	T	32.2	Very low	32.2	Very low	132 Å²	132	133.3 Å²	133.3	81%	0.81	79%	0.785	S	S	*	*			trans	-74	94.1	167.9	41	0	0	0	0	107.3	Y16 A20	Y16-T18 VanDerWaalsContact C-N 3.32Å; Y16-T18 PolarHBondContact O-N 2.66Å; T18-A20 PolarHBondContact O-N 2.89Å; T18-A20 VanDerWaalsContact O-N 3.14Å
19	S	31.2	Very low	32.3	Very low	107 Å²	107	130.9 Å²	130.9	75%	0.748	78%	0.78	S	S	*	*			trans	-56.2	120.1	162.2	60.9	0	0	0	0	107.1	A17 A21	A17-S19 PolarHBondContact O-N 2.83Å; A17-S19 VanDerWaalsContact O-N 3.08Å; S19-A21 VanDerWaalsContact C-N 3.26Å; S19-A21 PolarHBondContact O-N 3.46Å
20	A	32.8	Very low	33	Very low	99 Å²	99	128.5 Å²	128.5	82%	0.818	78%	0.775	S	S	*	*			trans	-59.7	92	171.1	0	0	0	0	0	108.5	T18 S22	T18-A20 PolarHBondContact O-N 2.89Å; T18-A20 VanDerWaalsContact O-N 3.14Å; A20-S22 PolarHBondContact O-N 2.71Å; A20-S22 VanDerWaalsContact O-N 3.15Å
21	A	33.2	Very low	33.9	Very low	88 Å²	88	128 Å²	128	73%	0.727	77%	0.769	S	S	*	*			trans	-70.7	105.9	163.3	0	0	0	0	0	105.5	S19	S19-A21 VanDerWaalsContact C-N 3.26Å; S19-A21 PolarHBondContact O-N 3.46Å
22	S	30.2	Very low	35	Very low	102 Å²	102	124 Å²	124	71%	0.713	75%	0.752	S	S	*	*			trans	-45.2	132.7	167.9	-44.1	0	0	0	0	108.4	A20 Q24	A20-S22 PolarHBondContact O-N 2.71Å; A20-S22 VanDerWaalsContact O-N 3.15Å; S22-Q24 PolarHBondContact O-N 3.21Å
23	P	33.1	Very low	36.5	Very low	123 Å²	123	121.9 Å²	121.9	80%	0.799	75%	0.747	S	S	*	*			trans	-57.2	114.4	179	22.5	-30.1	0	0	0	107.2	T25	P23-T25 VanDerWaalsContact C-N 3.35Å; P23-T25 PolarHBondContact O-N 3.33Å
24	Q	34.1	Very low	37.9	Very low	187 Å²	187	119.4 Å²	119.4	87%	0.874	73%	0.733	S	S	*	*			trans	-55.1	110.9	164.4	-79	178.6	-4	0	0	104.8	S22 A26	S22-Q24 PolarHBondContact O-N 3.21Å; Q24-A26 VanDerWaalsContact C-N 3.29Å; Q24-A26 PolarHBondContact O-N 3.39Å
25	T	34	Very low	39.5	Very low	134 Å²	134	111.9 Å²	111.9	82%	0.822	71%	0.707	S	S	*	*			trans	-50.4	103.1	166.9	43.6	0	0	0	0	105.6	P23 S27	P23-T25 VanDerWaalsContact C-N 3.35Å; P23-T25 PolarHBondContact O-N 3.33Å; T25-S27 VanDerWaalsContact C-N 3.31Å; T25-S27 PolarHBondContact O-N 3.26Å
26	A	35.4	Very low	41.3	Very low	95 Å²	95	113.4 Å²	113.4	79%	0.785	70%	0.701	S	S	*	*			trans	-54.4	108.4	166.9	0	0	0	0	0	104.4	Q24 A28	Q24-A26 VanDerWaalsContact C-N 3.29Å; Q24-A26 PolarHBondContact O-N 3.39Å; A26-A28 PolarHBondContact O-N 3.02Å
27	S	35.7	Very low	43.2	Very low	106 Å²	106	110 Å²	110	74%	0.741	70%	0.701	S	S	*	*			trans	-57.4	106.9	177.2	53.3	0	0	0	0	105.6	T25 S29	T25-S27 VanDerWaalsContact C-N 3.31Å; T25-S27 PolarHBondContact O-N 3.26Å; S27-S29 PolarHBondContact O-N 3.12Å
28	A	38.6	Very low	45.3	Very low	94 Å²	94	107.4 Å²	107.4	78%	0.777	68%	0.684	S	S	*	*			trans	-54.8	114.7	169.2	0	0	0	0	0	105.7	A26	A26-A28 PolarHBondContact O-N 3.02Å
29	S	34.2	Very low	47.9	Very low	102 Å²	102	102.2 Å²	102.2	71%	0.713	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-48.1	133	171.3	-44.4	0	0	0	0	107.3	S27 E31	S27-S29 PolarHBondContact O-N 3.12Å; S29-E31 PolarHBondContact O-N 3.43Å; S29-E31 VanDerWaalsContact O-N 3.13Å
30	P	42.1	Very low	50.7	Low	124 Å²	124	99.4 Å²	99.4	81%	0.805	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-54.4	126	-179.8	20.2	-29.9	0	0	0	108.9
31	E	52.4	Low	53.6	Low	139 Å²	139	94.9 Å²	94.9	65%	0.65	60%	0.598	S	S	*	*	P	Polyproline II helix	trans	-54.6	131.4	175.4	-149.4	-176.9	-171.9	0	0	107.4	S29 K34	S29-E31 PolarHBondContact O-N 3.43Å; S29-E31 VanDerWaalsContact O-N 3.13Å; E31-K34 VanDerWaalsContact CD-CE 3.47Å; E31-K34 WeakPolarHBondContact OE1-CE 3.45Å; E31-K34 IonicContact OE1-NZ 2.68Å; E31-K34 PolarHBondContact OE1-NZ 3.48Å; E31-K34 WeakPolarHBondContact OE2-CE 3.42Å; E31-K34 IonicContact OE2-NZ 3.04Å; E31-K34 PolarHBondContact OE2-NZ 3.25Å
32	P	53.6	Low	56.6	Low	53 Å²	53	95.3 Å²	95.3	34%	0.344	58%	0.583	S	S	.	*	P	Polyproline II helix	trans	-56.4	148	179.7	21.5	-31.6	0	0	0	110.2	K34 L59	P32-K34 PolarHBondContact O-N 3.35Å; P32-L59 HydrophobicContact CB-CD1 4.11Å; P32-L59 HydrophobicContact CG-CD1 4.08Å
33	P	60	Low	59.8	Low	102 Å²	102	90.5 Å²	90.5	66%	0.662	55%	0.55	S	S	*	.	P	Polyproline II helix	trans	-55.4	128.1	179.1	20.9	-30.2	0	0	0	109.8	G58 L59	P33-G58 CarbonylContact O-C 3.6Å; P33-G58 WeakPolarHBondContact O-CA 3.49Å; P33-L59 PolarHBondContact O-N 3.11Å
34	K	61	Low	62.9	Low	125 Å²	125	87.6 Å²	87.6	54%	0.543	53%	0.53	S	S	.	.	B	Isolated β-bridge	trans	-72.6	140.1	-180	-64.3	-179.1	-177.3	175.7	0	109.6	E31 P32 P61	E31-K34 VanDerWaalsContact CD-CE 3.47Å; E31-K34 WeakPolarHBondContact OE1-CE 3.45Å; E31-K34 IonicContact OE1-NZ 2.68Å; E31-K34 PolarHBondContact OE1-NZ 3.48Å; E31-K34 WeakPolarHBondContact OE2-CE 3.42Å; E31-K34 IonicContact OE2-NZ 3.04Å; E31-K34 PolarHBondContact OE2-NZ 3.25Å; P32-K34 PolarHBondContact O-N 3.35Å; K34-P61 HydrophobicContact CD-CG 4.39Å
35	T	62.8	Low	65.7	Low	17 Å²	17	80.1 Å²	80.1	10%	0.104	50%	0.5	C	S	.	.	P	Polyproline II helix	trans	-58.9	148.3	170.3	42	0	0	0	0	110.8	A39 F55 P60 D107	T35-A39 HydrophobicContact CG2-CB 3.67Å; T35-F55 HydrophobicContact CG2-CD1 4.26Å; T35-P60 HydrophobicContact CG2-CG 3.9Å; T35-P60 VanDerWaalsContact OG1-CA 3.3Å; T35-P60 WeakPolarHBondContact OG1-CA 3.42Å; T35-D107 PolarHBondContact OG1-OD2 3.35Å
36	K	68.6	Low	68.6	Low	174 Å²	174	76.3 Å²	76.3	76%	0.757	48%	0.476	S	S	*	.	P	Polyproline II helix	trans	-76.2	146	162.6	-68	-179	-177.5	173.4	0	108.4	G38 A39	K36-G38 PolarHBondContact O-N 3.26Å; K36-A39 VanDerWaalsContact O-CB 3.32Å; K36-A39 WeakPolarHBondContact O-CB 3.24Å; K36-A39 PolarHBondContact O-N 3.1Å
37	P	70.2	Confident	71.2	Confident	104 Å²	104	76.1 Å²	76.1	68%	0.675	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.3	132.7	170.8	-25.4	33.5	0	0	0	110.6
38	G	76.8	Confident	73.6	Confident	49 Å²	49	73.3 Å²	73.3	51%	0.505	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.8	4.5	-174.6	0	0	0	0	0	115.2	K36 S40 D107	K36-G38 PolarHBondContact O-N 3.26Å; G38-S40 PolarHBondContact O-N 2.69Å; G38-D107 WeakPolarHBondContact CA-O 3.37Å; G38-D107 PolarHBondContact N-O 3.42Å
39	A	85.3	Confident	76.1	Confident	22 Å²	22	69.4 Å²	69.4	18%	0.182	42%	0.416	C	S	.	.			trans	-56.8	133.1	170.6	0	0	0	0	0	110.3	T35 K36 F55 V106 D107	T35-A39 HydrophobicContact CG2-CB 3.67Å; K36-A39 VanDerWaalsContact O-CB 3.32Å; K36-A39 WeakPolarHBondContact O-CB 3.24Å; K36-A39 PolarHBondContact O-N 3.1Å; A39-F55 HydrophobicContact CB-CD1 4.37Å; A39-F55 HydrophobicContact CB-CE1 4.46Å; A39-V106 WeakPolarHBondContact O-CA 3.37Å; A39-D107 PolarHBondContact O-N 3.16Å
40	S	91	Very high	79	Confident	49 Å²	49	64.6 Å²	64.6	34%	0.343	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	137.5	-178.9	-174.3	0	0	0	0	110.3	G38 E104 V105	G38-S40 PolarHBondContact O-N 2.69Å; S40-E104 WeakPolarHBondContact OG-CG 3.36Å; S40-E104 PolarHBondContact OG-OE1 3.23Å; S40-V105 CarbonylContact C-O 3.54Å; S40-V105 WeakPolarHBondContact CA-O 3.38Å
41	G	94.3	Very high	81.6	Confident	3 Å²	3	58.7 Å²	58.7	3%	0.031	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	171.3	175.6	0	0	0	0	0	110.7	H54 E104 V105	G41-H54 CarbonylContact C-O 3.57Å; G41-H54 WeakPolarHBondContact CA-O 3.37Å; G41-E104 WeakPolarHBondContact O-CA 3.46Å; G41-V105 PolarHBondContact N-O 2.8Å; G41-V105 PolarHBondContact O-N 3.45Å
42	K	96.4	Very high	83.7	Confident	98 Å²	98	52.7 Å²	52.7	43%	0.426	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	136	-178.7	-69.9	172.3	-174.7	150.7	0	110.8	V44 V53 H54 E56 H103	K42-V44 PolarHBondContact O-N 3.35Å; K42-V53 WeakPolarHBondContact O-CA 3.43Å; K42-H54 PolarHBondContact N-O 3.35Å; K42-H54 PolarHBondContact O-N 3.44Å; K42-E56 IonicContact NZ-OE1 3.48Å; K42-E56 PolarHBondContact NZ-OE1 2.81Å; K42-H103 WeakPolarHBondContact CA-O 3.49Å
43	I	97.3	Very high	85.8	Confident	1 Å²	1	50.2 Å²	50.2	1%	0.005	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	126.9	174.1	-62.2	-174.3	0	0	0	109.5	V46 V51 L99 R101 G102 H103 V105	I43-V46 HydrophobicContact CG2-CG2 3.61Å; I43-V51 HydrophobicContact CB-CG1 4.48Å; I43-V51 HydrophobicContact CD1-CG1 3.87Å; I43-V51 HydrophobicContact CG1-CG1 3.94Å; I43-V51 HydrophobicContact CG2-CG1 3.91Å; I43-L99 HydrophobicContact CD1-CB 4.26Å; I43-L99 HydrophobicContact CD1-CD1 4.04Å; I43-L99 HydrophobicContact CD1-CD2 3.99Å; I43-L99 HydrophobicContact CD1-CG 4.34Å; I43-R101 CarbonylContact O-C 3.52Å; I43-R101 WeakPolarHBondContact O-CA 3.28Å; I43-G102 PolarHBondContact O-N 2.68Å; I43-H103 HydrophobicContact CB-CB 4.39Å; I43-H103 HydrophobicContact CD1-CB 3.87Å; I43-H103 HydrophobicContact CG1-CB 4.14Å; I43-H103 PolarHBondContact N-O 2.91Å; I43-V105 HydrophobicContact CD1-CG2 4.11Å; I43-V105 HydrophobicContact CG1-CG2 3.56Å
44	V	96.4	Very high	87.5	Confident	62 Å²	62	48.6 Å²	48.6	38%	0.376	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	-29.4	176	-68.4	0	0	0	0	112.7	K42 D52 H54 V87 R101	K42-V44 PolarHBondContact O-N 3.35Å; V44-D52 HydrophobicContact CG2-CB 3.8Å; V44-D52 WeakPolarHBondContact CG2-O 3.23Å; V44-D52 PolarHBondContact N-O 3.25Å; V44-H54 HydrophobicContact CG1-CB 3.62Å; V44-V87 HydrophobicContact CG2-CG1 4.08Å; V44-R101 WeakPolarHBondContact O-CD 3.43Å; V44-R101 WeakPolarHBondContact O-CG 3.33Å
45	A	94.6	Very high	89.2	Confident	30 Å²	30	42.7 Å²	42.7	25%	0.248	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	150.1	175.3	0	0	0	0	0	111.7	D52	A45-D52 HydrophobicContact CB-CB 4.18Å; A45-D52 PolarHBondContact N-O 3.36Å; A45-D52 PolarHBondContact O-N 3.29Å
46	V	93.8	Very high	90.4	Very high	54 Å²	54	48.3 Å²	48.3	33%	0.327	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	119.4	174.5	-177.1	0	0	0	0	107.3	I43 V51 L99	I43-V46 HydrophobicContact CG2-CG2 3.61Å; V46-V51 HydrophobicContact CG1-CG2 4.39Å; V46-V51 HydrophobicContact CG2-CG1 4.44Å; V46-L99 HydrophobicContact CG2-CB 3.97Å; V46-L99 HydrophobicContact CG2-CD1 4.44Å
47	I	89.7	Confident	91.1	Very high	90 Å²	90	48 Å²	48	46%	0.462	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	86.5	-177	-51.9	175.1	0	0	0	107.9	A49 V50	I47-A49 PolarHBondContact O-N 3.04Å; I47-V50 PolarHBondContact N-O 3.47Å; I47-V50 PolarHBondContact O-N 2.95Å
48	G	87.8	Confident	91.7	Very high	48 Å²	48	43.6 Å²	43.6	50%	0.495	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.3	-126.3	-170.1	0	0	0	0	0	110.2	V50 T96	G48-V50 PolarHBondContact O-N 3.19Å; G48-T96 PolarHBondContact O-OG1 3.06Å; G48-T96 VanDerWaalsContact O-OG1 3.04Å
49	A	90.3	Very high	92.4	Very high	11 Å²	11	41.9 Å²	41.9	9%	0.091	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-1.1	178.3	0	0	0	0	0	114.7	I47 A92 P255 P256 L301	I47-A49 PolarHBondContact O-N 3.04Å; A49-A92 WeakPolarHBondContact O-CB 3.4Å; A49-A92 PolarHBondContact O-N 3.31Å; A49-P255 HydrophobicContact CB-CB 4.23Å; A49-P256 HydrophobicContact CB-CG 4.24Å; A49-L301 HydrophobicContact CB-CD1 4.11Å
50	V	94.6	Very high	92.7	Very high	2 Å²	2	40.9 Å²	40.9	1%	0.012	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	126.3	176.7	170.6	0	0	0	0	110	I47 G48 R89 T90 L301 L302	I47-V50 PolarHBondContact N-O 3.47Å; I47-V50 PolarHBondContact O-N 2.95Å; G48-V50 PolarHBondContact O-N 3.19Å; V50-R89 HydrophobicContact CG1-CG 3.67Å; V50-T90 WeakPolarHBondContact CA-O 3.47Å; V50-L301 HydrophobicContact CG2-CB 3.55Å; V50-L301 HydrophobicContact CG2-CD1 4.48Å; V50-L302 HydrophobicContact CG2-CD2 4.24Å
51	V	96.3	Very high	92.8	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	122.6	-179.7	-177.2	0	0	0	0	108.7	I43 V46 V53 L77 T90 T96 L99	I43-V51 HydrophobicContact CB-CG1 4.48Å; I43-V51 HydrophobicContact CD1-CG1 3.87Å; I43-V51 HydrophobicContact CG1-CG1 3.94Å; I43-V51 HydrophobicContact CG2-CG1 3.91Å; V46-V51 HydrophobicContact CG1-CG2 4.39Å; V46-V51 HydrophobicContact CG2-CG1 4.44Å; V51-V53 HydrophobicContact CG1-CG2 4.09Å; V51-L77 HydrophobicContact CB-CD1 4.03Å; V51-L77 HydrophobicContact CB-CD2 4.33Å; V51-L77 HydrophobicContact CG1-CD1 3.9Å; V51-L77 HydrophobicContact CG2-CD2 4.08Å; V51-T90 PolarHBondContact N-O 2.91Å; V51-T90 WeakPolarHBondContact O-CB 3.32Å; V51-T90 PolarHBondContact O-N 3.34Å; V51-T90 PolarHBondContact O-OG1 3.42Å; V51-T96 HydrophobicContact CG2-CG2 4.05Å; V51-L99 HydrophobicContact CG2-CD1 3.86Å
52	D	97.2	Very high	92.9	Very high	13 Å²	13	44.9 Å²	44.9	7%	0.07	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	130.1	175.1	-67.7	-19.9	0	0	0	109	V44 A45 V87 V88 R89	V44-D52 HydrophobicContact CG2-CB 3.8Å; V44-D52 WeakPolarHBondContact CG2-O 3.23Å; V44-D52 PolarHBondContact N-O 3.25Å; A45-D52 HydrophobicContact CB-CB 4.18Å; A45-D52 PolarHBondContact N-O 3.36Å; A45-D52 PolarHBondContact O-N 3.29Å; D52-V87 HydrophobicContact CB-CG1 4.03Å; D52-V88 WeakPolarHBondContact CA-O 3.34Å; D52-R89 WeakPolarHBondContact OD1-CA 3.31Å; D52-R89 WeakPolarHBondContact OD1-CB 3.08Å; D52-R89 WeakPolarHBondContact OD1-CG 3.29Å; D52-R89 IonicContact OD1-CZ 3.96Å; D52-R89 IonicContact OD1-NE 3.54Å; D52-R89 PolarHBondContact OD1-NE 2.9Å; D52-R89 IonicContact OD1-NH2 3.59Å; D52-R89 IonicContact OD2-CZ 3.45Å; D52-R89 IonicContact OD2-NE 2.79Å; D52-R89 IonicContact OD2-NH2 2.88Å; D52-R89 PolarHBondContact OD2-NH2 2.94Å
53	V	97.5	Very high	92.8	Very high	0 Å²	0	43 Å²	43	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	126.5	-174.4	-174.5	0	0	0	0	109.4	K42 V51 F55 L66 L77 V87 V88 T90 V105	K42-V53 WeakPolarHBondContact O-CA 3.43Å; V51-V53 HydrophobicContact CG1-CG2 4.09Å; V53-F55 HydrophobicContact CB-CE2 4.06Å; V53-F55 HydrophobicContact CG1-CD2 4.17Å; V53-F55 HydrophobicContact CG1-CE2 3.54Å; V53-F55 HydrophobicContact CG1-CZ 4.01Å; V53-L66 HydrophobicContact CB-CD1 4.49Å; V53-L66 HydrophobicContact CG2-CD1 4.37Å; V53-L77 HydrophobicContact CG2-CD1 4.17Å; V53-V87 WeakPolarHBondContact O-CA 3.48Å; V53-V88 HydrophobicContact CB-CG2 4.04Å; V53-V88 PolarHBondContact N-O 3.49Å; V53-V88 PolarHBondContact O-N 3.06Å; V53-T90 HydrophobicContact CG2-CG2 4.36Å; V53-V105 HydrophobicContact CG1-CB 3.83Å; V53-V105 HydrophobicContact CG1-CG1 4.13Å; V53-V105 HydrophobicContact CG1-CG2 4.18Å; V53-V105 HydrophobicContact CG2-CB 4.45Å; V53-V105 HydrophobicContact CG2-CG1 4.31Å; V53-V105 HydrophobicContact CG2-CG2 4.16Å
54	H	96.8	Very high	92.7	Very high	68 Å²	68	43.6 Å²	43.6	32%	0.315	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	132.4	175.7	178.9	76.6	0	0	0	110.8	G41 K42 V44 E85 N86 V87	G41-H54 CarbonylContact C-O 3.57Å; G41-H54 WeakPolarHBondContact CA-O 3.37Å; K42-H54 PolarHBondContact N-O 3.35Å; K42-H54 PolarHBondContact O-N 3.44Å; V44-H54 HydrophobicContact CG1-CB 3.62Å; H54-E85 PolarHBondContact CE1-O 3.09Å; H54-E85 VanDerWaalsContact CE1-O 3.22Å; H54-E85 PolarHBondContact ND1-O 3.47Å; H54-E85 VanDerWaalsContact ND1-O 3.08Å; H54-N86 WeakPolarHBondContact CA-O 3.07Å; H54-V87 HydrophobicContact CB-CG2 4.11Å
55	F	95.2	Very high	92.7	Very high	1 Å²	1	40.9 Å²	40.9	0%	0.004	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	139.2	174.8	-74.4	-94	0	0	0	110.1	T35 A39 V53 G58 P60 L66 N86 V88 D107	T35-F55 HydrophobicContact CG2-CD1 4.26Å; A39-F55 HydrophobicContact CB-CD1 4.37Å; A39-F55 HydrophobicContact CB-CE1 4.46Å; V53-F55 HydrophobicContact CB-CE2 4.06Å; V53-F55 HydrophobicContact CG1-CD2 4.17Å; V53-F55 HydrophobicContact CG1-CE2 3.54Å; V53-F55 HydrophobicContact CG1-CZ 4.01Å; F55-G58 WeakPolarHBondContact CB-O 3.5Å; F55-P60 HydrophobicContact CD1-CG 4.17Å; F55-P60 HydrophobicContact CD2-CG 3.96Å; F55-P60 HydrophobicContact CE1-CG 3.8Å; F55-P60 HydrophobicContact CE2-CG 3.58Å; F55-P60 HydrophobicContact CG-CG 4.25Å; F55-P60 HydrophobicContact CZ-CG 3.49Å; F55-P60 VanDerWaalsContact CZ-CG 3.49Å; F55-L66 HydrophobicContact CE2-CD1 4.01Å; F55-L66 HydrophobicContact CZ-CD1 3.93Å; F55-L66 HydrophobicContact CZ-CD2 4.14Å; F55-N86 PolarHBondContact N-O 3.07Å; F55-N86 WeakPolarHBondContact O-CB 3.39Å; F55-V88 HydrophobicContact CD2-CG2 4.13Å; F55-V88 HydrophobicContact CE2-CG2 3.7Å; F55-D107 HydrophobicContact CE1-CB 4.28Å
56	E	87.5	Confident	92.9	Very high	136 Å²	136	39.4 Å²	39.4	64%	0.636	22%	0.217	S	C	*	.	S	Bend	trans	-72.3	-41.6	-179	-66.6	-179.1	-177.5	0	0	111.3	K42 N86	K42-E56 IonicContact NZ-OE1 3.48Å; K42-E56 PolarHBondContact NZ-OE1 2.81Å; E56-N86 PolarHBondContact O-ND2 3.4Å
57	E	84	Confident	93	Very high	167 Å²	167	39 Å²	39	78%	0.78	21%	0.211	S	C	*	.	S	Bend	trans	-133.6	129.6	177.3	-68.9	-170.1	168.5	0	0	112.1
58	G	83.5	Confident	93.3	Very high	12 Å²	12	34.9 Å²	34.9	12%	0.124	19%	0.19	C	C	.	.	S	Bend	trans	71.4	166.2	178.2	0	0	0	0	0	113.8	P33 F55	P33-G58 CarbonylContact O-C 3.6Å; P33-G58 WeakPolarHBondContact O-CA 3.49Å; F55-G58 WeakPolarHBondContact CB-O 3.5Å
59	L	90.8	Very high	93.5	Very high	13 Å²	13	36.7 Å²	36.7	7%	0.068	19%	0.185	C	C	.	.	B	Isolated β-bridge	trans	-119	128.1	177.5	-75.3	176.3	0	0	0	110.2	P32 P33 H82 N86 V88	P32-L59 HydrophobicContact CB-CD1 4.11Å; P32-L59 HydrophobicContact CG-CD1 4.08Å; P33-L59 PolarHBondContact O-N 3.11Å; L59-H82 HydrophobicContact CD1-CB 4.27Å; L59-N86 VanDerWaalsContact CD2-C 3.49Å; L59-N86 HydrophobicContact CD2-CB 4.3Å; L59-V88 HydrophobicContact CD2-CG1 3.67Å
60	P	92.4	Very high	93.4	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.219	C	C	.	.	P	Polyproline II helix	trans	-57.9	134.7	169.4	-25.2	34.6	0	0	0	110.9	T35 F55 N64 L66 V79 H82 D107	T35-P60 HydrophobicContact CG2-CG 3.9Å; T35-P60 VanDerWaalsContact OG1-CA 3.3Å; T35-P60 WeakPolarHBondContact OG1-CA 3.42Å; F55-P60 HydrophobicContact CD1-CG 4.17Å; F55-P60 HydrophobicContact CD2-CG 3.96Å; F55-P60 HydrophobicContact CE1-CG 3.8Å; F55-P60 HydrophobicContact CE2-CG 3.58Å; F55-P60 HydrophobicContact CG-CG 4.25Å; F55-P60 HydrophobicContact CZ-CG 3.49Å; F55-P60 VanDerWaalsContact CZ-CG 3.49Å; P60-N64 HydrophobicContact CB-CB 4.5Å; P60-L66 HydrophobicContact CB-CD2 3.96Å; P60-L66 HydrophobicContact CG-CD2 4Å; P60-V79 HydrophobicContact CB-CG2 4.11Å; P60-H82 PolarHBondContact O-NE2 3.41Å; P60-D107 HydrophobicContact CB-CB 4.39Å; P60-D107 HydrophobicContact CG-CB 4.05Å
61	P	93.4	Very high	93.1	Very high	40 Å²	40	41.2 Å²	41.2	26%	0.26	23%	0.225	S	C	.	.	P	Polyproline II helix	trans	-52.9	153.9	175.2	-27.4	33.6	0	0	0	113.7	K34 N64 V79	K34-P61 HydrophobicContact CD-CG 4.39Å; P61-N64 WeakPolarHBondContact O-CB 3.25Å; P61-N64 PolarHBondContact O-N 3.35Å; P61-V79 WeakPolarHBondContact O-CB 3.45Å
62	I	94.7	Very high	92.7	Very high	96 Å²	96	50.6 Å²	50.6	49%	0.492	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	142.8	170.5	-60.8	167.5	0	0	0	108.8	N64	I62-N64 PolarHBondContact O-N 3.27Å
63	L	94.9	Very high	92.2	Very high	60 Å²	60	54.2 Å²	54.2	31%	0.314	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.4	-3.5	-173.7	-47.7	175.8	0	0	0	116	V79 P111 H147	L63-V79 PolarHBondContact N-O 2.96Å; L63-P111 VanDerWaalsContact O-CA 3.22Å; L63-P111 WeakPolarHBondContact O-CA 3.49Å; L63-P111 WeakPolarHBondContact O-CB 3.48Å; L63-H147 HydrophobicContact CD1-CB 4.14Å
64	N	96	Very high	92	Very high	12 Å²	12	59.3 Å²	59.3	6%	0.064	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	144.4	172.3	-91.2	25.4	0	0	0	111.3	P60 P61 I62 V79 D107 G109 S110	P60-N64 HydrophobicContact CB-CB 4.5Å; P61-N64 WeakPolarHBondContact O-CB 3.25Å; P61-N64 PolarHBondContact O-N 3.35Å; I62-N64 PolarHBondContact O-N 3.27Å; N64-V79 HydrophobicContact CB-CG2 4.44Å; N64-V79 WeakPolarHBondContact O-CG2 3.46Å; N64-V79 PolarHBondContact O-N 2.89Å; N64-D107 PolarHBondContact ND2-OD1 3.44Å; N64-D107 VanDerWaalsContact ND2-OD1 3.12Å; N64-G109 VanDerWaalsContact ND2-C 3.33Å; N64-S110 PolarHBondContact ND2-N 3.41Å
65	A	96.7	Very high	91.9	Very high	5 Å²	5	56.1 Å²	56.1	4%	0.041	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	133.6	170.9	0	0	0	0	0	110.1	V76 L77 T108 S110 I112	A65-V76 HydrophobicContact CB-CG1 3.87Å; A65-L77 CarbonylContact C-O 3.41Å; A65-L77 WeakPolarHBondContact CA-O 3.49Å; A65-T108 HydrophobicContact CB-CG2 4.28Å; A65-T108 WeakPolarHBondContact O-CB 3.41Å; A65-T108 VanDerWaalsContact O-CG2 3.31Å; A65-T108 WeakPolarHBondContact O-CG2 3.25Å; A65-T108 PolarHBondContact O-N 3.03Å; A65-T108 PolarHBondContact O-OG1 3.09Å; A65-S110 PolarHBondContact N-O 2.9Å; A65-I112 HydrophobicContact CB-CG1 3.73Å
66	L	97	Very high	92	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	144.2	169.2	-41.6	-178.2	0	0	0	109.4	V53 F55 P60 V76 L77 V79 V88 T90 V105 V106 D107	V53-L66 HydrophobicContact CB-CD1 4.49Å; V53-L66 HydrophobicContact CG2-CD1 4.37Å; F55-L66 HydrophobicContact CE2-CD1 4.01Å; F55-L66 HydrophobicContact CZ-CD1 3.93Å; F55-L66 HydrophobicContact CZ-CD2 4.14Å; P60-L66 HydrophobicContact CB-CD2 3.96Å; P60-L66 HydrophobicContact CG-CD2 4Å; L66-V76 CarbonylContact O-C 3.54Å; L66-V76 WeakPolarHBondContact O-CA 3.48Å; L66-L77 HydrophobicContact CB-CB 4.3Å; L66-L77 PolarHBondContact N-O 2.84Å; L66-L77 PolarHBondContact O-N 2.75Å; L66-V79 HydrophobicContact CD1-CG2 3.94Å; L66-V79 HydrophobicContact CD2-CG2 3.87Å; L66-V79 HydrophobicContact CG-CG2 3.82Å; L66-V88 HydrophobicContact CD1-CG2 4.11Å; L66-T90 HydrophobicContact CD1-CG2 3.73Å; L66-V105 HydrophobicContact CB-CG1 3.48Å; L66-V105 VanDerWaalsContact CB-CG1 3.48Å; L66-V105 HydrophobicContact CD1-CG1 3.91Å; L66-V105 HydrophobicContact CG-CG1 4.34Å; L66-V106 CarbonylContact C-O 3.54Å; L66-V106 VanDerWaalsContact CA-O 3.3Å; L66-V106 WeakPolarHBondContact CA-O 3.44Å; L66-D107 HydrophobicContact CD2-CB 3.78Å
67	E	95.8	Very high	92.5	Very high	44 Å²	44	49.9 Å²	49.9	21%	0.206	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	127.4	179.7	-172.9	176.7	107.7	0	0	110.7	K69 R74 V105 V106 T108	E67-K69 PolarHBondContact O-N 3.07Å; E67-K69 IonicContact OE1-NZ 3.22Å; E67-K69 PolarHBondContact OE1-NZ 3.17Å; E67-R74 IonicContact OE2-CZ 3.44Å; E67-R74 IonicContact OE2-NE 2.97Å; E67-R74 PolarHBondContact OE2-NE 3.41Å; E67-R74 IonicContact OE2-NH2 3.58Å; E67-R74 PolarHBondContact OE2-NH2 3.02Å; E67-V105 CarbonylContact O-C 3.46Å; E67-V105 WeakPolarHBondContact O-CA 3.31Å; E67-V106 PolarHBondContact N-O 2.84Å; E67-V106 PolarHBondContact O-N 2.91Å; E67-T108 HydrophobicContact CB-CG2 4.45Å
68	V	96.2	Very high	93.1	Very high	4 Å²	4	41.9 Å²	41.9	2%	0.024	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	117.7	175.5	-172.2	0	0	0	0	109.8	H71 L75 L77 L99 V105	V68-H71 HydrophobicContact CB-CB 4.12Å; V68-H71 HydrophobicContact CG1-CB 3.98Å; V68-L75 HydrophobicContact CB-CB 4.37Å; V68-L75 HydrophobicContact CG2-CB 4.24Å; V68-L75 HydrophobicContact CG2-CD2 4Å; V68-L75 HydrophobicContact CG2-CG 4.14Å; V68-L75 PolarHBondContact N-O 3.13Å; V68-L75 VanDerWaalsContact N-O 3.11Å; V68-L77 HydrophobicContact CG2-CD1 3.78Å; V68-L77 HydrophobicContact CG2-CD2 4.37Å; V68-L77 HydrophobicContact CG2-CG 3.94Å; V68-L99 HydrophobicContact CG1-CD2 3.8Å; V68-L99 HydrophobicContact CG2-CD2 4.45Å; V68-V105 HydrophobicContact CG2-CG2 4.2Å
69	K	93.3	Very high	93.8	Very high	86 Å²	86	41.3 Å²	41.3	37%	0.374	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	132	-175	-72.4	-66.5	178	-159.9	0	111.9	E67 H71 H103 E104 V106	E67-K69 PolarHBondContact O-N 3.07Å; E67-K69 IonicContact OE1-NZ 3.22Å; E67-K69 PolarHBondContact OE1-NZ 3.17Å; K69-H71 PolarHBondContact O-N 3.04Å; K69-H103 PolarHBondContact O-CD2 2.96Å; K69-H103 PolarHBondContact O-NE2 3.4Å; K69-E104 HydrophobicContact CB-CB 4.3Å; K69-E104 HydrophobicContact CG-CG 4.45Å; K69-E104 PolarHBondContact N-O 3.32Å; K69-V106 HydrophobicContact CD-CG2 4.19Å; K69-V106 VanDerWaalsContact CE-CG2 3.44Å; K69-V106 HydrophobicContact CG-CG2 3.68Å
70	G	87.8	Confident	94	Very high	80 Å²	80	41.5 Å²	41.5	83%	0.825	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	74.9	7.6	176.7	0	0	0	0	0	115
71	H	89.2	Confident	94	Very high	29 Å²	29	44.1 Å²	44.1	13%	0.134	24%	0.238	C	C	.	.			trans	-80.2	144.2	171.2	-165.5	-92.6	0	0	0	111.1	V68 K69 P73 L75 E97	V68-H71 HydrophobicContact CB-CB 4.12Å; V68-H71 HydrophobicContact CG1-CB 3.98Å; K69-H71 PolarHBondContact O-N 3.04Å; H71-P73 CarbonylContact C-O 3.55Å; H71-P73 PolarHBondContact ND1-O 2.98Å; H71-L75 HydrophobicContact CB-CB 4.46Å; H71-E97 PolarHBondContact NE2-O 3.33Å
72	K	86.2	Confident	94.1	Very high	197 Å²	197	45.5 Å²	45.5	86%	0.857	24%	0.241	S	C	*	.	S	Bend	trans	-135.8	124.7	173.6	-71.8	-173.3	178.6	-178	0	109.3
73	P	88.1	Confident	93.9	Very high	88 Å²	88	44.6 Å²	44.6	57%	0.571	24%	0.237	S	C	*	.	S	Bend	cis	-64.7	171.5	-1.8	30.4	-36.1	0	0	0	112.6	H71 L75	H71-P73 CarbonylContact C-O 3.55Å; H71-P73 PolarHBondContact ND1-O 2.98Å; P73-L75 PolarHBondContact O-N 3.29Å
74	R	92.7	Very high	93.7	Very high	107 Å²	107	43.4 Å²	43.4	40%	0.404	24%	0.239	S	C	.	.			trans	-62	122.1	-179.2	178.9	179.5	173.8	-139.9	-0.4	109.2	E67 E130	E67-R74 IonicContact OE2-CZ 3.44Å; E67-R74 IonicContact OE2-NE 2.97Å; E67-R74 PolarHBondContact OE2-NE 3.41Å; E67-R74 IonicContact OE2-NH2 3.58Å; E67-R74 PolarHBondContact OE2-NH2 3.02Å; R74-E130 WeakPolarHBondContact CD-OE1 3.34Å; R74-E130 IonicContact CZ-OE1 3.71Å; R74-E130 IonicContact NE-OE1 3.65Å; R74-E130 IonicContact NH1-OE1 3.08Å; R74-E130 PolarHBondContact NH1-OE1 3.23Å
75	L	95.1	Very high	93.3	Very high	1 Å²	1	51.3 Å²	51.3	1%	0.005	28%	0.276	C	S	.	.			trans	-107.4	121.3	179.9	-177.7	62.9	0	0	0	110.8	V68 H71 P73 L77 A92 D94 L99	V68-L75 HydrophobicContact CB-CB 4.37Å; V68-L75 HydrophobicContact CG2-CB 4.24Å; V68-L75 HydrophobicContact CG2-CD2 4Å; V68-L75 HydrophobicContact CG2-CG 4.14Å; V68-L75 PolarHBondContact N-O 3.13Å; V68-L75 VanDerWaalsContact N-O 3.11Å; H71-L75 HydrophobicContact CB-CB 4.46Å; P73-L75 PolarHBondContact O-N 3.29Å; L75-L77 HydrophobicContact CD1-CD2 4.47Å; L75-L77 HydrophobicContact CD2-CD2 4.07Å; L75-L77 HydrophobicContact CG-CD2 4.02Å; L75-A92 HydrophobicContact CD1-CB 4.22Å; L75-D94 HydrophobicContact CD1-CB 3.74Å; L75-D94 WeakPolarHBondContact CD1-O 3.36Å; L75-L99 HydrophobicContact CD2-CD1 3.71Å; L75-L99 HydrophobicContact CD2-CD2 3.99Å; L75-L99 HydrophobicContact CD2-CG 4.15Å
76	V	97	Very high	93.1	Very high	6 Å²	6	54.1 Å²	54.1	4%	0.036	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	134.5	173.7	179.8	0	0	0	0	109	A65 L66 M93 I112 I128	A65-V76 HydrophobicContact CB-CG1 3.87Å; L66-V76 CarbonylContact O-C 3.54Å; L66-V76 WeakPolarHBondContact O-CA 3.48Å; V76-M93 HydrophobicContact CB-CG 4.41Å; V76-M93 HydrophobicContact CG1-CG 4.49Å; V76-M93 WeakPolarHBondContact O-CB 3.3Å; V76-M93 WeakPolarHBondContact O-CG 3.46Å; V76-M93 PolarHBondContact O-N 3.47Å; V76-I112 HydrophobicContact CG1-CD1 4.24Å; V76-I112 HydrophobicContact CG1-CG1 4.04Å; V76-I128 HydrophobicContact CB-CG2 3.97Å; V76-I128 HydrophobicContact CG1-CG2 4.35Å; V76-I128 HydrophobicContact CG2-CD1 3.94Å; V76-I128 HydrophobicContact CG2-CG2 4.12Å
77	L	97.4	Very high	93	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	137.6	175.1	-48.9	176.7	0	0	0	108.6	V51 V53 A65 L66 V68 L75 T90 I91 A92 V105	V51-L77 HydrophobicContact CB-CD1 4.03Å; V51-L77 HydrophobicContact CB-CD2 4.33Å; V51-L77 HydrophobicContact CG1-CD1 3.9Å; V51-L77 HydrophobicContact CG2-CD2 4.08Å; V53-L77 HydrophobicContact CG2-CD1 4.17Å; A65-L77 CarbonylContact C-O 3.41Å; A65-L77 WeakPolarHBondContact CA-O 3.49Å; L66-L77 HydrophobicContact CB-CB 4.3Å; L66-L77 PolarHBondContact N-O 2.84Å; L66-L77 PolarHBondContact O-N 2.75Å; V68-L77 HydrophobicContact CG2-CD1 3.78Å; V68-L77 HydrophobicContact CG2-CD2 4.37Å; V68-L77 HydrophobicContact CG2-CG 3.94Å; L75-L77 HydrophobicContact CD1-CD2 4.47Å; L75-L77 HydrophobicContact CD2-CD2 4.07Å; L75-L77 HydrophobicContact CG-CD2 4.02Å; L77-T90 HydrophobicContact CB-CG2 4.4Å; L77-T90 WeakPolarHBondContact CB-OG1 3.37Å; L77-I91 CarbonylContact C-O 3.42Å; L77-I91 WeakPolarHBondContact CA-O 3.37Å; L77-A92 HydrophobicContact CD2-CB 3.69Å; L77-V105 HydrophobicContact CD1-CG1 4.32Å; L77-V105 HydrophobicContact CD1-CG2 4.48Å
78	E	97.5	Very high	93.1	Very high	0 Å²	0	53 Å²	53	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	129.2	172.6	-179.8	-174.4	93.9	0	0	110	A80 T90 I91 M93 I112 H147 R261	E78-A80 PolarHBondContact O-N 2.87Å; E78-T90 CarbonylContact O-C 3.26Å; E78-T90 WeakPolarHBondContact O-CA 3.27Å; E78-T90 VanDerWaalsContact O-CB 3.28Å; E78-T90 WeakPolarHBondContact O-CB 3.29Å; E78-I91 PolarHBondContact N-O 3.48Å; E78-I91 PolarHBondContact O-N 3.4Å; E78-M93 HydrophobicContact CB-CE 3.53Å; E78-I112 HydrophobicContact CB-CD1 4.37Å; E78-H147 IonicContact OE1-NE2 2.67Å; E78-H147 IonicContact OE2-CD2 2.64Å; E78-H147 IonicContact OE2-CE1 3.8Å; E78-H147 IonicContact OE2-NE2 3.06Å; E78-H147 PolarHBondContact OE2-NE2 3.38Å; E78-R261 IonicContact OE1-CZ 2.8Å; E78-R261 IonicContact OE1-NE 3.96Å; E78-R261 PolarHBondContact OE1-NE 3.34Å; E78-R261 IonicContact OE1-NH2 2.64Å; E78-R261 PolarHBondContact OE1-NH2 3.15Å; E78-R261 IonicContact OE2-NE 3.53Å; E78-R261 PolarHBondContact OE2-NE 3.31Å
79	V	97.3	Very high	93.1	Very high	0 Å²	0	55 Å²	55	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	117.3	175.8	-179.6	0	0	0	0	110.2	P60 P61 L63 N64 L66 V88 T90	P60-V79 HydrophobicContact CB-CG2 4.11Å; P61-V79 WeakPolarHBondContact O-CB 3.45Å; L63-V79 PolarHBondContact N-O 2.96Å; N64-V79 HydrophobicContact CB-CG2 4.44Å; N64-V79 WeakPolarHBondContact O-CG2 3.46Å; N64-V79 PolarHBondContact O-N 2.89Å; L66-V79 HydrophobicContact CD1-CG2 3.94Å; L66-V79 HydrophobicContact CD2-CG2 3.87Å; L66-V79 HydrophobicContact CG-CG2 3.82Å; V79-V88 HydrophobicContact CG1-CB 4.09Å; V79-V88 HydrophobicContact CG1-CG1 4.28Å; V79-V88 HydrophobicContact CG2-CG2 4.38Å; V79-T90 HydrophobicContact CG2-CG2 4.21Å
80	A	94.5	Very high	93.3	Very high	16 Å²	16	51 Å²	51	13%	0.132	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	-40.3	-179.6	0	0	0	0	0	112.5	E78 R89 I91 L302	E78-A80 PolarHBondContact O-N 2.87Å; A80-R89 PolarHBondContact N-O 3.2Å; A80-I91 HydrophobicContact CB-CD1 3.75Å; A80-I91 HydrophobicContact CB-CG1 4Å; A80-L302 HydrophobicContact CB-CD1 4.32Å; A80-L302 HydrophobicContact CB-CD2 3.98Å
81	Q	93.8	Very high	93.7	Very high	55 Å²	55	47.3 Å²	47.3	26%	0.257	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	154	-174.9	-60.8	178.3	-24.6	0	0	111.8	V88 R89	Q81-V88 WeakPolarHBondContact O-CA 3.23Å; Q81-R89 HydrophobicContact CB-CB 4.26Å; Q81-R89 PolarHBondContact N-O 3.28Å; Q81-R89 VanDerWaalsContact N-O 3.17Å; Q81-R89 PolarHBondContact O-N 3.44Å
82	H	94.7	Very high	94	Very high	69 Å²	69	46 Å²	46	32%	0.319	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	123	166.6	-63	168.9	0	0	0	109	L59 P60	L59-H82 HydrophobicContact CD1-CB 4.27Å; P60-H82 PolarHBondContact O-NE2 3.41Å
83	L	91.1	Very high	94.5	Very high	78 Å²	78	36.9 Å²	36.9	41%	0.408	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	-13.3	-177.9	-61.7	-177.4	0	0	0	113	V87 R89	L83-V87 HydrophobicContact CB-CB 4.35Å; L83-V87 HydrophobicContact CD1-CG1 4.02Å; L83-V87 PolarHBondContact N-O 2.84Å; L83-R89 HydrophobicContact CD1-CB 4.1Å; L83-R89 HydrophobicContact CD2-CB 4.1Å; L83-R89 HydrophobicContact CG-CB 4Å
84	G	89.6	Confident	94.8	Very high	35 Å²	35	35.3 Å²	35.3	36%	0.361	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	94.2	175.8	-166.6	0	0	0	0	0	111.6	N86 V87	G84-N86 PolarHBondContact O-N 3.13Å; G84-N86 VanDerWaalsContact O-N 3.11Å; G84-V87 WeakPolarHBondContact O-CB 3.25Å; G84-V87 PolarHBondContact O-N 2.81Å
85	E	89.1	Confident	94.7	Very high	178 Å²	178	31 Å²	31	83%	0.832	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	53	35.2	179.8	-56.8	-176.5	176.4	0	0	113.8	H54 V87	H54-E85 PolarHBondContact CE1-O 3.09Å; H54-E85 VanDerWaalsContact CE1-O 3.22Å; H54-E85 PolarHBondContact ND1-O 3.47Å; H54-E85 VanDerWaalsContact ND1-O 3.08Å; E85-V87 PolarHBondContact O-N 2.89Å
86	N	92.5	Very high	94.6	Very high	63 Å²	63	32.1 Å²	32.1	34%	0.337	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.8	25.6	-172.9	-54.7	-24.9	0	0	0	114.8	H54 F55 E56 L59 G84	H54-N86 WeakPolarHBondContact CA-O 3.07Å; F55-N86 PolarHBondContact N-O 3.07Å; F55-N86 WeakPolarHBondContact O-CB 3.39Å; E56-N86 PolarHBondContact O-ND2 3.4Å; L59-N86 VanDerWaalsContact CD2-C 3.49Å; L59-N86 HydrophobicContact CD2-CB 4.3Å; G84-N86 PolarHBondContact O-N 3.13Å; G84-N86 VanDerWaalsContact O-N 3.11Å
87	V	95.3	Very high	94.3	Very high	22 Å²	22	39 Å²	39	13%	0.133	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	131.3	174.6	-174.9	0	0	0	0	110.2	V44 D52 V53 H54 L83 G84 E85	V44-V87 HydrophobicContact CG2-CG1 4.08Å; D52-V87 HydrophobicContact CB-CG1 4.03Å; V53-V87 WeakPolarHBondContact O-CA 3.48Å; H54-V87 HydrophobicContact CB-CG2 4.11Å; L83-V87 HydrophobicContact CB-CB 4.35Å; L83-V87 HydrophobicContact CD1-CG1 4.02Å; L83-V87 PolarHBondContact N-O 2.84Å; G84-V87 WeakPolarHBondContact O-CB 3.25Å; G84-V87 PolarHBondContact O-N 2.81Å; E85-V87 PolarHBondContact O-N 2.89Å
88	V	96.3	Very high	93.9	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	141.5	168.4	-58.9	0	0	0	0	110.3	D52 V53 F55 L59 L66 V79 Q81 T90	D52-V88 WeakPolarHBondContact CA-O 3.34Å; V53-V88 HydrophobicContact CB-CG2 4.04Å; V53-V88 PolarHBondContact N-O 3.49Å; V53-V88 PolarHBondContact O-N 3.06Å; F55-V88 HydrophobicContact CD2-CG2 4.13Å; F55-V88 HydrophobicContact CE2-CG2 3.7Å; L59-V88 HydrophobicContact CD2-CG1 3.67Å; L66-V88 HydrophobicContact CD1-CG2 4.11Å; V79-V88 HydrophobicContact CG1-CB 4.09Å; V79-V88 HydrophobicContact CG1-CG1 4.28Å; V79-V88 HydrophobicContact CG2-CG2 4.38Å; Q81-V88 WeakPolarHBondContact O-CA 3.23Å; V88-T90 HydrophobicContact CG2-CG2 3.86Å
89	R	96.7	Very high	93.7	Very high	46 Å²	46	43.1 Å²	43.1	17%	0.174	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	129.7	169	177.3	156	-70.9	175.1	0.8	109.4	V50 D52 A80 Q81 L83 L302	V50-R89 HydrophobicContact CG1-CG 3.67Å; D52-R89 WeakPolarHBondContact OD1-CA 3.31Å; D52-R89 WeakPolarHBondContact OD1-CB 3.08Å; D52-R89 WeakPolarHBondContact OD1-CG 3.29Å; D52-R89 IonicContact OD1-CZ 3.96Å; D52-R89 IonicContact OD1-NE 3.54Å; D52-R89 PolarHBondContact OD1-NE 2.9Å; D52-R89 IonicContact OD1-NH2 3.59Å; D52-R89 IonicContact OD2-CZ 3.45Å; D52-R89 IonicContact OD2-NE 2.79Å; D52-R89 IonicContact OD2-NH2 2.88Å; D52-R89 PolarHBondContact OD2-NH2 2.94Å; A80-R89 PolarHBondContact N-O 3.2Å; Q81-R89 HydrophobicContact CB-CB 4.26Å; Q81-R89 PolarHBondContact N-O 3.28Å; Q81-R89 VanDerWaalsContact N-O 3.17Å; Q81-R89 PolarHBondContact O-N 3.44Å; L83-R89 HydrophobicContact CD1-CB 4.1Å; L83-R89 HydrophobicContact CD2-CB 4.1Å; L83-R89 HydrophobicContact CG-CB 4Å; R89-L302 HydrophobicContact CG-CD2 3.72Å
90	T	97.1	Very high	93.5	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	159.7	-176	74	0	0	0	0	112.3	V50 V51 V53 L66 L77 E78 V79 V88	V50-T90 WeakPolarHBondContact CA-O 3.47Å; V51-T90 PolarHBondContact N-O 2.91Å; V51-T90 WeakPolarHBondContact O-CB 3.32Å; V51-T90 PolarHBondContact O-N 3.34Å; V51-T90 PolarHBondContact O-OG1 3.42Å; V53-T90 HydrophobicContact CG2-CG2 4.36Å; L66-T90 HydrophobicContact CD1-CG2 3.73Å; L77-T90 HydrophobicContact CB-CG2 4.4Å; L77-T90 WeakPolarHBondContact CB-OG1 3.37Å; E78-T90 CarbonylContact O-C 3.26Å; E78-T90 WeakPolarHBondContact O-CA 3.27Å; E78-T90 VanDerWaalsContact O-CB 3.28Å; E78-T90 WeakPolarHBondContact O-CB 3.29Å; V79-T90 HydrophobicContact CG2-CG2 4.21Å; V88-T90 HydrophobicContact CG2-CG2 3.86Å
91	I	96.4	Very high	93.5	Very high	4 Å²	4	56.3 Å²	56.3	2%	0.021	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	126.5	174.9	-59	157.1	0	0	0	107.9	L77 E78 A80 M93 G257 V298 L302	L77-I91 CarbonylContact C-O 3.42Å; L77-I91 WeakPolarHBondContact CA-O 3.37Å; E78-I91 PolarHBondContact N-O 3.48Å; E78-I91 PolarHBondContact O-N 3.4Å; A80-I91 HydrophobicContact CB-CD1 3.75Å; A80-I91 HydrophobicContact CB-CG1 4Å; I91-M93 HydrophobicContact CB-CE 4.33Å; I91-M93 HydrophobicContact CG2-CE 4.21Å; I91-M93 WeakPolarHBondContact O-CE 3.3Å; I91-G257 VanDerWaalsContact CG2-CA 3.5Å; I91-V298 HydrophobicContact CD1-CG1 3.38Å; I91-V298 HydrophobicContact CG1-CG1 4Å; I91-V298 HydrophobicContact CG2-CG2 4.35Å; I91-L302 HydrophobicContact CD1-CD1 4.38Å; I91-L302 HydrophobicContact CG1-CD2 4.33Å
92	A	96.2	Very high	93.5	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	136.1	176.5	0	0	0	0	0	111.9	A49 L75 L77 D94 T96	A49-A92 WeakPolarHBondContact O-CB 3.4Å; A49-A92 PolarHBondContact O-N 3.31Å; L75-A92 HydrophobicContact CD1-CB 4.22Å; L77-A92 HydrophobicContact CD2-CB 3.69Å; A92-D94 WeakPolarHBondContact CB-O 3.34Å; A92-T96 HydrophobicContact CB-CG2 3.4Å; A92-T96 VanDerWaalsContact CB-CG2 3.4Å
93	M	95.5	Very high	93.5	Very high	6 Å²	6	54.5 Å²	54.5	3%	0.03	30%	0.304	C	S	.	.	S	Bend	trans	-87.4	-9	176.1	-61.5	-61	125.9	0	0	113.4	V76 E78 I91 I112 V127 I128 A258 R261	V76-M93 HydrophobicContact CB-CG 4.41Å; V76-M93 HydrophobicContact CG1-CG 4.49Å; V76-M93 WeakPolarHBondContact O-CB 3.3Å; V76-M93 WeakPolarHBondContact O-CG 3.46Å; V76-M93 PolarHBondContact O-N 3.47Å; E78-M93 HydrophobicContact CB-CE 3.53Å; I91-M93 HydrophobicContact CB-CE 4.33Å; I91-M93 HydrophobicContact CG2-CE 4.21Å; I91-M93 WeakPolarHBondContact O-CE 3.3Å; M93-I112 HydrophobicContact CE-CD1 4.25Å; M93-I112 HydrophobicContact CG-CD1 3.73Å; M93-I112 HydrophobicContact SD-CD1 3.81Å; M93-V127 HydrophobicContact CB-CG1 3.99Å; M93-V127 HydrophobicContact SD-CG1 4.49Å; M93-V127 HydrophobicContact SD-CG2 4.25Å; M93-I128 HydrophobicContact CB-CG2 3.95Å; M93-I128 HydrophobicContact CG-CG2 4.04Å; M93-A258 WeakPolarHBondContact O-CB 3.21Å; M93-R261 HydrophobicContact CE-CG 4.19Å; M93-R261 HydrophobicContact SD-CB 4.3Å; M93-R261 HydrophobicContact SD-CG 4.06Å
94	D	94.2	Very high	93.7	Very high	55 Å²	55	55.2 Å²	55.2	29%	0.294	31%	0.306	S	S	.	.	S	Bend	trans	-147.7	178.9	177.6	-158.2	-7.7	0	0	0	109.1	L75 A92	L75-D94 HydrophobicContact CD1-CB 3.74Å; L75-D94 WeakPolarHBondContact CD1-O 3.36Å; A92-D94 WeakPolarHBondContact CB-O 3.34Å
95	G	91.8	Very high	94	Very high	17 Å²	17	53.6 Å²	53.6	18%	0.175	29%	0.289	C	S	.	.			trans	-49.7	136.8	178.9	0	0	0	0	0	113.1	E97	G95-E97 WeakPolarHBondContact CA-OE2 3.36Å
96	T	91.9	Very high	94.3	Very high	25 Å²	25	46.1 Å²	46.1	15%	0.153	26%	0.255	C	S	.	.			trans	-98	10.9	179.6	56.5	0	0	0	0	112.4	G48 V51 A92 G98 L99	G48-T96 PolarHBondContact O-OG1 3.06Å; G48-T96 VanDerWaalsContact O-OG1 3.04Å; V51-T96 HydrophobicContact CG2-CG2 4.05Å; A92-T96 HydrophobicContact CB-CG2 3.4Å; A92-T96 VanDerWaalsContact CB-CG2 3.4Å; T96-G98 PolarHBondContact O-N 2.88Å; T96-L99 HydrophobicContact CG2-CD1 4.02Å; T96-L99 WeakPolarHBondContact O-CB 3.3Å; T96-L99 WeakPolarHBondContact O-CG 3.24Å; T96-L99 PolarHBondContact O-N 3.41Å
97	E	90.9	Very high	94.4	Very high	149 Å²	149	43.2 Å²	43.2	70%	0.696	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.7	131.5	179.1	-65	81.8	-179.7	0	0	110.9	H71 G95 L99	H71-E97 PolarHBondContact NE2-O 3.33Å; G95-E97 WeakPolarHBondContact CA-OE2 3.36Å; E97-L99 VanDerWaalsContact C-N 3.34Å
98	G	90	Very high	94.3	Very high	68 Å²	68	45 Å²	45	70%	0.701	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.7	-4.4	179.4	0	0	0	0	0	114.9	T96	T96-G98 PolarHBondContact O-N 2.88Å
99	L	93	Very high	94.1	Very high	20 Å²	20	46.5 Å²	46.5	11%	0.105	27%	0.266	C	S	.	.			trans	-66.8	137	170.7	-63.9	-174.2	0	0	0	111.6	I43 V46 V51 V68 L75 T96 E97	I43-L99 HydrophobicContact CD1-CB 4.26Å; I43-L99 HydrophobicContact CD1-CD1 4.04Å; I43-L99 HydrophobicContact CD1-CD2 3.99Å; I43-L99 HydrophobicContact CD1-CG 4.34Å; V46-L99 HydrophobicContact CG2-CB 3.97Å; V46-L99 HydrophobicContact CG2-CD1 4.44Å; V51-L99 HydrophobicContact CG2-CD1 3.86Å; V68-L99 HydrophobicContact CG1-CD2 3.8Å; V68-L99 HydrophobicContact CG2-CD2 4.45Å; L75-L99 HydrophobicContact CD2-CD1 3.71Å; L75-L99 HydrophobicContact CD2-CD2 3.99Å; L75-L99 HydrophobicContact CD2-CG 4.15Å; T96-L99 HydrophobicContact CG2-CD1 4.02Å; T96-L99 WeakPolarHBondContact O-CB 3.3Å; T96-L99 WeakPolarHBondContact O-CG 3.24Å; T96-L99 PolarHBondContact O-N 3.41Å; E97-L99 VanDerWaalsContact C-N 3.34Å
100	V	93	Very high	93.9	Very high	89 Å²	89	45.5 Å²	45.5	54%	0.539	27%	0.266	S	S	.	.			trans	-128.1	155.9	177.4	-62.5	0	0	0	0	111	H103	V100-H103 HydrophobicContact CG2-CB 4.3Å; V100-H103 WeakPolarHBondContact O-CB 3.31Å; V100-H103 PolarHBondContact O-N 2.91Å
101	R	94.3	Very high	93.9	Very high	203 Å²	203	47.1 Å²	47.1	77%	0.766	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	140.1	172	-67.8	-175.1	-72.2	-163.2	-4.6	110.2	I43 V44 H103	I43-R101 CarbonylContact O-C 3.52Å; I43-R101 WeakPolarHBondContact O-CA 3.28Å; V44-R101 WeakPolarHBondContact O-CD 3.43Å; V44-R101 WeakPolarHBondContact O-CG 3.33Å; R101-H103 VanDerWaalsContact C-N 3.29Å
102	G	93.2	Very high	93.9	Very high	47 Å²	47	47.2 Å²	47.2	49%	0.485	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.5	-5.4	-175	0	0	0	0	0	114.4	I43 E104	I43-G102 PolarHBondContact O-N 2.68Å; G102-E104 PolarHBondContact O-N 3.31Å
103	H	94.6	Very high	93.9	Very high	39 Å²	39	52.5 Å²	52.5	18%	0.181	30%	0.3	C	S	.	.			trans	-61.3	132.3	174.7	-157.9	156.2	0	0	0	109.8	K42 I43 K69 V100 R101	K42-H103 WeakPolarHBondContact CA-O 3.49Å; I43-H103 HydrophobicContact CB-CB 4.39Å; I43-H103 HydrophobicContact CD1-CB 3.87Å; I43-H103 HydrophobicContact CG1-CB 4.14Å; I43-H103 PolarHBondContact N-O 2.91Å; K69-H103 PolarHBondContact O-CD2 2.96Å; K69-H103 PolarHBondContact O-NE2 3.4Å; V100-H103 HydrophobicContact CG2-CB 4.3Å; V100-H103 WeakPolarHBondContact O-CB 3.31Å; V100-H103 PolarHBondContact O-N 2.91Å; R101-H103 VanDerWaalsContact C-N 3.29Å
104	E	95.9	Very high	94	Very high	94 Å²	94	52.2 Å²	52.2	44%	0.439	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	134.3	-178.8	-168.5	176.4	-170.9	0	0	112.6	S40 G41 K69 G102	S40-E104 WeakPolarHBondContact OG-CG 3.36Å; S40-E104 PolarHBondContact OG-OE1 3.23Å; G41-E104 WeakPolarHBondContact O-CA 3.46Å; K69-E104 HydrophobicContact CB-CB 4.3Å; K69-E104 HydrophobicContact CG-CG 4.45Å; K69-E104 PolarHBondContact N-O 3.32Å; G102-E104 PolarHBondContact O-N 3.31Å
105	V	96.4	Very high	94.1	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	134.6	179.6	178.6	0	0	0	0	108.5	S40 G41 I43 V53 L66 E67 V68 L77	S40-V105 CarbonylContact C-O 3.54Å; S40-V105 WeakPolarHBondContact CA-O 3.38Å; G41-V105 PolarHBondContact N-O 2.8Å; G41-V105 PolarHBondContact O-N 3.45Å; I43-V105 HydrophobicContact CD1-CG2 4.11Å; I43-V105 HydrophobicContact CG1-CG2 3.56Å; V53-V105 HydrophobicContact CG1-CB 3.83Å; V53-V105 HydrophobicContact CG1-CG1 4.13Å; V53-V105 HydrophobicContact CG1-CG2 4.18Å; V53-V105 HydrophobicContact CG2-CB 4.45Å; V53-V105 HydrophobicContact CG2-CG1 4.31Å; V53-V105 HydrophobicContact CG2-CG2 4.16Å; L66-V105 HydrophobicContact CB-CG1 3.48Å; L66-V105 VanDerWaalsContact CB-CG1 3.48Å; L66-V105 HydrophobicContact CD1-CG1 3.91Å; L66-V105 HydrophobicContact CG-CG1 4.34Å; E67-V105 CarbonylContact O-C 3.46Å; E67-V105 WeakPolarHBondContact O-CA 3.31Å; V68-V105 HydrophobicContact CG2-CG2 4.2Å; L77-V105 HydrophobicContact CD1-CG1 4.32Å; L77-V105 HydrophobicContact CD1-CG2 4.48Å
106	V	95.5	Very high	94.3	Very high	22 Å²	22	49.3 Å²	49.3	13%	0.133	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	130.5	-176.4	176.4	0	0	0	0	110.8	A39 L66 E67 K69 T108	A39-V106 WeakPolarHBondContact O-CA 3.37Å; L66-V106 CarbonylContact C-O 3.54Å; L66-V106 VanDerWaalsContact CA-O 3.3Å; L66-V106 WeakPolarHBondContact CA-O 3.44Å; E67-V106 PolarHBondContact N-O 2.84Å; E67-V106 PolarHBondContact O-N 2.91Å; K69-V106 HydrophobicContact CD-CG2 4.19Å; K69-V106 VanDerWaalsContact CE-CG2 3.44Å; K69-V106 HydrophobicContact CG-CG2 3.68Å; V106-T108 PolarHBondContact O-N 2.9Å
107	D	94.8	Very high	94.4	Very high	2 Å²	2	48.1 Å²	48.1	1%	0.011	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	122.6	171.5	178.5	17.6	0	0	0	110.6	T35 G38 A39 F55 P60 N64 L66 G109	T35-D107 PolarHBondContact OG1-OD2 3.35Å; G38-D107 WeakPolarHBondContact CA-O 3.37Å; G38-D107 PolarHBondContact N-O 3.42Å; A39-D107 PolarHBondContact O-N 3.16Å; F55-D107 HydrophobicContact CE1-CB 4.28Å; P60-D107 HydrophobicContact CB-CB 4.39Å; P60-D107 HydrophobicContact CG-CB 4.05Å; N64-D107 PolarHBondContact ND2-OD1 3.44Å; N64-D107 VanDerWaalsContact ND2-OD1 3.12Å; L66-D107 HydrophobicContact CD2-CB 3.78Å; D107-G109 PolarHBondContact O-N 3.42Å; D107-G109 PolarHBondContact OD1-N 3.46Å
108	T	92.8	Very high	94.4	Very high	58 Å²	58	44.2 Å²	44.2	36%	0.356	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	-15.5	177.7	66.4	0	0	0	0	112.4	A65 E67 V106 S110	A65-T108 HydrophobicContact CB-CG2 4.28Å; A65-T108 WeakPolarHBondContact O-CB 3.41Å; A65-T108 VanDerWaalsContact O-CG2 3.31Å; A65-T108 WeakPolarHBondContact O-CG2 3.25Å; A65-T108 PolarHBondContact O-N 3.03Å; A65-T108 PolarHBondContact O-OG1 3.09Å; E67-T108 HydrophobicContact CB-CG2 4.45Å; V106-T108 PolarHBondContact O-N 2.9Å; T108-S110 VanDerWaalsContact C-N 3.29Å; T108-S110 PolarHBondContact OG1-O 3.36Å
109	G	91.3	Very high	94.5	Very high	32 Å²	32	42.3 Å²	42.3	33%	0.33	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	81.6	2.2	-179.1	0	0	0	0	0	114.3	N64 D107	N64-G109 VanDerWaalsContact ND2-C 3.33Å; D107-G109 PolarHBondContact O-N 3.42Å; D107-G109 PolarHBondContact OD1-N 3.46Å
110	S	93.7	Very high	94.6	Very high	25 Å²	25	41.4 Å²	41.4	18%	0.175	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	167.4	174.3	63.7	0	0	0	0	111.8	N64 A65 T108 K113	N64-S110 PolarHBondContact ND2-N 3.41Å; A65-S110 PolarHBondContact N-O 2.9Å; T108-S110 VanDerWaalsContact C-N 3.29Å; T108-S110 PolarHBondContact OG1-O 3.36Å; S110-K113 VanDerWaalsContact OG-CE 3.25Å; S110-K113 WeakPolarHBondContact OG-CE 3.2Å; S110-K113 PolarHBondContact OG-NZ 3.42Å
111	P	96	Very high	94.6	Very high	35 Å²	35	38.1 Å²	38.1	23%	0.227	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.2	168.9	167.4	-23.4	34.4	0	0	0	112.9	L63 K113 A145	L63-P111 VanDerWaalsContact O-CA 3.22Å; L63-P111 WeakPolarHBondContact O-CA 3.49Å; L63-P111 WeakPolarHBondContact O-CB 3.48Å; P111-K113 PolarHBondContact O-N 3.12Å; P111-K113 VanDerWaalsContact O-N 3.1Å; P111-A145 HydrophobicContact CB-CB 4.09Å; P111-A145 HydrophobicContact CG-CB 4.49Å
112	I	97.1	Very high	94.5	Very high	5 Å²	5	28.5 Å²	28.5	3%	0.026	18%	0.179	C	C	.	.			trans	-54.7	119.3	174.8	-61	172.8	0	0	0	108.5	A65 V76 E78 M93 I114 I128 A145 I146	A65-I112 HydrophobicContact CB-CG1 3.73Å; V76-I112 HydrophobicContact CG1-CD1 4.24Å; V76-I112 HydrophobicContact CG1-CG1 4.04Å; E78-I112 HydrophobicContact CB-CD1 4.37Å; M93-I112 HydrophobicContact CE-CD1 4.25Å; M93-I112 HydrophobicContact CG-CD1 3.73Å; M93-I112 HydrophobicContact SD-CD1 3.81Å; I112-I114 HydrophobicContact CG2-CG2 4.26Å; I112-I128 HydrophobicContact CD1-CG2 4.43Å; I112-I128 HydrophobicContact CG2-CB 4.27Å; I112-I128 HydrophobicContact CG2-CG2 4.1Å; I112-A145 CarbonylContact O-C 3.57Å; I112-A145 VanDerWaalsContact O-CA 3.29Å; I112-A145 WeakPolarHBondContact O-CA 3.03Å; I112-I146 HydrophobicContact CB-CD1 3.91Å; I112-I146 HydrophobicContact CB-CG1 4.12Å; I112-I146 HydrophobicContact CD1-CD1 4Å; I112-I146 HydrophobicContact CG1-CD1 4.45Å; I112-I146 HydrophobicContact CG2-CD1 4.26Å; I112-I146 HydrophobicContact CG2-CG2 4.27Å; I112-I146 PolarHBondContact O-N 3.4Å
113	K	96.3	Very high	94.5	Very high	112 Å²	112	27.3 Å²	27.3	49%	0.487	16%	0.16	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	130.1	178.2	-76	178.1	-178.8	169.6	0	110.2	S110 P111 S144 A145	S110-K113 VanDerWaalsContact OG-CE 3.25Å; S110-K113 WeakPolarHBondContact OG-CE 3.2Å; S110-K113 PolarHBondContact OG-NZ 3.42Å; P111-K113 PolarHBondContact O-N 3.12Å; P111-K113 VanDerWaalsContact O-N 3.1Å; K113-S144 CarbonylContact C-O 3.57Å; K113-S144 VanDerWaalsContact CA-O 3.28Å; K113-S144 WeakPolarHBondContact CA-O 3.43Å; K113-A145 HydrophobicContact CG-CB 4.45Å
114	I	97.1	Very high	94.6	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	152.1	-177.7	66.8	165.8	0	0	0	110.1	I112 V116 Y143 S144 I146 T265 T268 V269	I112-I114 HydrophobicContact CG2-CG2 4.26Å; I114-V116 HydrophobicContact CD1-CG1 4.41Å; I114-V116 HydrophobicContact CG1-CG1 4.15Å; I114-Y143 VanDerWaalsContact C-CD1 3.48Å; I114-Y143 CarbonylContact O-C 3.53Å; I114-Y143 WeakPolarHBondContact O-CA 3.26Å; I114-S144 PolarHBondContact N-O 3.07Å; I114-S144 PolarHBondContact O-N 3.28Å; I114-I146 HydrophobicContact CD1-CG2 4.29Å; I114-I146 HydrophobicContact CG1-CG2 4.29Å; I114-I146 HydrophobicContact CG2-CG2 3.6Å; I114-T265 HydrophobicContact CD1-CG2 3.61Å; I114-T265 VanDerWaalsContact CD1-O 3.28Å; I114-T265 WeakPolarHBondContact CD1-O 3.26Å; I114-T265 HydrophobicContact CG2-CG2 4.12Å; I114-T268 HydrophobicContact CD1-CG2 3.95Å; I114-T268 HydrophobicContact CG1-CG2 4.14Å; I114-V269 HydrophobicContact CD1-CG2 3.81Å
115	P	97.3	Very high	94.6	Very high	6 Å²	6	21.8 Å²	21.8	4%	0.039	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	137.7	170.8	27.4	-31.1	0	0	0	109.8	T120 G129 I138 T140 Y143	P115-T120 WeakPolarHBondContact O-CG2 3.41Å; P115-G129 WeakPolarHBondContact CD-O 3.34Å; P115-G129 WeakPolarHBondContact CG-O 3.36Å; P115-I138 HydrophobicContact CB-CB 4.34Å; P115-I138 HydrophobicContact CB-CG2 3.94Å; P115-I138 HydrophobicContact CG-CB 4.24Å; P115-I138 HydrophobicContact CG-CD1 3.85Å; P115-I138 HydrophobicContact CG-CG2 4.2Å; P115-T140 HydrophobicContact CB-CG2 3.28Å; P115-Y143 HydrophobicContact CB-CD1 4.38Å; P115-Y143 HydrophobicContact CB-CE1 3.98Å
116	V	96.2	Very high	94.5	Very high	4 Å²	4	22.7 Å²	22.7	2%	0.024	14%	0.139	C	C	.	.			trans	-130.7	161	176.5	-65.3	0	0	0	0	111.1	I114 T140 R142 T268 Y272	I114-V116 HydrophobicContact CD1-CG1 4.41Å; I114-V116 HydrophobicContact CG1-CG1 4.15Å; V116-T140 PolarHBondContact O-OG1 3.37Å; V116-R142 HydrophobicContact CG2-CB 3.91Å; V116-R142 PolarHBondContact N-O 3.33Å; V116-T268 HydrophobicContact CG1-CG2 4.23Å; V116-Y272 HydrophobicContact CB-CD2 3.89Å; V116-Y272 HydrophobicContact CB-CG 3.9Å; V116-Y272 HydrophobicContact CG2-CD2 3.5Å; V116-Y272 VanDerWaalsContact CG2-CD2 3.5Å; V116-Y272 HydrophobicContact CG2-CE2 4.14Å; V116-Y272 HydrophobicContact CG2-CG 4.05Å
117	G	92.2	Very high	94.6	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	13%	0.134	C	C	.	.	S	Bend	trans	96	-171.7	175.9	0	0	0	0	0	115.5	G119 T120	G117-G119 PolarHBondContact O-N 3.41Å; G117-T120 WeakPolarHBondContact O-CB 3.16Å; G117-T120 PolarHBondContact O-N 3.33Å; G117-T120 PolarHBondContact O-OG1 3.46Å
118	P	91.8	Very high	94.6	Very high	68 Å²	68	22.4 Å²	22.4	44%	0.442	14%	0.137	S	C	.	.	G	3₁₀ helix	trans	-56.1	-27.2	-165.2	-28.9	35.9	0	0	0	114.7	T120 L121 F273	P118-T120 PolarHBondContact O-N 3.31Å; P118-T120 VanDerWaalsContact O-N 3.17Å; P118-L121 HydrophobicContact CB-CD1 4.34Å; P118-L121 WeakPolarHBondContact O-CB 3.39Å; P118-L121 WeakPolarHBondContact O-CG 3.28Å; P118-L121 PolarHBondContact O-N 2.81Å; P118-F273 HydrophobicContact CG-CE1 4.46Å
119	G	92.3	Very high	94.7	Very high	28 Å²	28	19.9 Å²	19.9	29%	0.289	12%	0.122	S	C	.	.	G	3₁₀ helix	trans	-61.8	-18.8	174.9	0	0	0	0	0	114.9	G117 R123 I138	G117-G119 PolarHBondContact O-N 3.41Å; G119-R123 VanDerWaalsContact O-CG 3.3Å; G119-R123 WeakPolarHBondContact O-CG 3.44Å; G119-I138 WeakPolarHBondContact O-CG2 3.25Å
120	T	94.7	Very high	94.9	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.12	C	C	.	.	G	3₁₀ helix	trans	-80.8	-15.2	175.1	68.5	0	0	0	0	113.1	P115 G117 P118 R123 M125 I138 A246	P115-T120 WeakPolarHBondContact O-CG2 3.41Å; G117-T120 WeakPolarHBondContact O-CB 3.16Å; G117-T120 PolarHBondContact O-N 3.33Å; G117-T120 PolarHBondContact O-OG1 3.46Å; P118-T120 PolarHBondContact O-N 3.31Å; P118-T120 VanDerWaalsContact O-N 3.17Å; T120-R123 WeakPolarHBondContact O-CB 3.33Å; T120-R123 PolarHBondContact O-N 2.89Å; T120-M125 HydrophobicContact CG2-CE 3.82Å; T120-I138 HydrophobicContact CG2-CG2 4.22Å; T120-A246 WeakPolarHBondContact O-CB 3.4Å
121	L	93.2	Very high	95	Very high	21 Å²	21	22.4 Å²	22.4	11%	0.11	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	133.8	-178.5	-62.3	169	0	0	0	110.4	P118 R123 Y210 S243 F273	P118-L121 HydrophobicContact CB-CD1 4.34Å; P118-L121 WeakPolarHBondContact O-CB 3.39Å; P118-L121 WeakPolarHBondContact O-CG 3.28Å; P118-L121 PolarHBondContact O-N 2.81Å; L121-R123 PolarHBondContact O-N 2.98Å; L121-Y210 HydrophobicContact CD1-CD1 3.76Å; L121-Y210 HydrophobicContact CD1-CE1 3.37Å; L121-Y210 HydrophobicContact CD2-CD1 3.76Å; L121-Y210 HydrophobicContact CD2-CE1 4.28Å; L121-Y210 HydrophobicContact CD2-CG 4.28Å; L121-Y210 HydrophobicContact CG-CD1 4.44Å; L121-Y210 HydrophobicContact CG-CE1 4.48Å; L121-S243 WeakPolarHBondContact CB-O 3.43Å; L121-F273 HydrophobicContact CD1-CE1 4.31Å; L121-F273 HydrophobicContact CD1-CZ 4.17Å; L121-F273 HydrophobicContact CD2-CE2 4.14Å; L121-F273 HydrophobicContact CD2-CZ 3.77Å; L121-F273 HydrophobicContact CG-CE1 4.5Å; L121-F273 HydrophobicContact CG-CZ 3.86Å
122	G	91.6	Very high	94.8	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.1	6.9	-175.3	0	0	0	0	0	114	R135 S243 V245	G122-R135 PolarHBondContact O-NH1 3Å; G122-S243 VanDerWaalsContact CA-CB 3.49Å; G122-S243 WeakPolarHBondContact CA-OG 3.46Å; G122-V245 WeakPolarHBondContact CA-O 3.44Å; G122-V245 PolarHBondContact N-O 3.38Å
123	R	94.8	Very high	94.6	Very high	23 Å²	23	24.8 Å²	24.8	9%	0.087	14%	0.137	C	C	.	.			trans	-105.4	155.4	-178.9	-53.3	-56.1	-56.1	-81.3	-7	111.1	G119 T120 L121 D133 G136 P137 I138 L247	G119-R123 VanDerWaalsContact O-CG 3.3Å; G119-R123 WeakPolarHBondContact O-CG 3.44Å; T120-R123 WeakPolarHBondContact O-CB 3.33Å; T120-R123 PolarHBondContact O-N 2.89Å; L121-R123 PolarHBondContact O-N 2.98Å; R123-D133 WeakPolarHBondContact CA-OD2 3.33Å; R123-D133 IonicContact CZ-OD1 3.68Å; R123-D133 IonicContact CZ-OD2 3.05Å; R123-D133 IonicContact NE-OD1 2.86Å; R123-D133 IonicContact NE-OD2 3.88Å; R123-D133 PolarHBondContact NE-OD2 3.35Å; R123-D133 IonicContact NH2-OD1 3.72Å; R123-D133 PolarHBondContact NH2-OD1 3.4Å; R123-D133 IonicContact NH2-OD2 2.77Å; R123-D133 PolarHBondContact NH2-OD2 3.36Å; R123-G136 PolarHBondContact NH2-O 3.48Å; R123-P137 PolarHBondContact NH1-O 2.81Å; R123-I138 HydrophobicContact CB-CD1 4.3Å; R123-I138 HydrophobicContact CB-CG1 4.38Å; R123-I138 HydrophobicContact CG-CG1 4.37Å; R123-L247 PolarHBondContact O-N 2.85Å
124	I	95.3	Very high	94.2	Very high	16 Å²	16	28.8 Å²	28.8	8%	0.082	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	125.9	171.3	-46.1	-180	0	0	0	109.1	P131 I132 D133 Y227 L247 Y249	I124-P131 VanDerWaalsContact O-CA 3.31Å; I124-P131 WeakPolarHBondContact O-CA 3.39Å; I124-I132 HydrophobicContact CB-CG1 4.04Å; I124-I132 HydrophobicContact CG2-CD1 3.79Å; I124-I132 HydrophobicContact CG2-CG1 3.53Å; I124-I132 PolarHBondContact O-N 3.03Å; I124-D133 HydrophobicContact CB-CB 3.91Å; I124-D133 HydrophobicContact CD1-CB 4.13Å; I124-D133 HydrophobicContact CG1-CB 3.93Å; I124-D133 PolarHBondContact N-OD2 3.16Å; I124-Y227 HydrophobicContact CD1-CD1 3.96Å; I124-Y227 HydrophobicContact CD1-CD2 3.7Å; I124-Y227 HydrophobicContact CD1-CE1 4.09Å; I124-Y227 HydrophobicContact CD1-CE2 3.83Å; I124-Y227 HydrophobicContact CD1-CG 3.75Å; I124-Y227 HydrophobicContact CG1-CD2 4.08Å; I124-Y227 HydrophobicContact CG1-CE2 3.97Å; I124-L247 CarbonylContact C-O 3.39Å; I124-L247 WeakPolarHBondContact CA-O 3.39Å; I124-L247 HydrophobicContact CB-CB 4.46Å; I124-L247 HydrophobicContact CD1-CD1 4.47Å; I124-L247 HydrophobicContact CG1-CB 4.19Å; I124-L247 HydrophobicContact CG1-CD1 4.05Å; I124-L247 HydrophobicContact CG2-CB 4.26Å; I124-Y249 HydrophobicContact CG2-CD2 3.3Å; I124-Y249 HydrophobicContact CG2-CE2 3.62Å
125	M	96	Very high	93.9	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	154.2	176.8	72.3	-171.3	92.4	0	0	113	T120 E130 I138 L247 V248 Y249 T265 V269	T120-M125 HydrophobicContact CG2-CE 3.82Å; M125-E130 CarbonylContact C-O 3.55Å; M125-E130 WeakPolarHBondContact CA-O 3.24Å; M125-I138 HydrophobicContact CB-CD1 4.15Å; M125-L247 PolarHBondContact N-O 2.96Å; M125-V248 HydrophobicContact CE-CG2 4.09Å; M125-V248 HydrophobicContact CG-CB 4.22Å; M125-V248 HydrophobicContact CG-CG1 4.01Å; M125-V248 HydrophobicContact CG-CG2 3.76Å; M125-V248 CarbonylContact O-C 3.58Å; M125-V248 WeakPolarHBondContact O-CA 3.46Å; M125-V248 HydrophobicContact SD-CG2 4.01Å; M125-Y249 PolarHBondContact O-N 3.21Å; M125-T265 HydrophobicContact SD-CG2 4.5Å; M125-V269 HydrophobicContact CE-CG2 3.89Å; M125-V269 HydrophobicContact SD-CG2 4.06Å
126	N	95.5	Very high	93.6	Very high	19 Å²	19	34.6 Å²	34.6	10%	0.102	19%	0.19	C	C	.	.			trans	-86.3	-176.8	171.9	69.1	10.3	0	0	0	111.9	I128 G129 E130 I132	N126-I128 PolarHBondContact O-N 3.09Å; N126-I128 WeakPolarHBondContact OD1-CG1 3.43Å; N126-I128 PolarHBondContact OD1-N 3.47Å; N126-I128 VanDerWaalsContact OD1-N 3.13Å; N126-G129 PolarHBondContact O-N 2.94Å; N126-G129 PolarHBondContact OD1-N 3.16Å; N126-G129 VanDerWaalsContact OD1-N 3.14Å; N126-E130 PolarHBondContact N-O 3.06Å; N126-E130 PolarHBondContact OD1-N 2.96Å; N126-E130 PolarHBondContact OD1-O 3.35Å; N126-I132 HydrophobicContact CB-CG2 3.92Å
127	V	95.7	Very high	93.4	Very high	4 Å²	4	39.3 Å²	39.3	2%	0.024	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-33.3	-179.7	64.9	0	0	0	0	114.2	M93 G129 A258 R261 V262 T265	M93-V127 HydrophobicContact CB-CG1 3.99Å; M93-V127 HydrophobicContact SD-CG1 4.49Å; M93-V127 HydrophobicContact SD-CG2 4.25Å; V127-G129 VanDerWaalsContact C-N 3.34Å; V127-A258 HydrophobicContact CB-CB 4.4Å; V127-A258 HydrophobicContact CG1-CB 3.96Å; V127-R261 HydrophobicContact CG2-CB 3.55Å; V127-V262 HydrophobicContact CB-CB 4.32Å; V127-V262 HydrophobicContact CB-CG2 4.48Å; V127-V262 HydrophobicContact CG2-CB 4.33Å; V127-T265 PolarHBondContact O-OG1 3.36Å
128	I	95.9	Very high	93.5	Very high	15 Å²	15	40 Å²	40	8%	0.077	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.1	7.2	178.7	61.2	170.8	0	0	0	113.4	V76 M93 I112 N126 E130	V76-I128 HydrophobicContact CB-CG2 3.97Å; V76-I128 HydrophobicContact CG1-CG2 4.35Å; V76-I128 HydrophobicContact CG2-CD1 3.94Å; V76-I128 HydrophobicContact CG2-CG2 4.12Å; M93-I128 HydrophobicContact CB-CG2 3.95Å; M93-I128 HydrophobicContact CG-CG2 4.04Å; I112-I128 HydrophobicContact CD1-CG2 4.43Å; I112-I128 HydrophobicContact CG2-CB 4.27Å; I112-I128 HydrophobicContact CG2-CG2 4.1Å; N126-I128 PolarHBondContact O-N 3.09Å; N126-I128 WeakPolarHBondContact OD1-CG1 3.43Å; N126-I128 PolarHBondContact OD1-N 3.47Å; N126-I128 VanDerWaalsContact OD1-N 3.13Å; I128-E130 HydrophobicContact CD1-CG 3.99Å; I128-E130 HydrophobicContact CG1-CB 4.4Å; I128-E130 HydrophobicContact CG1-CG 4Å
129	G	94.9	Very high	93.3	Very high	5 Å²	5	45.6 Å²	45.6	5%	0.052	24%	0.242	C	C	.	.	S	Bend	trans	80.4	12.7	175.9	0	0	0	0	0	114.8	P115 N126 V127	P115-G129 WeakPolarHBondContact CD-O 3.34Å; P115-G129 WeakPolarHBondContact CG-O 3.36Å; N126-G129 PolarHBondContact O-N 2.94Å; N126-G129 PolarHBondContact OD1-N 3.16Å; N126-G129 VanDerWaalsContact OD1-N 3.14Å; V127-G129 VanDerWaalsContact C-N 3.34Å
130	E	95.3	Very high	93.2	Very high	61 Å²	61	45.6 Å²	45.6	29%	0.285	24%	0.236	S	C	.	.			trans	-81.7	139.9	174.6	-68.9	-177	163.4	0	0	110.7	R74 M125 N126 I128 I132	R74-E130 WeakPolarHBondContact CD-OE1 3.34Å; R74-E130 IonicContact CZ-OE1 3.71Å; R74-E130 IonicContact NE-OE1 3.65Å; R74-E130 IonicContact NH1-OE1 3.08Å; R74-E130 PolarHBondContact NH1-OE1 3.23Å; M125-E130 CarbonylContact C-O 3.55Å; M125-E130 WeakPolarHBondContact CA-O 3.24Å; N126-E130 PolarHBondContact N-O 3.06Å; N126-E130 PolarHBondContact OD1-N 2.96Å; N126-E130 PolarHBondContact OD1-O 3.35Å; I128-E130 HydrophobicContact CD1-CG 3.99Å; I128-E130 HydrophobicContact CG1-CB 4.4Å; I128-E130 HydrophobicContact CG1-CG 4Å; E130-I132 PolarHBondContact O-N 3.46Å
131	P	95.1	Very high	92.8	Very high	48 Å²	48	53.4 Å²	53.4	31%	0.312	28%	0.278	S	S	.	.	B	Isolated β-bridge	trans	-69.1	132.4	178.4	27.4	-32.1	0	0	0	110.9	I124 G136 I138	I124-P131 VanDerWaalsContact O-CA 3.31Å; I124-P131 WeakPolarHBondContact O-CA 3.39Å; P131-G136 VanDerWaalsContact CG-O 3.31Å; P131-G136 WeakPolarHBondContact CG-O 3.22Å; P131-I138 HydrophobicContact CB-CD1 4.4Å; P131-I138 HydrophobicContact CB-CG1 4.09Å; P131-I138 HydrophobicContact CG-CG1 4.44Å
132	I	92.9	Very high	92.8	Very high	70 Å²	70	58.4 Å²	58.4	36%	0.359	30%	0.295	S	S	.	.			trans	-117.2	13.8	176.8	61.1	172.3	0	0	0	112.3	I124 N126 E130	I124-I132 HydrophobicContact CB-CG1 4.04Å; I124-I132 HydrophobicContact CG2-CD1 3.79Å; I124-I132 HydrophobicContact CG2-CG1 3.53Å; I124-I132 PolarHBondContact O-N 3.03Å; N126-I132 HydrophobicContact CB-CG2 3.92Å; E130-I132 PolarHBondContact O-N 3.46Å
133	D	91.7	Very high	93	Very high	20 Å²	20	64.8 Å²	64.8	11%	0.107	32%	0.32	C	S	.	.	S	Bend	trans	-95.4	3.6	180	58	13.3	0	0	0	114.1	R123 I124 R135	R123-D133 WeakPolarHBondContact CA-OD2 3.33Å; R123-D133 IonicContact CZ-OD1 3.68Å; R123-D133 IonicContact CZ-OD2 3.05Å; R123-D133 IonicContact NE-OD1 2.86Å; R123-D133 IonicContact NE-OD2 3.88Å; R123-D133 PolarHBondContact NE-OD2 3.35Å; R123-D133 IonicContact NH2-OD1 3.72Å; R123-D133 PolarHBondContact NH2-OD1 3.4Å; R123-D133 IonicContact NH2-OD2 2.77Å; R123-D133 PolarHBondContact NH2-OD2 3.36Å; I124-D133 HydrophobicContact CB-CB 3.91Å; I124-D133 HydrophobicContact CD1-CB 4.13Å; I124-D133 HydrophobicContact CG1-CB 3.93Å; I124-D133 PolarHBondContact N-OD2 3.16Å; D133-R135 HydrophobicContact CB-CG 4.41Å; D133-R135 WeakPolarHBondContact O-CG 3.31Å; D133-R135 PolarHBondContact O-N 3.21Å; D133-R135 WeakPolarHBondContact OD1-CB 3.23Å; D133-R135 PolarHBondContact OD1-N 2.88Å
134	E	89.3	Confident	93.1	Very high	197 Å²	197	65.3 Å²	65.3	92%	0.921	33%	0.327	S	S	*	.	S	Bend	trans	58.9	13.9	-176.6	-53.9	-174.4	162.9	0	0	114.6	G136	E134-G136 VanDerWaalsContact C-N 3.29Å; E134-G136 PolarHBondContact O-N 3.43Å
135	R	89.7	Confident	93.2	Very high	91 Å²	91	65.2 Å²	65.2	34%	0.343	33%	0.329	S	S	.	.	S	Bend	trans	-92.6	20.2	-178.3	-66.7	169.7	68.8	-162.6	-1	113.5	G122 D133 L238	G122-R135 PolarHBondContact O-NH1 3Å; D133-R135 HydrophobicContact CB-CG 4.41Å; D133-R135 WeakPolarHBondContact O-CG 3.31Å; D133-R135 PolarHBondContact O-N 3.21Å; D133-R135 WeakPolarHBondContact OD1-CB 3.23Å; D133-R135 PolarHBondContact OD1-N 2.88Å; R135-L238 PolarHBondContact NH2-O 3.28Å; R135-L238 VanDerWaalsContact NH2-O 3.17Å
136	G	91.5	Very high	93.2	Very high	36 Å²	36	65.2 Å²	65.2	37%	0.371	33%	0.329	S	S	.	.			trans	78.2	-169.1	-177.2	0	0	0	0	0	113.4	R123 P131 E134	R123-G136 PolarHBondContact NH2-O 3.48Å; P131-G136 VanDerWaalsContact CG-O 3.31Å; P131-G136 WeakPolarHBondContact CG-O 3.22Å; E134-G136 VanDerWaalsContact C-N 3.29Å; E134-G136 PolarHBondContact O-N 3.43Å
137	P	92.9	Very high	93.2	Very high	103 Å²	103	66.3 Å²	66.3	67%	0.669	33%	0.334	S	S	*	.			trans	-66.7	152.5	-176.1	26.6	-33.8	0	0	0	112.7	R123 K139	R123-P137 PolarHBondContact NH1-O 2.81Å; P137-K139 PolarHBondContact O-N 3.17Å
138	I	92.7	Very high	93.1	Very high	14 Å²	14	70.1 Å²	70.1	7%	0.072	35%	0.351	C	S	.	.			trans	-74.7	119.4	169	-62.9	178.5	0	0	0	107.8	P115 G119 T120 R123 M125 P131 T140	P115-I138 HydrophobicContact CB-CB 4.34Å; P115-I138 HydrophobicContact CB-CG2 3.94Å; P115-I138 HydrophobicContact CG-CB 4.24Å; P115-I138 HydrophobicContact CG-CD1 3.85Å; P115-I138 HydrophobicContact CG-CG2 4.2Å; G119-I138 WeakPolarHBondContact O-CG2 3.25Å; T120-I138 HydrophobicContact CG2-CG2 4.22Å; R123-I138 HydrophobicContact CB-CD1 4.3Å; R123-I138 HydrophobicContact CB-CG1 4.38Å; R123-I138 HydrophobicContact CG-CG1 4.37Å; M125-I138 HydrophobicContact CB-CD1 4.15Å; P131-I138 HydrophobicContact CB-CD1 4.4Å; P131-I138 HydrophobicContact CB-CG1 4.09Å; P131-I138 HydrophobicContact CG-CG1 4.44Å; I138-T140 HydrophobicContact CG2-CG2 4.21Å; I138-T140 PolarHBondContact O-N 3.26Å
139	K	87.6	Confident	92.9	Very high	187 Å²	187	77.9 Å²	77.9	81%	0.813	39%	0.387	S	S	*	.			trans	-81.4	98	180	-66.2	179.9	-177.1	174.1	0	109.4	P137	P137-K139 PolarHBondContact O-N 3.17Å
140	T	90.1	Very high	92.9	Very high	27 Å²	27	79.7 Å²	79.7	17%	0.166	40%	0.401	C	S	.	.			trans	-154.2	148.3	171.3	-174.1	0	0	0	0	110.2	P115 V116 I138 R142 Y143	P115-T140 HydrophobicContact CB-CG2 3.28Å; V116-T140 PolarHBondContact O-OG1 3.37Å; I138-T140 HydrophobicContact CG2-CG2 4.21Å; I138-T140 PolarHBondContact O-N 3.26Å; T140-R142 WeakPolarHBondContact CG2-O 3.25Å; T140-R142 PolarHBondContact OG1-N 3.23Å; T140-R142 VanDerWaalsContact OG1-N 3.09Å; T140-R142 PolarHBondContact OG1-O 3.4Å; T140-Y143 HydrophobicContact CG2-CE2 4.45Å
141	D	87.7	Confident	92.7	Very high	165 Å²	165	77.4 Å²	77.4	88%	0.882	39%	0.392	S	S	*	.	S	Bend	trans	-95.3	-3.9	170.7	-58.2	-40.4	0	0	0	111.6
142	R	93.1	Very high	92.5	Very high	125 Å²	125	77.5 Å²	77.5	47%	0.472	40%	0.396	S	S	.	.			trans	-107.2	125.9	-172.9	-58.8	-170.7	-176.7	-176.4	-2.2	110.3	V116 T140 Y272 E277	V116-R142 HydrophobicContact CG2-CB 3.91Å; V116-R142 PolarHBondContact N-O 3.33Å; T140-R142 WeakPolarHBondContact CG2-O 3.25Å; T140-R142 PolarHBondContact OG1-N 3.23Å; T140-R142 VanDerWaalsContact OG1-N 3.09Å; T140-R142 PolarHBondContact OG1-O 3.4Å; R142-Y272 HydrophobicContact CB-CE2 4.39Å; R142-Y272 VanDerWaalsContact CD-CE2 3.49Å; R142-Y272 PolarHBondContact NH1-OH 3.46Å; R142-E277 IonicContact NH1-OE1 3.92Å
143	Y	95.8	Very high	92.2	Very high	134 Å²	134	82.1 Å²	82.1	53%	0.525	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	139.9	177.5	-70.7	-99.3	0	0	0	109.9	I114 P115 T140	I114-Y143 VanDerWaalsContact C-CD1 3.48Å; I114-Y143 CarbonylContact O-C 3.53Å; I114-Y143 WeakPolarHBondContact O-CA 3.26Å; P115-Y143 HydrophobicContact CB-CD1 4.38Å; P115-Y143 HydrophobicContact CB-CE1 3.98Å; T140-Y143 HydrophobicContact CG2-CE2 4.45Å
144	S	96.7	Very high	92.1	Very high	34 Å²	34	86.2 Å²	86.2	24%	0.238	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	149.2	177.1	-166.2	0	0	0	0	111.1	K113 I114 Q148	K113-S144 CarbonylContact C-O 3.57Å; K113-S144 VanDerWaalsContact CA-O 3.28Å; K113-S144 WeakPolarHBondContact CA-O 3.43Å; I114-S144 PolarHBondContact N-O 3.07Å; I114-S144 PolarHBondContact O-N 3.28Å; S144-Q148 PolarHBondContact OG-NE2 3.1Å
145	A	97.3	Very high	91.8	Very high	15 Å²	15	81.6 Å²	81.6	12%	0.124	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	141.7	175.8	0	0	0	0	0	110.4	P111 I112 K113 H147 Q148 T268	P111-A145 HydrophobicContact CB-CB 4.09Å; P111-A145 HydrophobicContact CG-CB 4.49Å; I112-A145 CarbonylContact O-C 3.57Å; I112-A145 VanDerWaalsContact O-CA 3.29Å; I112-A145 WeakPolarHBondContact O-CA 3.03Å; K113-A145 HydrophobicContact CG-CB 4.45Å; A145-H147 PolarHBondContact O-N 2.85Å; A145-Q148 WeakPolarHBondContact O-CG 3.22Å; A145-Q148 PolarHBondContact O-NE2 3.03Å; A145-T268 WeakPolarHBondContact O-CG2 3.38Å
146	I	96.3	Very high	91.6	Very high	0 Å²	0	79.7 Å²	79.7	0%	0	41%	0.414	C	S	.	.	S	Bend	trans	-68.6	-25.3	179.8	66.6	175.7	0	0	0	113.1	I112 I114 R261 L264 T268 R325	I112-I146 HydrophobicContact CB-CD1 3.91Å; I112-I146 HydrophobicContact CB-CG1 4.12Å; I112-I146 HydrophobicContact CD1-CD1 4Å; I112-I146 HydrophobicContact CG1-CD1 4.45Å; I112-I146 HydrophobicContact CG2-CD1 4.26Å; I112-I146 HydrophobicContact CG2-CG2 4.27Å; I112-I146 PolarHBondContact O-N 3.4Å; I114-I146 HydrophobicContact CD1-CG2 4.29Å; I114-I146 HydrophobicContact CG1-CG2 4.29Å; I114-I146 HydrophobicContact CG2-CG2 3.6Å; I146-R261 HydrophobicContact CD1-CB 4.16Å; I146-R261 HydrophobicContact CD1-CG 4.46Å; I146-L264 HydrophobicContact CB-CB 4.31Å; I146-T268 WeakPolarHBondContact CA-OG1 3.44Å; I146-T268 PolarHBondContact O-OG1 3.09Å; I146-R325 PolarHBondContact O-NH1 2.98Å; I146-R325 PolarHBondContact O-NH2 2.79Å
147	H	95.4	Very high	91	Very high	42 Å²	42	81.8 Å²	81.8	19%	0.194	42%	0.416	C	S	.	.			trans	-92.7	113.4	174.3	-63.2	-67.4	0	0	0	108.8	L63 E78 A145	L63-H147 HydrophobicContact CD1-CB 4.14Å; E78-H147 IonicContact OE1-NE2 2.67Å; E78-H147 IonicContact OE2-CD2 2.64Å; E78-H147 IonicContact OE2-CE1 3.8Å; E78-H147 IonicContact OE2-NE2 3.06Å; E78-H147 PolarHBondContact OE2-NE2 3.38Å; A145-H147 PolarHBondContact O-N 2.85Å
148	Q	93	Very high	90	Very high	83 Å²	83	82.5 Å²	82.5	39%	0.388	42%	0.419	S	S	.	.			trans	-131.2	154.7	177	-62.4	-62.8	-26.9	0	0	109.2	S144 A145 R325	S144-Q148 PolarHBondContact OG-NE2 3.1Å; A145-Q148 WeakPolarHBondContact O-CG 3.22Å; A145-Q148 PolarHBondContact O-NE2 3.03Å; Q148-R325 WeakPolarHBondContact O-CD 3.42Å
149	E	93	Very high	89.2	Confident	179 Å²	179	84.3 Å²	84.3	84%	0.836	44%	0.436	S	S	*	.	P	Polyproline II helix	trans	-76.2	151	169.4	-64.7	-172.3	165.1	0	0	110.4
150	A	93.3	Very high	88.7	Confident	42 Å²	42	81 Å²	81	35%	0.347	42%	0.423	S	S	.	.	P	Polyproline II helix	trans	-65.5	149.3	171.7	0	0	0	0	0	110.6	E324 R325	A150-E324 HydrophobicContact CB-CB 3.98Å; A150-E324 WeakPolarHBondContact CB-O 3.31Å; A150-R325 HydrophobicContact CB-CG 4.17Å
151	P	92.3	Very high	88.4	Confident	13 Å²	13	84.6 Å²	84.6	8%	0.084	44%	0.438	C	S	.	.	P	Polyproline II helix	trans	-53.7	144	175.7	-27.6	36.4	0	0	0	112.2	M156 T327 T329	P151-M156 WeakPolarHBondContact O-CE 3.33Å; P151-T327 HydrophobicContact CB-CG2 4.17Å; P151-T327 HydrophobicContact CG-CG2 3.71Å; P151-T329 HydrophobicContact CB-CG2 3.84Å; P151-T329 HydrophobicContact CG-CG2 3.85Å
152	A	90.4	Very high	88.5	Confident	50 Å²	50	79.2 Å²	79.2	41%	0.413	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-69.4	150.2	178.4	0	0	0	0	0	110.8	V154 E155 M156	A152-V154 HydrophobicContact CB-CG2 4.01Å; A152-V154 PolarHBondContact O-N 3.18Å; A152-E155 HydrophobicContact CB-CG 4.41Å; A152-E155 WeakPolarHBondContact O-CA 3.47Å; A152-E155 WeakPolarHBondContact O-CB 3.36Å; A152-E155 PolarHBondContact O-N 2.98Å; A152-M156 PolarHBondContact O-N 3.46Å
153	F	87	Confident	88.3	Confident	167 Å²	167	74.1 Å²	74.1	73%	0.732	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	-33.2	178.6	-177.6	-103.1	0	0	0	113.5	E155 M156	F153-E155 PolarHBondContact O-N 3.44Å; F153-M156 PolarHBondContact O-N 3.42Å
154	V	88.3	Confident	88	Confident	106 Å²	106	69.6 Å²	69.6	64%	0.642	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-18.1	177.5	-62.7	0	0	0	0	113.9	A152 K330	A152-V154 HydrophobicContact CB-CG2 4.01Å; A152-V154 PolarHBondContact O-N 3.18Å; V154-K330 WeakPolarHBondContact O-CE 3.25Å; V154-K330 PolarHBondContact O-NZ 2.92Å
155	E	84.4	Confident	87.7	Confident	101 Å²	101	68 Å²	68	47%	0.472	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-18.3	177.1	-59.3	-174.4	152.7	0	0	112.1	A152 F153 T329 K330	A152-E155 HydrophobicContact CB-CG 4.41Å; A152-E155 WeakPolarHBondContact O-CA 3.47Å; A152-E155 WeakPolarHBondContact O-CB 3.36Å; A152-E155 PolarHBondContact O-N 2.98Å; F153-E155 PolarHBondContact O-N 3.44Å; E155-T329 CarbonylContact O-C 3.57Å; E155-T329 WeakPolarHBondContact O-CA 3.45Å; E155-K330 WeakPolarHBondContact O-CG 3.28Å; E155-K330 PolarHBondContact O-N 2.9Å
156	M	85.3	Confident	87.4	Confident	50 Å²	50	67.3 Å²	67.3	25%	0.246	36%	0.36	C	S	.	.	B	Isolated β-bridge	trans	-70.2	141.3	-179.7	-63.1	-174.1	-171.4	0	0	111.3	P151 A152 F153 T327 T328	P151-M156 WeakPolarHBondContact O-CE 3.33Å; A152-M156 PolarHBondContact O-N 3.46Å; F153-M156 PolarHBondContact O-N 3.42Å; M156-T327 HydrophobicContact CE-CG2 4.37Å; M156-T328 WeakPolarHBondContact CA-O 3.13Å
157	N	78.9	Confident	87.3	Confident	80 Å²	80	67.3 Å²	67.3	43%	0.428	36%	0.36	S	S	.	.			trans	-100.1	132.5	169.8	-170.6	-1	0	0	0	109.3	A159 T328	N157-A159 WeakPolarHBondContact OD1-CB 3.38Å; N157-A159 PolarHBondContact OD1-N 3.3Å; N157-T328 HydrophobicContact CB-CG2 3.79Å; N157-T328 PolarHBondContact N-O 3.06Å; N157-T328 VanDerWaalsContact N-O 3.17Å
158	V	72.5	Confident	87.3	Confident	119 Å²	119	65.3 Å²	65.3	72%	0.721	35%	0.351	S	S	*	.			trans	-93.7	-7.1	-178.2	-157.1	0	0	0	0	111.8	Q160	V158-Q160 PolarHBondContact O-N 3.25Å
159	A	74.5	Confident	87.4	Confident	51 Å²	51	61.5 Å²	61.5	42%	0.421	33%	0.333	S	S	.	.			trans	-63.5	121.5	179.5	0	0	0	0	0	110.8	N157	N157-A159 WeakPolarHBondContact OD1-CB 3.38Å; N157-A159 PolarHBondContact OD1-N 3.3Å
160	Q	76.6	Confident	87.4	Confident	117 Å²	117	53 Å²	53	55%	0.547	29%	0.294	S	S	.	.			trans	-92.7	105.4	176	-64.7	-174.6	2	0	0	108.9	V158	V158-Q160 PolarHBondContact O-N 3.25Å
161	E	84.6	Confident	87.5	Confident	103 Å²	103	51.1 Å²	51.1	48%	0.481	28%	0.278	S	S	.	.			trans	-106.9	140.8	174	-67.3	178.8	177.6	0	0	109.6	K178	E161-K178 HydrophobicContact CB-CB 4.15Å; E161-K178 HydrophobicContact CB-CD 4.3Å; E161-K178 PolarHBondContact O-N 2.83Å; E161-K178 WeakPolarHBondContact OE2-CD 3.46Å; E161-K178 IonicContact OE2-NZ 3.66Å
162	I	89	Confident	87.7	Confident	52 Å²	52	50.5 Å²	50.5	27%	0.267	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	127.3	176.2	-56.6	172.3	0	0	0	108.6	P175 I387 V393	I162-P175 HydrophobicContact CG2-CB 4.22Å; I162-I387 HydrophobicContact CG1-CD1 4.04Å; I162-V393 HydrophobicContact CD1-CB 4.33Å; I162-V393 HydrophobicContact CD1-CG1 3.79Å
163	L	89	Confident	87.9	Confident	19 Å²	19	48.2 Å²	48.2	10%	0.099	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	102.6	167.3	-179.8	67.2	0	0	0	108.7	T165 Y176 L282 T335	L163-T165 PolarHBondContact O-N 3.31Å; L163-Y176 PolarHBondContact N-O 2.91Å; L163-L282 HydrophobicContact CD2-CD2 3.8Å; L163-T335 HydrophobicContact CD2-CG2 3.87Å
164	T	90	Very high	88.2	Confident	39 Å²	39	40.3 Å²	40.3	24%	0.239	22%	0.22	C	C	.	.			trans	-71.6	119.8	175.6	-50.9	0	0	0	0	110.2	D171 L464	T164-D171 WeakPolarHBondContact CG2-OD2 3.38Å; T164-L464 HydrophobicContact CG2-CB 4.23Å
165	T	90.8	Very high	88.5	Confident	1 Å²	1	35.3 Å²	35.3	1%	0.006	19%	0.19	C	C	.	.			trans	-90	-19	-178.4	65	0	0	0	0	112.8	L163 I167 V170 D171 Y176 L199 N202	L163-T165 PolarHBondContact O-N 3.31Å; T165-I167 PolarHBondContact O-N 2.9Å; T165-I167 PolarHBondContact OG1-N 3.41Å; T165-V170 HydrophobicContact CG2-CG1 3.93Å; T165-D171 WeakPolarHBondContact CB-OD1 3.42Å; T165-D171 PolarHBondContact N-OD1 3.07Å; T165-D171 PolarHBondContact N-OD2 2.93Å; T165-D171 VanDerWaalsContact OG1-CG 3.29Å; T165-D171 PolarHBondContact OG1-OD1 3.03Å; T165-Y176 HydrophobicContact CG2-CD2 3.51Å; T165-Y176 HydrophobicContact CG2-CE2 3.87Å; T165-Y176 HydrophobicContact CG2-CG 4.29Å; T165-L199 HydrophobicContact CG2-CD2 3.56Å; T165-N202 WeakPolarHBondContact O-CB 3.37Å; T165-N202 PolarHBondContact O-ND2 3.16Å; T165-N202 VanDerWaalsContact O-ND2 3.1Å
166	G	91	Very high	89	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.167	C	C	.	.	S	Bend	trans	77	6.5	-171.2	0	0	0	0	0	113.3	D171 Q446 F461 V462	G166-D171 WeakPolarHBondContact CA-OD2 3.44Å; G166-D171 PolarHBondContact N-OD2 3.02Å; G166-Q446 PolarHBondContact O-NE2 3.18Å; G166-Q446 PolarHBondContact O-OE1 3.14Å; G166-F461 VanDerWaalsContact CA-CE2 3.46Å; G166-V462 WeakPolarHBondContact CA-O 3.49Å; G166-V462 PolarHBondContact O-N 2.92Å; G166-V462 VanDerWaalsContact O-N 3.08Å
167	I	94.1	Very high	89.2	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.161	C	C	.	.			trans	-103.8	112.7	-179.6	-57.5	177.6	0	0	0	108.4	T165 V169 V170 D171 L195 E198 L199 P376 F448	T165-I167 PolarHBondContact O-N 2.9Å; T165-I167 PolarHBondContact OG1-N 3.41Å; I167-V169 HydrophobicContact CG2-CG1 3.94Å; I167-V169 PolarHBondContact O-N 3.2Å; I167-V170 HydrophobicContact CB-CB 4.21Å; I167-V170 HydrophobicContact CB-CG2 4.24Å; I167-V170 HydrophobicContact CG2-CB 4.33Å; I167-V170 HydrophobicContact CG2-CG2 3.97Å; I167-V170 PolarHBondContact O-N 3.41Å; I167-V170 VanDerWaalsContact O-N 3.08Å; I167-D171 PolarHBondContact N-OD2 3Å; I167-D171 WeakPolarHBondContact O-CB 3.42Å; I167-D171 PolarHBondContact O-N 3.01Å; I167-L195 HydrophobicContact CD1-CD1 3.56Å; I167-E198 HydrophobicContact CD1-CG 4.17Å; I167-L199 HydrophobicContact CD1-CD2 3.81Å; I167-L199 HydrophobicContact CD1-CG 4.2Å; I167-P376 HydrophobicContact CG2-CG 4.13Å; I167-F448 HydrophobicContact CD1-CE1 4.2Å; I167-F448 HydrophobicContact CD1-CZ 3.92Å; I167-F448 HydrophobicContact CG1-CE1 4.19Å; I167-F448 HydrophobicContact CG1-CZ 4.39Å; I167-F448 HydrophobicContact CG2-CE1 4.14Å; I167-F448 HydrophobicContact CG2-CZ 4.16Å
168	K	95.2	Very high	89.7	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-49.6	-50.3	-171.7	-74	-174.2	-72	-173.3	0	114	V170 L172 F443 S445 V462 T467 F471 V490 G491	K168-V170 VanDerWaalsContact C-N 3.35Å; K168-V170 PolarHBondContact O-N 2.88Å; K168-L172 WeakPolarHBondContact O-CB 3.38Å; K168-L172 PolarHBondContact O-N 3.13Å; K168-F443 HydrophobicContact CD-CE1 4.35Å; K168-F443 HydrophobicContact CD-CZ 4.25Å; K168-F443 WeakPolarHBondContact CE-O 3.31Å; K168-F443 PolarHBondContact NZ-O 3.07Å; K168-S445 PolarHBondContact NZ-O 3.02Å; K168-V462 HydrophobicContact CD-CB 4.48Å; K168-V462 HydrophobicContact CD-CG1 4.24Å; K168-V462 HydrophobicContact CD-CG2 4.28Å; K168-V462 HydrophobicContact CG-CB 3.92Å; K168-V462 HydrophobicContact CG-CG1 3.97Å; K168-V462 HydrophobicContact CG-CG2 4.1Å; K168-T467 HydrophobicContact CB-CG2 3.89Å; K168-T467 HydrophobicContact CG-CG2 3.89Å; K168-F471 HydrophobicContact CB-CE2 4.43Å; K168-V490 PolarHBondContact NZ-O 3.45Å; K168-G491 WeakPolarHBondContact CD-O 3.34Å; K168-G491 WeakPolarHBondContact CE-O 3.5Å; K168-G491 PolarHBondContact NZ-O 2.81Å
169	V	94.6	Very high	90.4	Very high	2 Å²	2	22.5 Å²	22.5	1%	0.012	12%	0.123	C	C	.	.	H	α-helix	trans	-66	-38.2	-176.5	61.3	0	0	0	0	112.3	I167 L173 P376 V378 L444	I167-V169 HydrophobicContact CG2-CG1 3.94Å; I167-V169 PolarHBondContact O-N 3.2Å; V169-L173 HydrophobicContact CG2-CD1 4.23Å; V169-L173 WeakPolarHBondContact O-CB 3.41Å; V169-L173 PolarHBondContact O-N 3.23Å; V169-L173 VanDerWaalsContact O-N 3.1Å; V169-P376 HydrophobicContact CG1-CG 3.69Å; V169-V378 HydrophobicContact CB-CB 4.45Å; V169-V378 HydrophobicContact CG1-CB 3.83Å; V169-V378 HydrophobicContact CG1-CG1 4.29Å; V169-V378 HydrophobicContact CG1-CG2 3.87Å; V169-V378 HydrophobicContact CG2-CB 3.74Å; V169-V378 HydrophobicContact CG2-CG1 3.61Å; V169-L444 HydrophobicContact CB-CB 4.5Å; V169-L444 HydrophobicContact CB-CD2 3.82Å; V169-L444 HydrophobicContact CG2-CD2 3.94Å
170	V	94.7	Very high	91.1	Very high	1 Å²	1	20.2 Å²	20.2	1%	0.006	10%	0.104	C	C	.	.	H	α-helix	trans	-70.7	-56.2	178.3	174.1	0	0	0	0	109.3	T165 I167 K168 L172 L173 A174 P175 Y176	T165-V170 HydrophobicContact CG2-CG1 3.93Å; I167-V170 HydrophobicContact CB-CB 4.21Å; I167-V170 HydrophobicContact CB-CG2 4.24Å; I167-V170 HydrophobicContact CG2-CB 4.33Å; I167-V170 HydrophobicContact CG2-CG2 3.97Å; I167-V170 PolarHBondContact O-N 3.41Å; I167-V170 VanDerWaalsContact O-N 3.08Å; K168-V170 VanDerWaalsContact C-N 3.35Å; K168-V170 PolarHBondContact O-N 2.88Å; V170-L172 VanDerWaalsContact C-N 3.28Å; V170-L172 PolarHBondContact O-N 3.36Å; V170-L173 PolarHBondContact O-N 3.05Å; V170-A174 CarbonylContact O-C 3.49Å; V170-A174 WeakPolarHBondContact O-CA 3.48Å; V170-A174 PolarHBondContact O-N 3.17Å; V170-P175 WeakPolarHBondContact O-CA 3.12Å; V170-Y176 HydrophobicContact CG1-CD1 3.86Å; V170-Y176 HydrophobicContact CG1-CD2 4.07Å; V170-Y176 HydrophobicContact CG1-CE1 3.47Å; V170-Y176 VanDerWaalsContact CG1-CE1 3.47Å; V170-Y176 HydrophobicContact CG1-CE2 3.7Å; V170-Y176 HydrophobicContact CG1-CG 4.14Å
171	D	94.8	Very high	92	Very high	2 Å²	2	15.6 Å²	15.6	1%	0.011	8%	0.082	C	C	.	.	H	α-helix	trans	-62.2	-35.7	-175.5	-72.2	-10	0	0	0	112.1	T164 T165 G166 I167 H397 L464	T164-D171 WeakPolarHBondContact CG2-OD2 3.38Å; T165-D171 WeakPolarHBondContact CB-OD1 3.42Å; T165-D171 PolarHBondContact N-OD1 3.07Å; T165-D171 PolarHBondContact N-OD2 2.93Å; T165-D171 VanDerWaalsContact OG1-CG 3.29Å; T165-D171 PolarHBondContact OG1-OD1 3.03Å; G166-D171 WeakPolarHBondContact CA-OD2 3.44Å; G166-D171 PolarHBondContact N-OD2 3.02Å; I167-D171 PolarHBondContact N-OD2 3Å; I167-D171 WeakPolarHBondContact O-CB 3.42Å; I167-D171 PolarHBondContact O-N 3.01Å; D171-H397 PolarHBondContact O-CE1 3.01Å; D171-H397 PolarHBondContact O-NE2 3.14Å; D171-L464 HydrophobicContact CB-CD1 4.04Å
172	L	95.7	Very high	92.5	Very high	0 Å²	0	10.7 Å²	10.7	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-76.8	-49.9	177.9	-174.2	74.1	0	0	0	113	K168 V170 M388 H397 I400 A401 V404 T467 I468 F471	K168-L172 WeakPolarHBondContact O-CB 3.38Å; K168-L172 PolarHBondContact O-N 3.13Å; V170-L172 VanDerWaalsContact C-N 3.28Å; V170-L172 PolarHBondContact O-N 3.36Å; L172-M388 WeakPolarHBondContact O-CE 2.98Å; L172-H397 PolarHBondContact O-NE2 2.84Å; L172-I400 HydrophobicContact CD1-CG2 4.27Å; L172-A401 HydrophobicContact CD1-CB 4.45Å; L172-A401 HydrophobicContact CG-CB 4.34Å; L172-A401 WeakPolarHBondContact O-CB 3.29Å; L172-V404 HydrophobicContact CD2-CB 4.49Å; L172-V404 HydrophobicContact CD2-CG1 4.44Å; L172-V404 HydrophobicContact CD2-CG2 4.16Å; L172-T467 HydrophobicContact CB-CG2 4Å; L172-I468 HydrophobicContact CD1-CG1 4.34Å; L172-F471 HydrophobicContact CD1-CD2 4.42Å; L172-F471 HydrophobicContact CD2-CB 4.25Å; L172-F471 HydrophobicContact CD2-CD1 4.08Å; L172-F471 HydrophobicContact CD2-CD2 3.42Å; L172-F471 VanDerWaalsContact CD2-CD2 3.42Å; L172-F471 HydrophobicContact CD2-CE1 4.31Å; L172-F471 HydrophobicContact CD2-CE2 3.7Å; L172-F471 HydrophobicContact CD2-CG 3.64Å; L172-F471 HydrophobicContact CD2-CZ 4.15Å; L172-F471 HydrophobicContact CG-CD2 4.42Å
173	L	94.8	Very high	92.7	Very high	3 Å²	3	8.2 Å²	8.2	2%	0.016	5%	0.047	C	C	.	.	H	α-helix	trans	-105.3	-32.1	-163.7	-58.6	-179.8	0	0	0	114	V169 V170 P380 M388 A401 V404 Q405 L444	V169-L173 HydrophobicContact CG2-CD1 4.23Å; V169-L173 WeakPolarHBondContact O-CB 3.41Å; V169-L173 PolarHBondContact O-N 3.23Å; V169-L173 VanDerWaalsContact O-N 3.1Å; V170-L173 PolarHBondContact O-N 3.05Å; L173-P380 HydrophobicContact CD1-CB 3.23Å; L173-M388 WeakPolarHBondContact O-CE 3.37Å; L173-A401 HydrophobicContact CD2-CB 4.13Å; L173-V404 HydrophobicContact CD2-CB 4.45Å; L173-V404 HydrophobicContact CD2-CG1 4.13Å; L173-Q405 HydrophobicContact CD2-CG 4.07Å; L173-L444 HydrophobicContact CD1-CD2 4.29Å
174	A	93.8	Very high	92.9	Very high	1 Å²	1	7.3 Å²	7.3	1%	0.008	4%	0.042	C	C	.	.	S	Bend	trans	-135.7	60.1	-179.6	0	0	0	0	0	110.5	V170 Y176	V170-A174 CarbonylContact O-C 3.49Å; V170-A174 WeakPolarHBondContact O-CA 3.48Å; V170-A174 PolarHBondContact O-N 3.17Å; A174-Y176 WeakPolarHBondContact O-CD1 3.33Å; A174-Y176 VanDerWaalsContact O-CE1 3.32Å; A174-Y176 WeakPolarHBondContact O-CE1 3.28Å
175	P	94.8	Very high	92.8	Very high	0 Å²	0	5.9 Å²	5.9	0%	0	3%	0.033	C	C	.	.	P	Polyproline II helix	trans	-61.4	143	-174.7	24	-32.1	0	0	0	110.2	I162 V170 S385 I387 M388 V393	I162-P175 HydrophobicContact CG2-CB 4.22Å; V170-P175 WeakPolarHBondContact O-CA 3.12Å; P175-S385 WeakPolarHBondContact O-CB 3.14Å; P175-S385 PolarHBondContact O-OG 3.24Å; P175-I387 HydrophobicContact CB-CD1 3.88Å; P175-I387 HydrophobicContact CB-CG1 4.47Å; P175-I387 HydrophobicContact CG-CD1 3.95Å; P175-I387 HydrophobicContact CG-CG1 4.06Å; P175-I387 WeakPolarHBondContact O-CD1 3.21Å; P175-I387 WeakPolarHBondContact O-CG1 3.26Å; P175-M388 HydrophobicContact CG-CE 3.74Å; P175-V393 HydrophobicContact CG-CG1 4.03Å
176	Y	93.4	Very high	92.3	Very high	2 Å²	2	6.6 Å²	6.6	1%	0.008	4%	0.04	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	139.6	-177.9	-63.9	-12.1	0	0	0	110.7	L163 T165 V170 A174 I182 L199 A361 T363	L163-Y176 PolarHBondContact N-O 2.91Å; T165-Y176 HydrophobicContact CG2-CD2 3.51Å; T165-Y176 HydrophobicContact CG2-CE2 3.87Å; T165-Y176 HydrophobicContact CG2-CG 4.29Å; V170-Y176 HydrophobicContact CG1-CD1 3.86Å; V170-Y176 HydrophobicContact CG1-CD2 4.07Å; V170-Y176 HydrophobicContact CG1-CE1 3.47Å; V170-Y176 VanDerWaalsContact CG1-CE1 3.47Å; V170-Y176 HydrophobicContact CG1-CE2 3.7Å; V170-Y176 HydrophobicContact CG1-CG 4.14Å; A174-Y176 WeakPolarHBondContact O-CD1 3.33Å; A174-Y176 VanDerWaalsContact O-CE1 3.32Å; A174-Y176 WeakPolarHBondContact O-CE1 3.28Å; Y176-I182 HydrophobicContact CD1-CD1 4.46Å; Y176-I182 HydrophobicContact CD1-CG1 3.58Å; Y176-I182 HydrophobicContact CD1-CG2 4.14Å; Y176-I182 HydrophobicContact CD2-CD1 4.22Å; Y176-I182 HydrophobicContact CD2-CG1 3.97Å; Y176-I182 HydrophobicContact CE1-CB 4.35Å; Y176-I182 HydrophobicContact CE1-CG1 3.85Å; Y176-I182 HydrophobicContact CE1-CG2 3.51Å; Y176-I182 HydrophobicContact CE2-CG1 4.21Å; Y176-I182 HydrophobicContact CE2-CG2 4.21Å; Y176-I182 HydrophobicContact CG-CD1 4.06Å; Y176-I182 HydrophobicContact CG-CG1 3.65Å; Y176-L199 HydrophobicContact CE2-CD1 4.11Å; Y176-L199 HydrophobicContact CE2-CD2 4.2Å; Y176-A361 HydrophobicContact CD1-CB 4.22Å; Y176-T363 PolarHBondContact OH-OG1 2.79Å; Y176-T363 VanDerWaalsContact OH-OG1 3.09Å
177	A	90.6	Very high	91.6	Very high	13 Å²	13	7.9 Å²	7.9	11%	0.107	5%	0.053	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	140.6	172.1	0	0	0	0	0	109.8	G179 G180 I387	A177-G179 PolarHBondContact O-N 3.33Å; A177-G180 WeakPolarHBondContact O-CA 3.41Å; A177-G180 PolarHBondContact O-N 2.85Å; A177-I387 HydrophobicContact CB-CD1 4.32Å; A177-I387 HydrophobicContact CB-CG2 3.9Å
178	K	88.3	Confident	90.8	Very high	57 Å²	57	12.1 Å²	12.1	25%	0.248	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	124.9	172.1	-171.2	179.1	-177.5	179.3	0	110.6	E161 G180 D280 T328 S333	E161-K178 HydrophobicContact CB-CB 4.15Å; E161-K178 HydrophobicContact CB-CD 4.3Å; E161-K178 PolarHBondContact O-N 2.83Å; E161-K178 WeakPolarHBondContact OE2-CD 3.46Å; E161-K178 IonicContact OE2-NZ 3.66Å; K178-G180 PolarHBondContact O-N 3.06Å; K178-D280 WeakPolarHBondContact CE-OD1 3.46Å; K178-D280 WeakPolarHBondContact CE-OD2 3.14Å; K178-D280 VanDerWaalsContact NZ-CG 3.32Å; K178-D280 IonicContact NZ-OD1 3.69Å; K178-D280 PolarHBondContact NZ-OD1 2.92Å; K178-D280 IonicContact NZ-OD2 2.8Å; K178-D280 PolarHBondContact NZ-OD2 3.35Å; K178-T328 PolarHBondContact O-OG1 3.26Å; K178-S333 WeakPolarHBondContact CE-OG 3.44Å; K178-S333 WeakPolarHBondContact CG-OG 3.33Å
179	G	87.7	Confident	90	Very high	10 Å²	10	15.8 Å²	15.8	10%	0.103	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.5	7.3	-170.1	0	0	0	0	0	115	A177 T328 I334 T335	A177-G179 PolarHBondContact O-N 3.33Å; G179-T328 VanDerWaalsContact CA-OG1 3.26Å; G179-T328 WeakPolarHBondContact CA-OG1 3.41Å; G179-I334 CarbonylContact C-O 3.59Å; G179-I334 WeakPolarHBondContact CA-O 3.15Å; G179-T335 PolarHBondContact N-OG1 3Å
180	G	90.6	Very high	89.5	Confident	3 Å²	3	15.9 Å²	15.9	3%	0.031	13%	0.127	C	C	.	.			trans	-75.9	163.9	178.4	0	0	0	0	0	112.9	A177 K178 S336 D360	A177-G180 WeakPolarHBondContact O-CA 3.41Å; A177-G180 PolarHBondContact O-N 2.85Å; K178-G180 PolarHBondContact O-N 3.06Å; G180-S336 PolarHBondContact O-N 3.25Å; G180-D360 VanDerWaalsContact CA-OD2 3.25Å; G180-D360 WeakPolarHBondContact CA-OD2 3.44Å
181	K	94.7	Very high	89.1	Confident	19 Å²	19	17 Å²	17	8%	0.083	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	109.5	175.2	-63.9	153.6	-174.6	171.8	0	109.9	Q323 E324 I326 S336 H358 L359 D360 A361	K181-Q323 WeakPolarHBondContact CE-O 3.37Å; K181-Q323 PolarHBondContact NZ-O 2.67Å; K181-E324 IonicContact NZ-OE1 3.41Å; K181-I326 WeakPolarHBondContact CE-O 3.13Å; K181-I326 HydrophobicContact CG-CB 4.43Å; K181-I326 HydrophobicContact CG-CG2 3.93Å; K181-S336 WeakPolarHBondContact CA-OG 3.35Å; K181-H358 HydrophobicContact CD-CB 4.25Å; K181-H358 WeakPolarHBondContact CD-O 3.2Å; K181-L359 HydrophobicContact CB-CD2 4.17Å; K181-L359 CarbonylContact O-C 3.59Å; K181-L359 WeakPolarHBondContact O-CA 3.43Å; K181-D360 PolarHBondContact N-OD2 2.79Å; K181-D360 PolarHBondContact O-N 2.89Å; K181-A361 PolarHBondContact O-N 3.15Å
182	I	94.7	Very high	88.6	Confident	1 Å²	1	18.3 Å²	18.3	1%	0.005	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	127.5	-178.9	-58.2	87.6	0	0	0	109.4	Y176 L184 T335 S336 V337 Q338 A361	Y176-I182 HydrophobicContact CD1-CD1 4.46Å; Y176-I182 HydrophobicContact CD1-CG1 3.58Å; Y176-I182 HydrophobicContact CD1-CG2 4.14Å; Y176-I182 HydrophobicContact CD2-CD1 4.22Å; Y176-I182 HydrophobicContact CD2-CG1 3.97Å; Y176-I182 HydrophobicContact CE1-CB 4.35Å; Y176-I182 HydrophobicContact CE1-CG1 3.85Å; Y176-I182 HydrophobicContact CE1-CG2 3.51Å; Y176-I182 HydrophobicContact CE2-CG1 4.21Å; Y176-I182 HydrophobicContact CE2-CG2 4.21Å; Y176-I182 HydrophobicContact CG-CD1 4.06Å; Y176-I182 HydrophobicContact CG-CG1 3.65Å; I182-L184 HydrophobicContact CG2-CD2 4.26Å; I182-T335 HydrophobicContact CD1-CG2 3.59Å; I182-S336 WeakPolarHBondContact CB-O 3.38Å; I182-S336 WeakPolarHBondContact CD1-O 3.45Å; I182-S336 PolarHBondContact N-O 3.4Å; I182-V337 HydrophobicContact CB-CG2 4.35Å; I182-V337 HydrophobicContact CD1-CG2 4.35Å; I182-Q338 PolarHBondContact O-N 3.32Å; I182-A361 WeakPolarHBondContact CA-O 3.49Å; I182-A361 HydrophobicContact CG1-CB 4.3Å
183	G	93.9	Very high	87.9	Confident	0 Å²	0	20.7 Å²	20.7	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	120.3	169.5	0	0	0	0	0	111.9	F185 Q338 A361 T363	G183-F185 WeakPolarHBondContact O-CD2 3.32Å; G183-Q338 CarbonylContact C-O 3.58Å; G183-Q338 WeakPolarHBondContact CA-O 3.11Å; G183-A361 PolarHBondContact N-O 2.92Å; G183-T363 PolarHBondContact O-N 3.15Å
184	L	91.7	Very high	87.4	Confident	0 Å²	0	22.6 Å²	22.6	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	106.2	168.8	-61.1	-173.1	0	0	0	109.9	I182 L195 I196 V337 Q338 A339 I340 T363	I182-L184 HydrophobicContact CG2-CD2 4.26Å; L184-L195 HydrophobicContact CD1-CD2 4.24Å; L184-L195 HydrophobicContact CD2-CD2 3.95Å; L184-I196 HydrophobicContact CD1-CD1 4.05Å; L184-I196 HydrophobicContact CD1-CG1 3.58Å; L184-V337 HydrophobicContact CD1-CG1 3.38Å; L184-V337 HydrophobicContact CD2-CG1 4.12Å; L184-V337 HydrophobicContact CG-CG1 3.52Å; L184-Q338 PolarHBondContact N-O 3.39Å; L184-A339 WeakPolarHBondContact O-CA 3.5Å; L184-I340 PolarHBondContact O-N 3.26Å; L184-T363 WeakPolarHBondContact CA-O 3.33Å; L184-T363 HydrophobicContact CD2-CG2 4.06Å
185	F	88.1	Confident	87.2	Confident	9 Å²	9	22.6 Å²	22.6	4%	0.039	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	146.1	177.8	-65.2	-94.1	0	0	0	109.8	G183 I340 V342 F356 L359 T362 T363 V364 L365	G183-F185 WeakPolarHBondContact O-CD2 3.32Å; F185-I340 HydrophobicContact CD1-CB 3.91Å; F185-I340 HydrophobicContact CD1-CG2 3.91Å; F185-I340 HydrophobicContact CE1-CB 3.67Å; F185-I340 HydrophobicContact CE1-CD1 3.8Å; F185-I340 HydrophobicContact CE1-CG1 4.33Å; F185-I340 HydrophobicContact CE1-CG2 3.42Å; F185-I340 VanDerWaalsContact CE1-CG2 3.42Å; F185-I340 HydrophobicContact CE2-CD1 3.7Å; F185-I340 HydrophobicContact CZ-CB 4.08Å; F185-I340 HydrophobicContact CZ-CD1 3.27Å; F185-I340 HydrophobicContact CZ-CG1 4.25Å; F185-I340 HydrophobicContact CZ-CG2 4.11Å; F185-V342 HydrophobicContact CD1-CG2 3.57Å; F185-V342 HydrophobicContact CE1-CG2 4.02Å; F185-F356 HydrophobicContact CD1-CZ 4.21Å; F185-F356 AromaticContact CE1-CE1 3.97Å; F185-F356 HydrophobicContact CE1-CE1 3.97Å; F185-F356 AromaticContact CE1-CE2 3.7Å; F185-F356 HydrophobicContact CE1-CE2 3.7Å; F185-F356 AromaticContact CE1-CZ 3.29Å; F185-F356 HydrophobicContact CE1-CZ 3.29Å; F185-F356 AromaticContact CE2-CE1 3.74Å; F185-F356 HydrophobicContact CE2-CE1 3.74Å; F185-F356 AromaticContact CE2-CZ 3.91Å; F185-F356 HydrophobicContact CE2-CZ 3.91Å; F185-F356 HydrophobicContact CZ-CD1 4.01Å; F185-F356 HydrophobicContact CZ-CD2 4.45Å; F185-F356 AromaticContact CZ-CE1 3.26Å; F185-F356 HydrophobicContact CZ-CE1 3.26Å; F185-F356 AromaticContact CZ-CE2 3.76Å; F185-F356 HydrophobicContact CZ-CE2 3.76Å; F185-F356 AromaticContact CZ-CZ 3.11Å; F185-F356 HydrophobicContact CZ-CZ 3.11Å; F185-L359 HydrophobicContact CE2-CD1 3.92Å; F185-L359 HydrophobicContact CZ-CD1 3.89Å; F185-T362 HydrophobicContact CE2-CG2 3.99Å; F185-T363 PolarHBondContact N-O 2.9Å; F185-V364 HydrophobicContact CB-CB 4.49Å; F185-V364 HydrophobicContact CB-CG1 4.47Å; F185-V364 HydrophobicContact CB-CG2 4.15Å; F185-L365 WeakPolarHBondContact O-CB 3.35Å; F185-L365 PolarHBondContact O-N 3.16Å
186	G	81.6	Confident	86.9	Confident	16 Å²	16	22.6 Å²	22.6	17%	0.165	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	157.2	150.3	173.9	0	0	0	0	0	113.2	K192 L365	G186-K192 WeakPolarHBondContact O-CE 3.37Å; G186-K192 PolarHBondContact O-NZ 2.95Å; G186-L365 WeakPolarHBondContact CA-O 3.39Å
187	G	76.2	Confident	86.4	Confident	26 Å²	26	23 Å²	23	27%	0.268	17%	0.172	S	C	.	.			trans	-68.5	-173.4	176.5	0	0	0	0	0	113.5	V190	G187-V190 WeakPolarHBondContact O-CG2 3.32Å
188	A	76.2	Confident	86.3	Confident	90 Å²	90	22.4 Å²	22.4	74%	0.744	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68	142.4	172.2	0	0	0	0	0	111	V190	A188-V190 VanDerWaalsContact C-N 3.34Å; A188-V190 PolarHBondContact O-N 3.14Å
189	G	79.1	Confident	86.4	Confident	77 Å²	77	19.9 Å²	19.9	79%	0.794	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	79.6	0.2	171.4	0	0	0	0	0	116.7	G191	G189-G191 VanDerWaalsContact C-N 3.25Å; G189-G191 PolarHBondContact O-N 3.06Å
190	V	84.5	Confident	86.2	Confident	4 Å²	4	19.5 Å²	19.5	2%	0.024	15%	0.152	C	C	.	.	S	Bend	trans	-81.5	4.3	-179.4	-57.8	0	0	0	0	114.6	G187 A188 K192 L365 R367	G187-V190 WeakPolarHBondContact O-CG2 3.32Å; A188-V190 VanDerWaalsContact C-N 3.34Å; A188-V190 PolarHBondContact O-N 3.14Å; V190-K192 HydrophobicContact CG2-CG 4.26Å; V190-L365 HydrophobicContact CB-CB 3.96Å; V190-L365 HydrophobicContact CG2-CB 3.42Å; V190-L365 VanDerWaalsContact CG2-CB 3.42Å; V190-L365 HydrophobicContact CG2-CD1 4.14Å; V190-L365 HydrophobicContact CG2-CG 4.4Å; V190-R367 HydrophobicContact CG1-CB 4.38Å
191	G	85.8	Confident	85.9	Confident	24 Å²	24	19.6 Å²	19.6	25%	0.247	15%	0.151	C	C	.	.	S	Bend	trans	88.7	23.5	176.5	0	0	0	0	0	116.2	G189 T193 V194 L195	G189-G191 VanDerWaalsContact C-N 3.25Å; G189-G191 PolarHBondContact O-N 3.06Å; G191-T193 PolarHBondContact O-N 2.85Å; G191-V194 PolarHBondContact O-N 3.1Å; G191-L195 PolarHBondContact O-N 3.48Å
192	K	84.6	Confident	85.3	Confident	29 Å²	29	19 Å²	19	13%	0.126	15%	0.149	C	C	.	.	H	α-helix	trans	-52.3	-53.7	175.4	-80.6	-174.6	-56.7	-170.9	0	112.9	G186 V190 V194 L195 I196 A339 L365	G186-K192 WeakPolarHBondContact O-CE 3.37Å; G186-K192 PolarHBondContact O-NZ 2.95Å; V190-K192 HydrophobicContact CG2-CG 4.26Å; K192-V194 VanDerWaalsContact C-N 3.31Å; K192-V194 PolarHBondContact O-N 2.67Å; K192-L195 PolarHBondContact O-N 3.22Å; K192-I196 WeakPolarHBondContact O-CG1 3.43Å; K192-I196 PolarHBondContact O-N 2.91Å; K192-A339 HydrophobicContact CD-CB 4.44Å; K192-L365 HydrophobicContact CB-CD1 4.18Å; K192-L365 HydrophobicContact CG-CD1 3.41Å; K192-L365 VanDerWaalsContact CG-CD1 3.41Å
193	T	79.8	Confident	84.4	Confident	50 Å²	50	19.3 Å²	19.3	31%	0.307	15%	0.151	S	C	.	.	H	α-helix	trans	-60.5	-43.4	-179.6	-45.4	0	0	0	0	111	G191 L195 I196 M197 L226	G191-T193 PolarHBondContact O-N 2.85Å; T193-L195 VanDerWaalsContact C-N 3.34Å; T193-L195 PolarHBondContact O-N 3Å; T193-I196 PolarHBondContact O-N 3.37Å; T193-M197 HydrophobicContact CG2-CE 4.08Å; T193-M197 HydrophobicContact CG2-SD 4.25Å; T193-M197 WeakPolarHBondContact O-CB 3.43Å; T193-M197 VanDerWaalsContact O-CG 3.26Å; T193-M197 WeakPolarHBondContact O-CG 3.45Å; T193-M197 PolarHBondContact O-N 3.43Å; T193-L226 HydrophobicContact CG2-CD1 4.34Å
194	V	85.2	Confident	83.4	Confident	43 Å²	43	19.7 Å²	19.7	26%	0.261	16%	0.155	S	C	.	.	H	α-helix	trans	-61	-42.5	177.3	173.6	0	0	0	0	111.4	G191 K192 M197 E198 F448 V450 A451	G191-V194 PolarHBondContact O-N 3.1Å; K192-V194 VanDerWaalsContact C-N 3.31Å; K192-V194 PolarHBondContact O-N 2.67Å; V194-M197 HydrophobicContact CB-CE 4.45Å; V194-M197 HydrophobicContact CG2-CE 4.11Å; V194-M197 PolarHBondContact O-N 3.29Å; V194-E198 WeakPolarHBondContact O-CB 3.26Å; V194-E198 PolarHBondContact O-N 3.07Å; V194-F448 HydrophobicContact CG1-CD2 3.81Å; V194-F448 HydrophobicContact CG1-CE2 4.42Å; V194-V450 HydrophobicContact CG1-CG2 4.13Å; V194-A451 HydrophobicContact CG1-CB 4.25Å
195	L	89.6	Confident	82.5	Confident	1 Å²	1	26 Å²	26	1%	0.005	18%	0.182	C	C	.	.	H	α-helix	trans	-64.5	-44.3	174.6	-176.9	64.8	0	0	0	112	I167 L184 G191 K192 T193 M197 E198 L199 T363 L365 P376 F448	I167-L195 HydrophobicContact CD1-CD1 3.56Å; L184-L195 HydrophobicContact CD1-CD2 4.24Å; L184-L195 HydrophobicContact CD2-CD2 3.95Å; G191-L195 PolarHBondContact O-N 3.48Å; K192-L195 PolarHBondContact O-N 3.22Å; T193-L195 VanDerWaalsContact C-N 3.34Å; T193-L195 PolarHBondContact O-N 3Å; L195-M197 VanDerWaalsContact C-N 3.34Å; L195-M197 PolarHBondContact O-N 3.28Å; L195-E198 PolarHBondContact O-N 2.64Å; L195-L199 HydrophobicContact CG-CD1 4.31Å; L195-L199 VanDerWaalsContact O-CG 3.27Å; L195-L199 WeakPolarHBondContact O-CG 3.36Å; L195-L199 PolarHBondContact O-N 3.05Å; L195-T363 HydrophobicContact CD2-CG2 4.35Å; L195-L365 HydrophobicContact CD2-CD1 4.23Å; L195-L365 HydrophobicContact CD2-CD2 4.31Å; L195-P376 HydrophobicContact CD1-CB 4.39Å; L195-F448 HydrophobicContact CD1-CE2 3.95Å; L195-F448 HydrophobicContact CD1-CZ 3.85Å
196	I	87.5	Confident	81.4	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-59	-46.7	176.4	-73.5	168.5	0	0	0	110.7	L184 K192 T193 E198 L199 I200 F213 F284 V337	L184-I196 HydrophobicContact CD1-CD1 4.05Å; L184-I196 HydrophobicContact CD1-CG1 3.58Å; K192-I196 WeakPolarHBondContact O-CG1 3.43Å; K192-I196 PolarHBondContact O-N 2.91Å; T193-I196 PolarHBondContact O-N 3.37Å; I196-E198 PolarHBondContact O-N 2.84Å; I196-L199 WeakPolarHBondContact O-CB 3.15Å; I196-L199 PolarHBondContact O-N 2.9Å; I196-I200 HydrophobicContact CG2-CD1 3.89Å; I196-I200 WeakPolarHBondContact O-CG1 3.4Å; I196-I200 PolarHBondContact O-N 2.69Å; I196-F213 HydrophobicContact CG2-CD2 4.3Å; I196-F213 HydrophobicContact CG2-CE2 4.03Å; I196-F284 HydrophobicContact CB-CD1 4.19Å; I196-F284 HydrophobicContact CB-CE1 4.39Å; I196-F284 HydrophobicContact CG1-CD1 4.11Å; I196-F284 HydrophobicContact CG2-CB 4.34Å; I196-F284 HydrophobicContact CG2-CD1 3.38Å; I196-F284 HydrophobicContact CG2-CE1 3.8Å; I196-F284 HydrophobicContact CG2-CG 3.94Å; I196-V337 HydrophobicContact CG1-CG1 4.41Å
197	M	84.5	Confident	80.6	Confident	11 Å²	11	32.8 Å²	32.8	5%	0.054	22%	0.219	C	C	.	.	H	α-helix	trans	-63.8	-42.1	179.8	-70.7	-175.9	-57.4	0	0	112.1	T193 V194 L195 L199 I200 N201 L226 E229 V450	T193-M197 HydrophobicContact CG2-CE 4.08Å; T193-M197 HydrophobicContact CG2-SD 4.25Å; T193-M197 WeakPolarHBondContact O-CB 3.43Å; T193-M197 VanDerWaalsContact O-CG 3.26Å; T193-M197 WeakPolarHBondContact O-CG 3.45Å; T193-M197 PolarHBondContact O-N 3.43Å; V194-M197 HydrophobicContact CB-CE 4.45Å; V194-M197 HydrophobicContact CG2-CE 4.11Å; V194-M197 PolarHBondContact O-N 3.29Å; L195-M197 VanDerWaalsContact C-N 3.34Å; L195-M197 PolarHBondContact O-N 3.28Å; M197-L199 VanDerWaalsContact C-N 3.33Å; M197-L199 PolarHBondContact O-N 2.72Å; M197-I200 PolarHBondContact O-N 3.23Å; M197-N201 WeakPolarHBondContact O-CB 3.32Å; M197-N201 PolarHBondContact O-N 3.27Å; M197-L226 HydrophobicContact CG-CD1 3.28Å; M197-L226 HydrophobicContact SD-CD1 3.29Å; M197-L226 WeakPolarHBondContact SD-CD1 3.45Å; M197-E229 WeakPolarHBondContact CE-OE1 3.32Å; M197-E229 WeakPolarHBondContact CE-OE2 3.26Å; M197-E229 HydrophobicContact SD-CB 4.3Å; M197-E229 HydrophobicContact SD-CG 4.02Å; M197-V450 HydrophobicContact CB-CB 4.26Å; M197-V450 HydrophobicContact CB-CG1 4.03Å; M197-V450 HydrophobicContact CB-CG2 4.12Å
198	E	88.6	Confident	80	Confident	1 Å²	1	33.3 Å²	33.3	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-63	-41.2	175.9	-172.6	68.4	177.2	0	0	111.2	I167 V194 L195 I196 I200 N201 N202 F448 Q449 V450	I167-E198 HydrophobicContact CD1-CG 4.17Å; V194-E198 WeakPolarHBondContact O-CB 3.26Å; V194-E198 PolarHBondContact O-N 3.07Å; L195-E198 PolarHBondContact O-N 2.64Å; I196-E198 PolarHBondContact O-N 2.84Å; E198-I200 PolarHBondContact O-N 2.64Å; E198-N201 PolarHBondContact O-N 2.93Å; E198-N202 VanDerWaalsContact O-CB 3.28Å; E198-N202 WeakPolarHBondContact O-CB 3.17Å; E198-N202 PolarHBondContact O-N 2.86Å; E198-N202 PolarHBondContact O-OD1 3.49Å; E198-N202 PolarHBondContact OE1-OD1 2.72Å; E198-F448 HydrophobicContact CB-CB 4.37Å; E198-F448 HydrophobicContact CB-CD2 3.69Å; E198-F448 HydrophobicContact CB-CE2 4.01Å; E198-F448 HydrophobicContact CB-CG 3.99Å; E198-F448 HydrophobicContact CG-CB 4.01Å; E198-F448 HydrophobicContact CG-CD1 3.78Å; E198-F448 HydrophobicContact CG-CD2 3.86Å; E198-F448 HydrophobicContact CG-CE1 4.12Å; E198-F448 HydrophobicContact CG-CE2 4.21Å; E198-F448 HydrophobicContact CG-CG 3.63Å; E198-F448 HydrophobicContact CG-CZ 4.31Å; E198-Q449 PolarHBondContact OE1-N 2.72Å; E198-Q449 PolarHBondContact OE2-N 3.04Å; E198-V450 HydrophobicContact CB-CG2 3.99Å; E198-V450 PolarHBondContact OE2-N 2.8Å
199	L	88.7	Confident	80.1	Confident	4 Å²	4	29.3 Å²	29.3	2%	0.021	19%	0.192	C	C	.	.	H	α-helix	trans	-61.2	-44.5	174.9	-71	171.2	0	0	0	111.9	T165 I167 Y176 L195 I196 M197 N202 V203 F284 V337	T165-L199 HydrophobicContact CG2-CD2 3.56Å; I167-L199 HydrophobicContact CD1-CD2 3.81Å; I167-L199 HydrophobicContact CD1-CG 4.2Å; Y176-L199 HydrophobicContact CE2-CD1 4.11Å; Y176-L199 HydrophobicContact CE2-CD2 4.2Å; L195-L199 HydrophobicContact CG-CD1 4.31Å; L195-L199 VanDerWaalsContact O-CG 3.27Å; L195-L199 WeakPolarHBondContact O-CG 3.36Å; L195-L199 PolarHBondContact O-N 3.05Å; I196-L199 WeakPolarHBondContact O-CB 3.15Å; I196-L199 PolarHBondContact O-N 2.9Å; M197-L199 VanDerWaalsContact C-N 3.33Å; M197-L199 PolarHBondContact O-N 2.72Å; L199-N202 PolarHBondContact O-N 3.48Å; L199-V203 WeakPolarHBondContact O-CB 3.33Å; L199-V203 WeakPolarHBondContact O-CG2 3.45Å; L199-V203 PolarHBondContact O-N 3.44Å; L199-F284 HydrophobicContact CB-CE1 4.15Å; L199-F284 HydrophobicContact CB-CZ 4.15Å; L199-F284 HydrophobicContact CD1-CE1 4.5Å; L199-V337 HydrophobicContact CD1-CG1 4.26Å; L199-V337 HydrophobicContact CD1-CG2 4.31Å
200	I	84.6	Confident	80.6	Confident	2 Å²	2	28.7 Å²	28.7	1%	0.01	17%	0.166	C	C	.	.	H	α-helix	trans	-58.7	-50.3	175.6	-68.3	168.8	0	0	0	110.1	I196 M197 E198 A204 F213 M230 V235 F284	I196-I200 HydrophobicContact CG2-CD1 3.89Å; I196-I200 WeakPolarHBondContact O-CG1 3.4Å; I196-I200 PolarHBondContact O-N 2.69Å; M197-I200 PolarHBondContact O-N 3.23Å; E198-I200 PolarHBondContact O-N 2.64Å; I200-A204 WeakPolarHBondContact O-CB 3.35Å; I200-A204 PolarHBondContact O-N 3.23Å; I200-F213 HydrophobicContact CD1-CD2 4.49Å; I200-M230 HydrophobicContact CD1-CE 3.46Å; I200-M230 VanDerWaalsContact CD1-CE 3.46Å; I200-V235 HydrophobicContact CG2-CG1 3.85Å; I200-F284 HydrophobicContact CB-CE2 4.43Å; I200-F284 HydrophobicContact CB-CZ 4.45Å; I200-F284 HydrophobicContact CD1-CD2 3.85Å; I200-F284 HydrophobicContact CD1-CE2 3.84Å; I200-F284 HydrophobicContact CD1-CG 4.23Å; I200-F284 HydrophobicContact CD1-CZ 4.17Å; I200-F284 HydrophobicContact CG1-CD2 3.73Å; I200-F284 HydrophobicContact CG1-CE1 4.03Å; I200-F284 HydrophobicContact CG1-CE2 3.16Å; I200-F284 HydrophobicContact CG1-CG 4.37Å; I200-F284 HydrophobicContact CG1-CZ 3.32Å
201	N	83.6	Confident	80.9	Confident	4 Å²	4	28.6 Å²	28.6	2%	0.021	17%	0.165	C	C	.	.	H	α-helix	trans	-62.2	-45.4	-178.8	172	74.1	0	0	0	112.2	M197 E198 K205 V450	M197-N201 WeakPolarHBondContact O-CB 3.32Å; M197-N201 PolarHBondContact O-N 3.27Å; E198-N201 PolarHBondContact O-N 2.93Å; N201-K205 PolarHBondContact ND2-NZ 2.54Å; N201-K205 WeakPolarHBondContact O-CB 3.38Å; N201-K205 WeakPolarHBondContact O-CG 3.19Å; N201-K205 PolarHBondContact O-N 2.84Å; N201-K205 VanDerWaalsContact O-N 3.09Å; N201-K205 WeakPolarHBondContact OD1-CE 3.37Å; N201-K205 PolarHBondContact OD1-NZ 3Å; N201-V450 HydrophobicContact CB-CG1 4.14Å
202	N	83.6	Confident	81.4	Confident	6 Å²	6	27.4 Å²	27.4	3%	0.032	15%	0.153	C	C	.	.	H	α-helix	trans	-67.7	-43.6	-177.1	-73	-0.6	0	0	0	111.5	T165 E198 L199 K205 A206 F461	T165-N202 WeakPolarHBondContact O-CB 3.37Å; T165-N202 PolarHBondContact O-ND2 3.16Å; T165-N202 VanDerWaalsContact O-ND2 3.1Å; E198-N202 VanDerWaalsContact O-CB 3.28Å; E198-N202 WeakPolarHBondContact O-CB 3.17Å; E198-N202 PolarHBondContact O-N 2.86Å; E198-N202 PolarHBondContact O-OD1 3.49Å; E198-N202 PolarHBondContact OE1-OD1 2.72Å; L199-N202 PolarHBondContact O-N 3.48Å; N202-K205 PolarHBondContact O-N 3.21Å; N202-A206 VanDerWaalsContact O-CB 3.25Å; N202-A206 WeakPolarHBondContact O-CB 3.38Å; N202-A206 PolarHBondContact O-N 3.35Å; N202-F461 HydrophobicContact CB-CD2 4Å; N202-F461 HydrophobicContact CB-CE2 4.07Å
203	V	75.5	Confident	81.9	Confident	9 Å²	9	26.2 Å²	26.2	6%	0.055	15%	0.148	C	C	.	.	H	α-helix	trans	-71.8	-38.7	177.8	174.4	0	0	0	0	112	L199 K205 A206 H207 L282	L199-V203 WeakPolarHBondContact O-CB 3.33Å; L199-V203 WeakPolarHBondContact O-CG2 3.45Å; L199-V203 PolarHBondContact O-N 3.44Å; V203-K205 PolarHBondContact O-N 3.37Å; V203-A206 PolarHBondContact O-N 3.35Å; V203-H207 HydrophobicContact CG1-CB 4.19Å; V203-H207 PolarHBondContact O-N 3.24Å; V203-L282 HydrophobicContact CB-CD1 3.47Å; V203-L282 VanDerWaalsContact CB-CD1 3.47Å; V203-L282 HydrophobicContact CG1-CD1 3.52Å; V203-L282 HydrophobicContact CG1-CG 4.12Å; V203-L282 HydrophobicContact CG2-CD1 3.56Å
204	A	73.1	Confident	82.6	Confident	8 Å²	8	23.9 Å²	23.9	7%	0.066	13%	0.134	C	C	.	.	H	α-helix	trans	-58.8	-33	174.2	0	0	0	0	0	112.7	I200 K244	I200-A204 WeakPolarHBondContact O-CB 3.35Å; I200-A204 PolarHBondContact O-N 3.23Å; A204-K244 HydrophobicContact CB-CD 4.05Å; A204-K244 PolarHBondContact O-NZ 3.27Å
205	K	71.2	Confident	83.1	Confident	131 Å²	131	21.8 Å²	21.8	57%	0.57	12%	0.121	S	C	*	.	H	α-helix	trans	-82.1	-44.3	176.2	-74	173.7	-179	165.5	0	113.2	N201 N202 V203	N201-K205 PolarHBondContact ND2-NZ 2.54Å; N201-K205 WeakPolarHBondContact O-CB 3.38Å; N201-K205 WeakPolarHBondContact O-CG 3.19Å; N201-K205 PolarHBondContact O-N 2.84Å; N201-K205 VanDerWaalsContact O-N 3.09Å; N201-K205 WeakPolarHBondContact OD1-CE 3.37Å; N201-K205 PolarHBondContact OD1-NZ 3Å; N202-K205 PolarHBondContact O-N 3.21Å; V203-K205 PolarHBondContact O-N 3.37Å
206	A	66.7	Low	83.3	Confident	56 Å²	56	21.8 Å²	21.8	46%	0.463	12%	0.121	S	C	.	.	H	α-helix	trans	-81.1	-42.6	-171.9	0	0	0	0	0	113.6	N202 V203 F461	N202-A206 VanDerWaalsContact O-CB 3.25Å; N202-A206 WeakPolarHBondContact O-CB 3.38Å; N202-A206 PolarHBondContact O-N 3.35Å; V203-A206 PolarHBondContact O-N 3.35Å; A206-F461 HydrophobicContact CB-CE2 4.44Å; A206-F461 HydrophobicContact CB-CZ 4.46Å
207	H	63.2	Low	83.5	Confident	112 Å²	112	21.9 Å²	21.9	52%	0.519	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.2	-9.6	-169.4	-66.5	-70.9	0	0	0	113.9	V203 G209	V203-H207 HydrophobicContact CG1-CB 4.19Å; V203-H207 PolarHBondContact O-N 3.24Å; H207-G209 PolarHBondContact O-N 3.41Å; H207-G209 VanDerWaalsContact O-N 3.08Å
208	G	64.5	Low	83.6	Confident	38 Å²	38	22.1 Å²	22.1	39%	0.392	12%	0.123	S	C	.	.			trans	65.9	6.6	-177	0	0	0	0	0	114.6
209	G	78.4	Confident	83.7	Confident	5 Å²	5	27.7 Å²	27.7	5%	0.052	14%	0.144	C	C	.	.			trans	-71.5	165.2	-177.7	0	0	0	0	0	113.7	H207	H207-G209 PolarHBondContact O-N 3.41Å; H207-G209 VanDerWaalsContact O-N 3.08Å
210	Y	88.8	Confident	83.6	Confident	65 Å²	65	31 Å²	31	26%	0.255	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	151	174.3	-63.8	-57.8	0	0	0	111	L121 K244 F273 Q279 V281 L282	L121-Y210 HydrophobicContact CD1-CD1 3.76Å; L121-Y210 HydrophobicContact CD1-CE1 3.37Å; L121-Y210 HydrophobicContact CD2-CD1 3.76Å; L121-Y210 HydrophobicContact CD2-CE1 4.28Å; L121-Y210 HydrophobicContact CD2-CG 4.28Å; L121-Y210 HydrophobicContact CG-CD1 4.44Å; L121-Y210 HydrophobicContact CG-CE1 4.48Å; Y210-K244 WeakPolarHBondContact CA-O 3.43Å; Y210-F273 HydrophobicContact CD2-CB 4.39Å; Y210-F273 AromaticContact CD2-CD1 3.5Å; Y210-F273 HydrophobicContact CD2-CD1 3.5Å; Y210-F273 AromaticContact CD2-CE1 3.91Å; Y210-F273 HydrophobicContact CD2-CE1 3.91Å; Y210-F273 AromaticContact CD2-CG 3.99Å; Y210-F273 HydrophobicContact CD2-CG 3.99Å; Y210-F273 AromaticContact CE2-CD1 3.84Å; Y210-F273 HydrophobicContact CE2-CD1 3.84Å; Y210-F273 HydrophobicContact CE2-CE1 4.02Å; Y210-F273 HydrophobicContact CG-CD1 4.24Å; Y210-F273 HydrophobicContact CG-CE1 4.38Å; Y210-Q279 HydrophobicContact CD2-CB 4.39Å; Y210-Q279 HydrophobicContact CD2-CG 4.14Å; Y210-Q279 HydrophobicContact CE2-CG 4.15Å; Y210-V281 VanDerWaalsContact O-CA 3.32Å; Y210-V281 WeakPolarHBondContact O-CA 3.34Å; Y210-V281 WeakPolarHBondContact O-CG1 3.34Å; Y210-L282 PolarHBondContact O-N 2.67Å
211	S	92.2	Very high	83.7	Confident	1 Å²	1	37.8 Å²	37.8	1%	0.007	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	147.1	173	-63.9	0	0	0	0	110.1	K244 V245 A246 L282	S211-K244 PolarHBondContact N-O 3.29Å; S211-V245 CarbonylContact O-C 3.57Å; S211-V245 WeakPolarHBondContact O-CA 3.25Å; S211-A246 PolarHBondContact O-N 3.41Å; S211-L282 CarbonylContact C-O 3.51Å; S211-L282 VanDerWaalsContact CA-O 3.28Å; S211-L282 WeakPolarHBondContact CA-O 3.28Å
212	V	94.8	Very high	83.7	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	127.1	169.6	-176.7	0	0	0	0	107.8	A246 V248 G266 V269 A270 V281 L282 L283 F284	V212-A246 WeakPolarHBondContact CA-O 3.48Å; V212-A246 HydrophobicContact CG2-CB 4.46Å; V212-V248 HydrophobicContact CG1-CG2 4.48Å; V212-G266 WeakPolarHBondContact CG1-O 3.39Å; V212-V269 HydrophobicContact CG1-CB 4.24Å; V212-V269 HydrophobicContact CG1-CG1 4.34Å; V212-V269 HydrophobicContact CG2-CB 4.38Å; V212-V269 HydrophobicContact CG2-CG1 3.91Å; V212-A270 HydrophobicContact CB-CB 4.28Å; V212-A270 HydrophobicContact CG2-CB 3.94Å; V212-V281 HydrophobicContact CG2-CG1 4.14Å; V212-L282 PolarHBondContact N-O 3.46Å; V212-L283 HydrophobicContact CB-CD1 4.07Å; V212-L283 HydrophobicContact CG1-CD1 4.15Å; V212-L283 CarbonylContact O-C 3.48Å; V212-L283 WeakPolarHBondContact O-CA 3.43Å; V212-F284 PolarHBondContact O-N 2.93Å
213	F	94.7	Very high	83.8	Confident	4 Å²	4	40 Å²	40	2%	0.018	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	120.9	176.3	-174	-84.6	0	0	0	109.5	I196 I200 L226 A246 L247 V248 Y249 F284 D286	I196-F213 HydrophobicContact CG2-CD2 4.3Å; I196-F213 HydrophobicContact CG2-CE2 4.03Å; I200-F213 HydrophobicContact CD1-CD2 4.49Å; F213-L226 HydrophobicContact CD1-CD2 3.87Å; F213-L226 HydrophobicContact CD2-CD2 3.9Å; F213-L226 HydrophobicContact CE1-CD2 3.54Å; F213-L226 HydrophobicContact CE2-CD2 3.57Å; F213-L226 HydrophobicContact CG-CD2 4.05Å; F213-L226 HydrophobicContact CZ-CD2 3.39Å; F213-A246 PolarHBondContact N-O 3.49Å; F213-L247 HydrophobicContact CB-CD2 3.54Å; F213-L247 HydrophobicContact CD1-CD2 4.37Å; F213-L247 HydrophobicContact CG-CD2 4.2Å; F213-V248 PolarHBondContact O-N 2.92Å; F213-Y249 HydrophobicContact CD1-CE1 4.14Å; F213-Y249 AromaticContact CE1-CE1 3.81Å; F213-Y249 HydrophobicContact CE1-CE1 3.81Å; F213-F284 HydrophobicContact CB-CB 4.5Å; F213-F284 HydrophobicContact CD2-CB 3.58Å; F213-F284 HydrophobicContact CD2-CG 4.36Å; F213-F284 HydrophobicContact CE2-CB 4.17Å; F213-F284 HydrophobicContact CG-CB 4.35Å; F213-D286 HydrophobicContact CZ-CB 4.04Å
214	A	96	Very high	84.4	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	101.9	175.2	0	0	0	0	0	109.4	V216 V248 F284 I285 D286	A214-V216 PolarHBondContact O-N 3.43Å; A214-V248 CarbonylContact C-O 3.55Å; A214-V248 WeakPolarHBondContact CA-O 3.25Å; A214-F284 PolarHBondContact N-O 3.46Å; A214-I285 HydrophobicContact CB-CG1 4.35Å; A214-I285 WeakPolarHBondContact O-CA 3.47Å; A214-D286 PolarHBondContact O-N 3.1Å; A214-D286 VanDerWaalsContact O-N 3.13Å
215	G	94.5	Very high	85	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	92	174.3	0	0	0	0	0	111.4	V248 G250 D286	G215-V248 PolarHBondContact N-O 3.37Å; G215-G250 PolarHBondContact O-N 2.92Å; G215-G250 VanDerWaalsContact O-O 3.12Å; G215-D286 CarbonylContact C-O 3.57Å; G215-D286 VanDerWaalsContact CA-O 3.24Å; G215-D286 WeakPolarHBondContact CA-O 2.95Å
216	V	94.7	Very high	85.7	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	109.4	178.8	-170.9	0	0	0	0	110.8	A214 E218 R259 V262 A263 I285 D286 N287 R290 F291	A214-V216 PolarHBondContact O-N 3.43Å; V216-E218 PolarHBondContact O-N 2.91Å; V216-R259 VanDerWaalsContact CG1-O 3.28Å; V216-R259 WeakPolarHBondContact CG1-O 3.4Å; V216-V262 HydrophobicContact CB-CG1 4.05Å; V216-V262 HydrophobicContact CG1-CG1 3.98Å; V216-V262 HydrophobicContact CG2-CG1 3.77Å; V216-A263 HydrophobicContact CG2-CB 3.84Å; V216-I285 HydrophobicContact CG2-CG2 3.84Å; V216-D286 PolarHBondContact N-O 2.92Å; V216-N287 PolarHBondContact O-N 2.81Å; V216-N287 VanDerWaalsContact O-N 3.12Å; V216-R290 HydrophobicContact CG1-CB 4.08Å; V216-R290 VanDerWaalsContact O-CB 3.24Å; V216-R290 WeakPolarHBondContact O-CB 2.96Å; V216-F291 HydrophobicContact CG1-CB 4.02Å
217	G	91.2	Very high	86.7	Confident	3 Å²	3	39.2 Å²	39.2	3%	0.031	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	61.8	34	-174.3	0	0	0	0	0	112.1	G250 M252	G217-G250 WeakPolarHBondContact CA-O 3.33Å; G217-G250 PolarHBondContact N-O 2.86Å; G217-M252 WeakPolarHBondContact O-CE 3.38Å; G217-M252 WeakPolarHBondContact O-CG 3.45Å
218	E	87.8	Confident	88	Confident	16 Å²	16	37.1 Å²	37.1	8%	0.075	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	150.4	179.5	-83.2	-57.1	131.1	0	0	111.8	V216 Y249 G250 M252 D286	V216-E218 PolarHBondContact O-N 2.91Å; E218-Y249 HydrophobicContact CB-CD1 4.19Å; E218-Y249 HydrophobicContact CB-CE1 4.47Å; E218-G250 PolarHBondContact N-O 3.36Å; E218-M252 PolarHBondContact O-N 2.65Å; E218-D286 VanDerWaalsContact CG-O 3.26Å; E218-D286 WeakPolarHBondContact CG-O 3.49Å; E218-D286 VanDerWaalsContact OE1-C 3.24Å; E218-D286 WeakPolarHBondContact OE1-CB 3.43Å
219	R	89.9	Confident	88.7	Confident	118 Å²	118	36.7 Å²	36.7	45%	0.445	17%	0.174	S	C	.	.			trans	-76.9	135	173	-66.1	-175.9	-173.4	79.1	2.5	109.1	R221 E222 G223 M252	R219-R221 PolarHBondContact O-N 3.05Å; R219-R221 VanDerWaalsContact O-N 3.17Å; R219-E222 HydrophobicContact CB-CB 4.25Å; R219-E222 HydrophobicContact CB-CG 4.2Å; R219-E222 WeakPolarHBondContact CD-OE2 3.43Å; R219-E222 IonicContact CZ-OE2 3.26Å; R219-E222 IonicContact NH1-OE1 3.7Å; R219-E222 IonicContact NH1-OE2 2.71Å; R219-E222 PolarHBondContact NH1-OE2 3.14Å; R219-E222 PolarHBondContact O-N 3.33Å; R219-G223 PolarHBondContact O-N 2.88Å; R219-M252 HydrophobicContact CG-CG 4.38Å; R219-M252 HydrophobicContact CG-SD 3.56Å; R219-M252 VanDerWaalsContact CG-SD 3.56Å
220	T	87.2	Confident	89.1	Confident	74 Å²	74	36.7 Å²	36.7	45%	0.454	17%	0.172	S	C	.	.	H	α-helix	trans	-55.3	-37.9	178.7	-44.4	0	0	0	0	112.7	N224 Q251	T220-N224 VanDerWaalsContact O-CB 3.25Å; T220-N224 WeakPolarHBondContact O-CB 3.46Å; T220-N224 PolarHBondContact O-N 2.93Å; T220-Q251 PolarHBondContact OG1-OE1 3.36Å
221	R	87	Confident	89	Confident	143 Å²	143	35.5 Å²	35.5	54%	0.54	17%	0.17	S	C	.	.	H	α-helix	trans	-61.1	-50	174.8	-175.9	-174.9	56.1	64.9	4.6	111.6	R219 N224 D225	R219-R221 PolarHBondContact O-N 3.05Å; R219-R221 VanDerWaalsContact O-N 3.17Å; R221-N224 PolarHBondContact O-N 2.81Å; R221-D225 IonicContact NH1-OD2 3.43Å; R221-D225 PolarHBondContact NH1-OD2 2.78Å; R221-D225 VanDerWaalsContact NH1-OD2 3.14Å; R221-D225 PolarHBondContact O-N 3.08Å
222	E	82.9	Confident	88.5	Confident	49 Å²	49	42.2 Å²	42.2	23%	0.229	20%	0.201	C	C	.	.	H	α-helix	trans	-66.5	-40.4	-177.1	-68.5	167.8	173.3	0	0	110.9	R219 D225 L226	R219-E222 HydrophobicContact CB-CB 4.25Å; R219-E222 HydrophobicContact CB-CG 4.2Å; R219-E222 WeakPolarHBondContact CD-OE2 3.43Å; R219-E222 IonicContact CZ-OE2 3.26Å; R219-E222 IonicContact NH1-OE1 3.7Å; R219-E222 IonicContact NH1-OE2 2.71Å; R219-E222 PolarHBondContact NH1-OE2 3.14Å; R219-E222 PolarHBondContact O-N 3.33Å; E222-D225 PolarHBondContact O-N 3.48Å; E222-L226 VanDerWaalsContact O-CB 3.3Å; E222-L226 WeakPolarHBondContact O-CB 3.28Å; E222-L226 PolarHBondContact O-N 3.1Å
223	G	86.1	Confident	87.6	Confident	7 Å²	7	44.3 Å²	44.3	7%	0.072	21%	0.214	C	C	.	.	H	α-helix	trans	-63.8	-39.5	172.6	0	0	0	0	0	113.3	R219 Y227 Y249	R219-G223 PolarHBondContact O-N 2.88Å; G223-Y227 WeakPolarHBondContact O-CB 3.3Å; G223-Y227 PolarHBondContact O-N 3.49Å; G223-Y249 PolarHBondContact O-OH 3.08Å
224	N	88.4	Confident	86.9	Confident	84 Å²	84	52.5 Å²	52.5	45%	0.449	25%	0.249	S	C	.	.	H	α-helix	trans	-66	-44.7	175	176.3	77.7	0	0	0	111.9	T220 R221 L226 Y227 N228	T220-N224 VanDerWaalsContact O-CB 3.25Å; T220-N224 WeakPolarHBondContact O-CB 3.46Å; T220-N224 PolarHBondContact O-N 2.93Å; R221-N224 PolarHBondContact O-N 2.81Å; N224-L226 VanDerWaalsContact C-N 3.34Å; N224-Y227 PolarHBondContact O-N 2.75Å; N224-N228 PolarHBondContact ND2-ND2 3.46Å; N224-N228 PolarHBondContact O-N 2.8Å; N224-N228 VanDerWaalsContact O-N 3.07Å; N224-N228 PolarHBondContact O-ND2 3.29Å; N224-N228 PolarHBondContact OD1-ND2 2.64Å
225	D	85.4	Confident	86.2	Confident	72 Å²	72	53 Å²	53	39%	0.385	25%	0.252	S	S	.	.	H	α-helix	trans	-60.1	-47.7	178	-63.2	-16.1	0	0	0	109.6	R221 E222 Y227 N228 E229	R221-D225 IonicContact NH1-OD2 3.43Å; R221-D225 PolarHBondContact NH1-OD2 2.78Å; R221-D225 VanDerWaalsContact NH1-OD2 3.14Å; R221-D225 PolarHBondContact O-N 3.08Å; E222-D225 PolarHBondContact O-N 3.48Å; D225-Y227 PolarHBondContact O-N 2.91Å; D225-N228 PolarHBondContact O-N 3.37Å; D225-E229 WeakPolarHBondContact O-CB 3.21Å; D225-E229 PolarHBondContact O-N 2.84Å
226	L	84.9	Confident	85.8	Confident	4 Å²	4	53.1 Å²	53.1	2%	0.021	25%	0.253	C	S	.	.	H	α-helix	trans	-56.8	-45.7	176	-177.4	64.7	0	0	0	112.7	T193 M197 F213 E222 N224 E229 M230	T193-L226 HydrophobicContact CG2-CD1 4.34Å; M197-L226 HydrophobicContact CG-CD1 3.28Å; M197-L226 HydrophobicContact SD-CD1 3.29Å; M197-L226 WeakPolarHBondContact SD-CD1 3.45Å; F213-L226 HydrophobicContact CD1-CD2 3.87Å; F213-L226 HydrophobicContact CD2-CD2 3.9Å; F213-L226 HydrophobicContact CE1-CD2 3.54Å; F213-L226 HydrophobicContact CE2-CD2 3.57Å; F213-L226 HydrophobicContact CG-CD2 4.05Å; F213-L226 HydrophobicContact CZ-CD2 3.39Å; E222-L226 VanDerWaalsContact O-CB 3.3Å; E222-L226 WeakPolarHBondContact O-CB 3.28Å; E222-L226 PolarHBondContact O-N 3.1Å; N224-L226 VanDerWaalsContact C-N 3.34Å; L226-E229 PolarHBondContact O-N 3.2Å; L226-M230 HydrophobicContact CD1-CE 3.68Å; L226-M230 HydrophobicContact CD2-CE 4.21Å; L226-M230 HydrophobicContact CG-CE 3.86Å; L226-M230 HydrophobicContact CG-SD 4.4Å; L226-M230 WeakPolarHBondContact O-CB 3.42Å; L226-M230 VanDerWaalsContact O-CG 3.29Å; L226-M230 WeakPolarHBondContact O-CG 3.35Å; L226-M230 PolarHBondContact O-N 2.94Å
227	Y	89	Confident	85.4	Confident	29 Å²	29	55.4 Å²	55.4	11%	0.114	27%	0.265	C	S	.	.	H	α-helix	trans	-63.1	-45.5	179.8	176.9	-120.6	0	0	0	112.1	I124 G223 N224 D225 M230 I231 I236 L247	I124-Y227 HydrophobicContact CD1-CD1 3.96Å; I124-Y227 HydrophobicContact CD1-CD2 3.7Å; I124-Y227 HydrophobicContact CD1-CE1 4.09Å; I124-Y227 HydrophobicContact CD1-CE2 3.83Å; I124-Y227 HydrophobicContact CD1-CG 3.75Å; I124-Y227 HydrophobicContact CG1-CD2 4.08Å; I124-Y227 HydrophobicContact CG1-CE2 3.97Å; G223-Y227 WeakPolarHBondContact O-CB 3.3Å; G223-Y227 PolarHBondContact O-N 3.49Å; N224-Y227 PolarHBondContact O-N 2.75Å; D225-Y227 PolarHBondContact O-N 2.91Å; Y227-M230 PolarHBondContact O-N 3.04Å; Y227-I231 HydrophobicContact CD1-CD1 3.94Å; Y227-I231 HydrophobicContact CD2-CD1 4.31Å; Y227-I231 HydrophobicContact CE1-CD1 3.63Å; Y227-I231 HydrophobicContact CE2-CD1 4.05Å; Y227-I231 HydrophobicContact CE2-CG1 4.46Å; Y227-I231 HydrophobicContact CG-CD1 4.29Å; Y227-I231 WeakPolarHBondContact O-CD1 3.48Å; Y227-I231 WeakPolarHBondContact O-CG1 3.2Å; Y227-I231 PolarHBondContact O-N 2.85Å; Y227-I231 VanDerWaalsContact O-N 3.16Å; Y227-I236 HydrophobicContact CD2-CD1 3.61Å; Y227-I236 HydrophobicContact CE2-CD1 3.76Å; Y227-I236 HydrophobicContact CE2-CG2 4.37Å; Y227-L247 HydrophobicContact CD2-CD1 3.58Å; Y227-L247 HydrophobicContact CE2-CD1 4.38Å; Y227-L247 HydrophobicContact CG-CD1 4.36Å
228	N	88.7	Confident	85.1	Confident	67 Å²	67	59 Å²	59	36%	0.358	28%	0.283	S	S	.	.	H	α-helix	trans	-65.9	-40.5	178.7	-71.1	-61	0	0	0	111.5	N224 D225 M230 I231 E232	N224-N228 PolarHBondContact ND2-ND2 3.46Å; N224-N228 PolarHBondContact O-N 2.8Å; N224-N228 VanDerWaalsContact O-N 3.07Å; N224-N228 PolarHBondContact O-ND2 3.29Å; N224-N228 PolarHBondContact OD1-ND2 2.64Å; D225-N228 PolarHBondContact O-N 3.37Å; N228-M230 VanDerWaalsContact C-N 3.34Å; N228-M230 PolarHBondContact O-N 2.85Å; N228-I231 WeakPolarHBondContact O-CB 3.27Å; N228-I231 PolarHBondContact O-N 3.2Å; N228-I231 VanDerWaalsContact O-N 3.12Å; N228-E232 WeakPolarHBondContact O-CG 3.36Å; N228-E232 PolarHBondContact O-N 2.97Å
229	E	80.9	Confident	84.7	Confident	30 Å²	30	68.2 Å²	68.2	14%	0.14	32%	0.323	C	S	.	.	H	α-helix	trans	-64.4	-37.9	176.8	-170.4	168.7	166.7	0	0	112.3	M197 D225 L226 I231 E232 T233 V450	M197-E229 WeakPolarHBondContact CE-OE1 3.32Å; M197-E229 WeakPolarHBondContact CE-OE2 3.26Å; M197-E229 HydrophobicContact SD-CB 4.3Å; M197-E229 HydrophobicContact SD-CG 4.02Å; D225-E229 WeakPolarHBondContact O-CB 3.21Å; D225-E229 PolarHBondContact O-N 2.84Å; L226-E229 PolarHBondContact O-N 3.2Å; E229-I231 VanDerWaalsContact C-N 3.28Å; E229-I231 PolarHBondContact O-N 3.08Å; E229-E232 PolarHBondContact O-N 3.04Å; E229-T233 WeakPolarHBondContact O-CB 3.49Å; E229-T233 WeakPolarHBondContact O-CG2 3.43Å; E229-T233 PolarHBondContact O-N 3.29Å; E229-T233 PolarHBondContact O-OG1 2.82Å; E229-V450 WeakPolarHBondContact OE1-CB 3.4Å
230	M	84.9	Confident	84	Confident	4 Å²	4	63.9 Å²	63.9	2%	0.02	32%	0.315	C	S	.	.	H	α-helix	trans	-65.6	-30.2	173.5	-75	-178.6	177.9	0	0	113.2	I200 L226 Y227 N228 T233 K234 V235 I236 V245 L247	I200-M230 HydrophobicContact CD1-CE 3.46Å; I200-M230 VanDerWaalsContact CD1-CE 3.46Å; L226-M230 HydrophobicContact CD1-CE 3.68Å; L226-M230 HydrophobicContact CD2-CE 4.21Å; L226-M230 HydrophobicContact CG-CE 3.86Å; L226-M230 HydrophobicContact CG-SD 4.4Å; L226-M230 WeakPolarHBondContact O-CB 3.42Å; L226-M230 VanDerWaalsContact O-CG 3.29Å; L226-M230 WeakPolarHBondContact O-CG 3.35Å; L226-M230 PolarHBondContact O-N 2.94Å; Y227-M230 PolarHBondContact O-N 3.04Å; N228-M230 VanDerWaalsContact C-N 3.34Å; N228-M230 PolarHBondContact O-N 2.85Å; M230-T233 WeakPolarHBondContact CA-OG1 3.25Å; M230-T233 PolarHBondContact O-OG1 2.95Å; M230-K234 PolarHBondContact O-N 2.74Å; M230-V235 HydrophobicContact CB-CB 4.35Å; M230-V235 PolarHBondContact O-N 3.23Å; M230-I236 HydrophobicContact CB-CB 4.38Å; M230-I236 HydrophobicContact CB-CD1 3.61Å; M230-I236 HydrophobicContact CB-CG1 3.83Å; M230-I236 HydrophobicContact CG-CD1 4.45Å; M230-I236 PolarHBondContact O-N 3.49Å; M230-I236 HydrophobicContact SD-CD1 4Å; M230-V245 HydrophobicContact CE-CG2 4.31Å; M230-V245 HydrophobicContact SD-CG1 3.72Å; M230-V245 HydrophobicContact SD-CG2 4.24Å; M230-L247 HydrophobicContact CE-CD2 4.23Å; M230-L247 HydrophobicContact SD-CD1 4.34Å; M230-L247 HydrophobicContact SD-CD2 3.81Å
231	I	86.7	Confident	83.4	Confident	41 Å²	41	68.4 Å²	68.4	21%	0.21	34%	0.337	C	S	.	.	H	α-helix	trans	-70.8	-46.8	172.5	-66.2	159.1	0	0	0	110.1	Y227 N228 E229 T233 K234 I236 L238	Y227-I231 HydrophobicContact CD1-CD1 3.94Å; Y227-I231 HydrophobicContact CD2-CD1 4.31Å; Y227-I231 HydrophobicContact CE1-CD1 3.63Å; Y227-I231 HydrophobicContact CE2-CD1 4.05Å; Y227-I231 HydrophobicContact CE2-CG1 4.46Å; Y227-I231 HydrophobicContact CG-CD1 4.29Å; Y227-I231 WeakPolarHBondContact O-CD1 3.48Å; Y227-I231 WeakPolarHBondContact O-CG1 3.2Å; Y227-I231 PolarHBondContact O-N 2.85Å; Y227-I231 VanDerWaalsContact O-N 3.16Å; N228-I231 WeakPolarHBondContact O-CB 3.27Å; N228-I231 PolarHBondContact O-N 3.2Å; N228-I231 VanDerWaalsContact O-N 3.12Å; E229-I231 VanDerWaalsContact C-N 3.28Å; E229-I231 PolarHBondContact O-N 3.08Å; I231-T233 VanDerWaalsContact C-N 3.34Å; I231-T233 PolarHBondContact O-N 2.8Å; I231-K234 PolarHBondContact O-N 2.83Å; I231-I236 HydrophobicContact CG1-CB 4.05Å; I231-I236 HydrophobicContact CG1-CG2 3.91Å; I231-L238 HydrophobicContact CD1-CD1 3.96Å; I231-L238 HydrophobicContact CD1-CD2 4Å; I231-L238 HydrophobicContact CD1-CG 4.2Å; I231-L238 HydrophobicContact CG1-CD1 4.26Å; I231-L238 HydrophobicContact CG1-CD2 4.11Å; I231-L238 HydrophobicContact CG1-CG 4.09Å; I231-L238 HydrophobicContact CG2-CD1 3.87Å; I231-L238 HydrophobicContact CG2-CG 4.1Å
232	E	82.9	Confident	83.2	Confident	142 Å²	142	66 Å²	66	66%	0.664	34%	0.338	S	S	*	.	H	α-helix	trans	-61.3	-42.1	180	-72.4	-177.8	-179.7	0	0	112.2	N228 E229 K234	N228-E232 WeakPolarHBondContact O-CG 3.36Å; N228-E232 PolarHBondContact O-N 2.97Å; E229-E232 PolarHBondContact O-N 3.04Å; E232-K234 PolarHBondContact O-N 3.11Å
233	T	75.7	Confident	83.5	Confident	43 Å²	43	64 Å²	64	26%	0.264	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-0.2	177	55.5	0	0	0	0	113.6	E229 M230 I231 V235 V450	E229-T233 WeakPolarHBondContact O-CB 3.49Å; E229-T233 WeakPolarHBondContact O-CG2 3.43Å; E229-T233 PolarHBondContact O-N 3.29Å; E229-T233 PolarHBondContact O-OG1 2.82Å; M230-T233 WeakPolarHBondContact CA-OG1 3.25Å; M230-T233 PolarHBondContact O-OG1 2.95Å; I231-T233 VanDerWaalsContact C-N 3.34Å; I231-T233 PolarHBondContact O-N 2.8Å; T233-V235 PolarHBondContact O-N 3.47Å; T233-V235 WeakPolarHBondContact OG1-CG2 3.1Å; T233-V450 HydrophobicContact CG2-CG1 4.34Å
234	K	79.8	Confident	83.5	Confident	176 Å²	176	67 Å²	67	77%	0.765	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.7	20.6	-178	-53.1	178.7	-178.7	174.9	0	114.3	M230 I231 E232 I236	M230-K234 PolarHBondContact O-N 2.74Å; I231-K234 PolarHBondContact O-N 2.83Å; E232-K234 PolarHBondContact O-N 3.11Å; K234-I236 VanDerWaalsContact C-N 3.29Å
235	V	81.7	Confident	83.7	Confident	11 Å²	11	63 Å²	63	7%	0.067	32%	0.319	C	S	.	.	S	Bend	trans	-69.3	-36.6	168.6	178.3	0	0	0	0	109.6	I200 M230 T233 K244 V245	I200-V235 HydrophobicContact CG2-CG1 3.85Å; M230-V235 HydrophobicContact CB-CB 4.35Å; M230-V235 PolarHBondContact O-N 3.23Å; T233-V235 PolarHBondContact O-N 3.47Å; T233-V235 WeakPolarHBondContact OG1-CG2 3.1Å; V235-K244 PolarHBondContact O-N 3.31Å; V235-V245 HydrophobicContact CG1-CB 4.05Å; V235-V245 HydrophobicContact CG1-CG1 3.71Å
236	I	86.7	Confident	84.1	Confident	2 Å²	2	59.6 Å²	59.6	1%	0.01	30%	0.301	C	S	.	.	S	Bend	trans	-104.5	119.2	168.1	-65.3	175.2	0	0	0	108.3	Y227 M230 I231 K234 L238 V245 L247	Y227-I236 HydrophobicContact CD2-CD1 3.61Å; Y227-I236 HydrophobicContact CE2-CD1 3.76Å; Y227-I236 HydrophobicContact CE2-CG2 4.37Å; M230-I236 HydrophobicContact CB-CB 4.38Å; M230-I236 HydrophobicContact CB-CD1 3.61Å; M230-I236 HydrophobicContact CB-CG1 3.83Å; M230-I236 HydrophobicContact CG-CD1 4.45Å; M230-I236 PolarHBondContact O-N 3.49Å; M230-I236 HydrophobicContact SD-CD1 4Å; I231-I236 HydrophobicContact CG1-CB 4.05Å; I231-I236 HydrophobicContact CG1-CG2 3.91Å; K234-I236 VanDerWaalsContact C-N 3.29Å; I236-L238 HydrophobicContact CG2-CD2 4.06Å; I236-V245 HydrophobicContact CD1-CG1 3.76Å; I236-V245 HydrophobicContact CG1-CG1 3.34Å; I236-L247 HydrophobicContact CD1-CD1 3.87Å; I236-L247 HydrophobicContact CD1-CG 4.45Å
237	D	86.4	Confident	84.6	Confident	48 Å²	48	59.4 Å²	59.4	26%	0.257	30%	0.3	S	S	.	.			trans	-96.5	117.5	167	-175.6	0	0	0	0	109	K239 G240 T242 S243	D237-K239 PolarHBondContact OD1-N 2.95Å; D237-G240 PolarHBondContact OD1-N 3.45Å; D237-G240 WeakPolarHBondContact OD2-CA 3.42Å; D237-G240 PolarHBondContact OD2-N 3.23Å; D237-G240 VanDerWaalsContact OD2-N 3.08Å; D237-T242 WeakPolarHBondContact CB-OG1 3.01Å; D237-T242 PolarHBondContact OD2-OG1 3.26Å; D237-S243 PolarHBondContact N-OG 3.13Å; D237-S243 PolarHBondContact O-OG 3.44Å
238	L	84.8	Confident	84.9	Confident	78 Å²	78	58 Å²	58	41%	0.408	29%	0.294	S	S	.	.	S	Bend	trans	-76.7	-26.9	178.6	-66.8	-179.2	0	0	0	113.2	R135 I231 I236	R135-L238 PolarHBondContact NH2-O 3.28Å; R135-L238 VanDerWaalsContact NH2-O 3.17Å; I231-L238 HydrophobicContact CD1-CD1 3.96Å; I231-L238 HydrophobicContact CD1-CD2 4Å; I231-L238 HydrophobicContact CD1-CG 4.2Å; I231-L238 HydrophobicContact CG1-CD1 4.26Å; I231-L238 HydrophobicContact CG1-CD2 4.11Å; I231-L238 HydrophobicContact CG1-CG 4.09Å; I231-L238 HydrophobicContact CG2-CD1 3.87Å; I231-L238 HydrophobicContact CG2-CG 4.1Å; I236-L238 HydrophobicContact CG2-CD2 4.06Å
239	K	78.3	Confident	85.3	Confident	210 Å²	210	55.1 Å²	55.1	91%	0.913	28%	0.279	S	S	*	.	S	Bend	trans	-103.3	-30.4	-171.4	-67.5	-175.5	-179.2	177.8	0	112.9	D237	D237-K239 PolarHBondContact OD1-N 2.95Å
240	G	75.6	Confident	85.9	Confident	27 Å²	27	53.7 Å²	53.7	28%	0.278	27%	0.272	S	S	.	.	S	Bend	trans	-110.9	-175.8	177.8	0	0	0	0	0	113.6	D237	D237-G240 PolarHBondContact OD1-N 3.45Å; D237-G240 WeakPolarHBondContact OD2-CA 3.42Å; D237-G240 PolarHBondContact OD2-N 3.23Å; D237-G240 VanDerWaalsContact OD2-N 3.08Å
241	D	75.1	Confident	86.2	Confident	170 Å²	170	55.3 Å²	55.3	91%	0.909	28%	0.28	S	S	*	.	S	Bend	trans	-102.6	21.3	-177.4	-60	-35.8	0	0	0	111.8
242	T	82.9	Confident	86.4	Confident	93 Å²	93	56.8 Å²	56.8	57%	0.571	29%	0.286	S	S	*	.			trans	-94	8.9	-177.7	64.9	0	0	0	0	113.6	D237 K244	D237-T242 WeakPolarHBondContact CB-OG1 3.01Å; D237-T242 PolarHBondContact OD2-OG1 3.26Å; T242-K244 PolarHBondContact O-N 2.89Å
243	S	88.8	Confident	86.7	Confident	7 Å²	7	55.7 Å²	55.7	5%	0.049	29%	0.285	C	S	.	.			trans	-58.8	134.6	175.3	-72.2	0	0	0	0	110.5	L121 G122 D237	L121-S243 WeakPolarHBondContact CB-O 3.43Å; G122-S243 VanDerWaalsContact CA-CB 3.49Å; G122-S243 WeakPolarHBondContact CA-OG 3.46Å; D237-S243 PolarHBondContact N-OG 3.13Å; D237-S243 PolarHBondContact O-OG 3.44Å
244	K	86.6	Confident	87.5	Confident	69 Å²	69	55.2 Å²	55.2	30%	0.3	28%	0.28	S	S	.	.			trans	-111.7	-1.2	-177.1	-62.5	-166.8	-178.9	-169.5	0	114.5	A204 Y210 S211 V235 T242	A204-K244 HydrophobicContact CB-CD 4.05Å; A204-K244 PolarHBondContact O-NZ 3.27Å; Y210-K244 WeakPolarHBondContact CA-O 3.43Å; S211-K244 PolarHBondContact N-O 3.29Å; V235-K244 PolarHBondContact O-N 3.31Å; T242-K244 PolarHBondContact O-N 2.89Å
245	V	91.1	Very high	88.2	Confident	0 Å²	0	48 Å²	48	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	136.3	-176.6	66.6	0	0	0	0	111.5	G122 S211 M230 V235 I236 L247	G122-V245 WeakPolarHBondContact CA-O 3.44Å; G122-V245 PolarHBondContact N-O 3.38Å; S211-V245 CarbonylContact O-C 3.57Å; S211-V245 WeakPolarHBondContact O-CA 3.25Å; M230-V245 HydrophobicContact CE-CG2 4.31Å; M230-V245 HydrophobicContact SD-CG1 3.72Å; M230-V245 HydrophobicContact SD-CG2 4.24Å; V235-V245 HydrophobicContact CG1-CB 4.05Å; V235-V245 HydrophobicContact CG1-CG1 3.71Å; I236-V245 HydrophobicContact CD1-CG1 3.76Å; I236-V245 HydrophobicContact CG1-CG1 3.34Å; V245-L247 HydrophobicContact CG2-CD2 3.86Å
246	A	94	Very high	88.8	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	136.1	166.4	0	0	0	0	0	109.7	T120 S211 V212 F213 V269	T120-A246 WeakPolarHBondContact O-CB 3.4Å; S211-A246 PolarHBondContact O-N 3.41Å; V212-A246 WeakPolarHBondContact CA-O 3.48Å; V212-A246 HydrophobicContact CG2-CB 4.46Å; F213-A246 PolarHBondContact N-O 3.49Å; A246-V269 HydrophobicContact CB-CG1 3.97Å
247	L	95.3	Very high	89.1	Confident	0 Å²	0	48 Å²	48	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	130	-178.7	-56.5	-179	0	0	0	110.3	R123 I124 M125 F213 Y227 M230 I236 V245 Y249	R123-L247 PolarHBondContact O-N 2.85Å; I124-L247 CarbonylContact C-O 3.39Å; I124-L247 WeakPolarHBondContact CA-O 3.39Å; I124-L247 HydrophobicContact CB-CB 4.46Å; I124-L247 HydrophobicContact CD1-CD1 4.47Å; I124-L247 HydrophobicContact CG1-CB 4.19Å; I124-L247 HydrophobicContact CG1-CD1 4.05Å; I124-L247 HydrophobicContact CG2-CB 4.26Å; M125-L247 PolarHBondContact N-O 2.96Å; F213-L247 HydrophobicContact CB-CD2 3.54Å; F213-L247 HydrophobicContact CD1-CD2 4.37Å; F213-L247 HydrophobicContact CG-CD2 4.2Å; Y227-L247 HydrophobicContact CD2-CD1 3.58Å; Y227-L247 HydrophobicContact CE2-CD1 4.38Å; Y227-L247 HydrophobicContact CG-CD1 4.36Å; M230-L247 HydrophobicContact CE-CD2 4.23Å; M230-L247 HydrophobicContact SD-CD1 4.34Å; M230-L247 HydrophobicContact SD-CD2 3.81Å; I236-L247 HydrophobicContact CD1-CD1 3.87Å; I236-L247 HydrophobicContact CD1-CG 4.45Å; V245-L247 HydrophobicContact CG2-CD2 3.86Å; L247-Y249 HydrophobicContact CB-CE2 4Å; L247-Y249 HydrophobicContact CD1-CE2 4.34Å
248	V	96.9	Very high	89.5	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	122.8	175.8	-170	0	0	0	0	108	M125 V212 F213 A214 G215 V262 T265	M125-V248 HydrophobicContact CE-CG2 4.09Å; M125-V248 HydrophobicContact CG-CB 4.22Å; M125-V248 HydrophobicContact CG-CG1 4.01Å; M125-V248 HydrophobicContact CG-CG2 3.76Å; M125-V248 CarbonylContact O-C 3.58Å; M125-V248 WeakPolarHBondContact O-CA 3.46Å; M125-V248 HydrophobicContact SD-CG2 4.01Å; V212-V248 HydrophobicContact CG1-CG2 4.48Å; F213-V248 PolarHBondContact O-N 2.92Å; A214-V248 CarbonylContact C-O 3.55Å; A214-V248 WeakPolarHBondContact CA-O 3.25Å; G215-V248 PolarHBondContact N-O 3.37Å; V248-V262 HydrophobicContact CB-CG2 4.48Å; V248-V262 HydrophobicContact CG1-CG2 3.47Å; V248-V262 VanDerWaalsContact CG1-CG2 3.47Å; V248-T265 HydrophobicContact CG1-CG2 3.48Å; V248-T265 VanDerWaalsContact CG1-CG2 3.48Å
249	Y	95.8	Very high	90	Very high	7 Å²	7	43.1 Å²	43.1	3%	0.027	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	137.6	178.6	-69	-73.2	0	0	0	112.2	I124 M125 F213 E218 G223 L247	I124-Y249 HydrophobicContact CG2-CD2 3.3Å; I124-Y249 HydrophobicContact CG2-CE2 3.62Å; M125-Y249 PolarHBondContact O-N 3.21Å; F213-Y249 HydrophobicContact CD1-CE1 4.14Å; F213-Y249 AromaticContact CE1-CE1 3.81Å; F213-Y249 HydrophobicContact CE1-CE1 3.81Å; E218-Y249 HydrophobicContact CB-CD1 4.19Å; E218-Y249 HydrophobicContact CB-CE1 4.47Å; G223-Y249 PolarHBondContact O-OH 3.08Å; L247-Y249 HydrophobicContact CB-CE2 4Å; L247-Y249 HydrophobicContact CD1-CE2 4.34Å
250	G	93.4	Very high	90.8	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	101.6	161.7	0	0	0	0	0	107.2	G215 G217 E218 E254	G215-G250 PolarHBondContact O-N 2.92Å; G215-G250 VanDerWaalsContact O-O 3.12Å; G217-G250 WeakPolarHBondContact CA-O 3.33Å; G217-G250 PolarHBondContact N-O 2.86Å; E218-G250 PolarHBondContact N-O 3.36Å; G250-E254 VanDerWaalsContact C-OE2 3.24Å; G250-E254 WeakPolarHBondContact CA-OE2 3.4Å
251	Q	92.6	Very high	91.7	Very high	38 Å²	38	34 Å²	34	18%	0.178	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	164.5	-163.1	-59.7	-175.2	-24.4	0	0	113	T220 N253 E254	T220-Q251 PolarHBondContact OG1-OE1 3.36Å; Q251-N253 VanDerWaalsContact C-N 3.27Å; Q251-N253 WeakPolarHBondContact CB-OD1 3.1Å; Q251-N253 PolarHBondContact O-N 3.36Å; Q251-N253 PolarHBondContact OE1-OD1 2.68Å; Q251-E254 HydrophobicContact CB-CG 4.16Å; Q251-E254 PolarHBondContact N-OE2 2.88Å; Q251-E254 WeakPolarHBondContact O-CB 3.34Å; Q251-E254 PolarHBondContact O-N 3.36Å; Q251-E254 VanDerWaalsContact O-N 3.13Å
252	M	90.2	Very high	92.8	Very high	72 Å²	72	25.9 Å²	25.9	36%	0.355	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-33.8	177.8	-75.5	-163.8	140.9	0	0	114.4	G217 E218 R219 E254	G217-M252 WeakPolarHBondContact O-CE 3.38Å; G217-M252 WeakPolarHBondContact O-CG 3.45Å; E218-M252 PolarHBondContact O-N 2.65Å; R219-M252 HydrophobicContact CG-CG 4.38Å; R219-M252 HydrophobicContact CG-SD 3.56Å; R219-M252 VanDerWaalsContact CG-SD 3.56Å; M252-E254 PolarHBondContact O-N 3.44Å
253	N	89.7	Confident	93.4	Very high	119 Å²	119	21.5 Å²	21.5	64%	0.636	11%	0.105	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-7.6	179.1	59.8	-60.3	0	0	0	112.8	Q251	Q251-N253 VanDerWaalsContact C-N 3.27Å; Q251-N253 WeakPolarHBondContact CB-OD1 3.1Å; Q251-N253 PolarHBondContact O-N 3.36Å; Q251-N253 PolarHBondContact OE1-OD1 2.68Å
254	E	92.7	Very high	93.9	Very high	33 Å²	33	21.6 Å²	21.6	15%	0.154	11%	0.105	C	C	.	.	S	Bend	trans	-84.9	154.6	179.1	-70.3	-179.9	166.4	0	0	111.9	G250 Q251 M252 A258 R259	G250-E254 VanDerWaalsContact C-OE2 3.24Å; G250-E254 WeakPolarHBondContact CA-OE2 3.4Å; Q251-E254 HydrophobicContact CB-CG 4.16Å; Q251-E254 PolarHBondContact N-OE2 2.88Å; Q251-E254 WeakPolarHBondContact O-CB 3.34Å; Q251-E254 PolarHBondContact O-N 3.36Å; Q251-E254 VanDerWaalsContact O-N 3.13Å; M252-E254 PolarHBondContact O-N 3.44Å; E254-A258 HydrophobicContact CB-CB 4.01Å; E254-R259 PolarHBondContact O-NE 3.24Å
255	P	93.2	Very high	94.4	Very high	23 Å²	23	18.3 Å²	18.3	15%	0.149	9%	0.091	C	C	.	.			trans	-60.5	158.1	-178.9	27.2	-38.4	0	0	0	112.4	A49 G257 A258 R259	A49-P255 HydrophobicContact CB-CB 4.23Å; P255-G257 PolarHBondContact O-N 2.6Å; P255-G257 VanDerWaalsContact O-N 3.11Å; P255-A258 HydrophobicContact CG-CB 4.38Å; P255-A258 WeakPolarHBondContact O-CB 3.41Å; P255-A258 PolarHBondContact O-N 3.02Å; P255-A258 VanDerWaalsContact O-N 3.09Å; P255-R259 PolarHBondContact O-N 3.36Å
256	P	94	Very high	94.7	Very high	14 Å²	14	18.3 Å²	18.3	9%	0.091	9%	0.091	C	C	.	.	H	α-helix	trans	-59.4	-26.6	179.8	25.1	-35.2	0	0	0	113.2	A49 R259 A260 E297 V298 L301	A49-P256 HydrophobicContact CB-CG 4.24Å; P256-R259 PolarHBondContact O-N 3.01Å; P256-A260 WeakPolarHBondContact O-CB 3.3Å; P256-A260 PolarHBondContact O-N 3.23Å; P256-E297 HydrophobicContact CB-CB 3.71Å; P256-E297 HydrophobicContact CG-CB 4.25Å; P256-V298 HydrophobicContact CB-CG2 3.98Å; P256-V298 HydrophobicContact CG-CG2 4.46Å; P256-L301 HydrophobicContact CG-CD1 4.08Å
257	G	94.2	Very high	94.8	Very high	1 Å²	1	18.3 Å²	18.3	1%	0.01	9%	0.091	C	C	.	.	H	α-helix	trans	-58.9	-47.3	173.8	0	0	0	0	0	113.2	I91 P255 A260 R261	I91-G257 VanDerWaalsContact CG2-CA 3.5Å; P255-G257 PolarHBondContact O-N 2.6Å; P255-G257 VanDerWaalsContact O-N 3.11Å; G257-A260 PolarHBondContact O-N 3.24Å; G257-R261 WeakPolarHBondContact O-CG 3.07Å; G257-R261 PolarHBondContact O-N 3.15Å
258	A	94.8	Very high	95	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-60.2	-51.7	177	0	0	0	0	0	111.2	M93 V127 E254 P255 A260 R261 V262	M93-A258 WeakPolarHBondContact O-CB 3.21Å; V127-A258 HydrophobicContact CB-CB 4.4Å; V127-A258 HydrophobicContact CG1-CB 3.96Å; E254-A258 HydrophobicContact CB-CB 4.01Å; P255-A258 HydrophobicContact CG-CB 4.38Å; P255-A258 WeakPolarHBondContact O-CB 3.41Å; P255-A258 PolarHBondContact O-N 3.02Å; P255-A258 VanDerWaalsContact O-N 3.09Å; A258-A260 VanDerWaalsContact C-N 3.29Å; A258-A260 PolarHBondContact O-N 3.02Å; A258-R261 PolarHBondContact O-N 3.45Å; A258-V262 WeakPolarHBondContact O-CB 3.14Å; A258-V262 PolarHBondContact O-N 2.84Å
259	R	95	Very high	95	Very high	22 Å²	22	18.3 Å²	18.3	8%	0.083	9%	0.091	C	C	.	.	H	α-helix	trans	-62.1	-35.1	-179.6	-67.1	-176.9	-76.2	118.8	-7.6	112.6	V216 E254 P255 P256 R261 A294 E297	V216-R259 VanDerWaalsContact CG1-O 3.28Å; V216-R259 WeakPolarHBondContact CG1-O 3.4Å; E254-R259 PolarHBondContact O-NE 3.24Å; P255-R259 PolarHBondContact O-N 3.36Å; P256-R259 PolarHBondContact O-N 3.01Å; R259-R261 PolarHBondContact O-N 3.49Å; R259-A294 HydrophobicContact CB-CB 3.54Å; R259-E297 IonicContact CZ-OE1 3.29Å; R259-E297 IonicContact CZ-OE2 2.78Å; R259-E297 IonicContact NH1-OE1 3.71Å; R259-E297 PolarHBondContact NH1-OE1 3.5Å; R259-E297 IonicContact NH1-OE2 2.92Å; R259-E297 IonicContact NH2-OE1 3.47Å; R259-E297 PolarHBondContact NH2-OE1 3.37Å; R259-E297 IonicContact NH2-OE2 3.74Å; R259-E297 PolarHBondContact NH2-OE2 2.99Å
260	A	94.2	Very high	95	Very high	2 Å²	2	18 Å²	18	2%	0.017	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76	-7.4	177.9	0	0	0	0	0	114	P256 G257 A258 F291 A294 V298	P256-A260 WeakPolarHBondContact O-CB 3.3Å; P256-A260 PolarHBondContact O-N 3.23Å; G257-A260 PolarHBondContact O-N 3.24Å; A258-A260 VanDerWaalsContact C-N 3.29Å; A258-A260 PolarHBondContact O-N 3.02Å; A260-F291 VanDerWaalsContact O-CE2 3.26Å; A260-F291 WeakPolarHBondContact O-CE2 3.37Å; A260-A294 HydrophobicContact CB-CB 3.92Å; A260-V298 HydrophobicContact CB-CG2 4.12Å
261	R	96.1	Very high	95.1	Very high	44 Å²	44	18.5 Å²	18.5	17%	0.166	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	-122	-24	-177.6	-67.3	-63.5	176.6	-91.1	-1.5	113.9	E78 M93 V127 I146 G257 A258 R259 A263 L264 T265	E78-R261 IonicContact OE1-CZ 2.8Å; E78-R261 IonicContact OE1-NE 3.96Å; E78-R261 PolarHBondContact OE1-NE 3.34Å; E78-R261 IonicContact OE1-NH2 2.64Å; E78-R261 PolarHBondContact OE1-NH2 3.15Å; E78-R261 IonicContact OE2-NE 3.53Å; E78-R261 PolarHBondContact OE2-NE 3.31Å; M93-R261 HydrophobicContact CE-CG 4.19Å; M93-R261 HydrophobicContact SD-CB 4.3Å; M93-R261 HydrophobicContact SD-CG 4.06Å; V127-R261 HydrophobicContact CG2-CB 3.55Å; I146-R261 HydrophobicContact CD1-CB 4.16Å; I146-R261 HydrophobicContact CD1-CG 4.46Å; G257-R261 WeakPolarHBondContact O-CG 3.07Å; G257-R261 PolarHBondContact O-N 3.15Å; A258-R261 PolarHBondContact O-N 3.45Å; R259-R261 PolarHBondContact O-N 3.49Å; R261-A263 PolarHBondContact O-N 2.72Å; R261-A263 VanDerWaalsContact O-N 3.16Å; R261-L264 WeakPolarHBondContact O-CA 3.33Å; R261-L264 VanDerWaalsContact O-CB 3.24Å; R261-L264 WeakPolarHBondContact O-CB 3.16Å; R261-L264 PolarHBondContact O-N 2.83Å; R261-T265 PolarHBondContact O-N 3.29Å; R261-T265 VanDerWaalsContact O-N 3.17Å
262	V	96.9	Very high	95.3	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-62.4	-29.3	-172.8	74.1	0	0	0	0	114.4	V127 V216 V248 A258 L264 T265 G266	V127-V262 HydrophobicContact CB-CB 4.32Å; V127-V262 HydrophobicContact CB-CG2 4.48Å; V127-V262 HydrophobicContact CG2-CB 4.33Å; V216-V262 HydrophobicContact CB-CG1 4.05Å; V216-V262 HydrophobicContact CG1-CG1 3.98Å; V216-V262 HydrophobicContact CG2-CG1 3.77Å; V248-V262 HydrophobicContact CB-CG2 4.48Å; V248-V262 HydrophobicContact CG1-CG2 3.47Å; V248-V262 VanDerWaalsContact CG1-CG2 3.47Å; A258-V262 WeakPolarHBondContact O-CB 3.14Å; A258-V262 PolarHBondContact O-N 2.84Å; V262-L264 VanDerWaalsContact C-N 3.28Å; V262-L264 PolarHBondContact O-N 3.17Å; V262-T265 WeakPolarHBondContact O-CB 3.24Å; V262-T265 PolarHBondContact O-N 2.82Å; V262-G266 PolarHBondContact O-N 3.47Å
263	A	96.8	Very high	95.5	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-59.8	-40.1	171.1	0	0	0	0	0	111.7	V216 R261 G266 L267 F291	V216-A263 HydrophobicContact CG2-CB 3.84Å; R261-A263 PolarHBondContact O-N 2.72Å; R261-A263 VanDerWaalsContact O-N 3.16Å; A263-G266 PolarHBondContact O-N 3.05Å; A263-L267 VanDerWaalsContact O-CB 3.27Å; A263-L267 WeakPolarHBondContact O-CB 3.32Å; A263-L267 PolarHBondContact O-N 3.32Å; A263-F291 HydrophobicContact CB-CD2 3.88Å; A263-F291 HydrophobicContact CB-CE2 4.35Å
264	L	97.5	Very high	95.7	Very high	9 Å²	9	8.6 Å²	8.6	5%	0.047	4%	0.041	C	C	.	.	H	α-helix	trans	-68.5	-36.9	176.7	-52.2	180	0	0	0	111.2	I146 R261 V262 L267 T268 M322	I146-L264 HydrophobicContact CB-CB 4.31Å; R261-L264 WeakPolarHBondContact O-CA 3.33Å; R261-L264 VanDerWaalsContact O-CB 3.24Å; R261-L264 WeakPolarHBondContact O-CB 3.16Å; R261-L264 PolarHBondContact O-N 2.83Å; V262-L264 VanDerWaalsContact C-N 3.28Å; V262-L264 PolarHBondContact O-N 3.17Å; L264-L267 PolarHBondContact O-N 3.27Å; L264-T268 WeakPolarHBondContact O-CB 3.48Å; L264-T268 PolarHBondContact O-N 2.82Å; L264-T268 PolarHBondContact O-OG1 2.78Å; L264-M322 HydrophobicContact CD2-CB 3.82Å; L264-M322 HydrophobicContact CD2-CG 3.65Å
265	T	97.8	Very high	95.7	Very high	0 Å²	0	9.2 Å²	9.2	0%	0	5%	0.045	C	C	.	.	H	α-helix	trans	-59.7	-52.1	174	-57.1	0	0	0	0	110.9	I114 M125 V127 V248 R261 V262 L267 T268 V269	I114-T265 HydrophobicContact CD1-CG2 3.61Å; I114-T265 VanDerWaalsContact CD1-O 3.28Å; I114-T265 WeakPolarHBondContact CD1-O 3.26Å; I114-T265 HydrophobicContact CG2-CG2 4.12Å; M125-T265 HydrophobicContact SD-CG2 4.5Å; V127-T265 PolarHBondContact O-OG1 3.36Å; V248-T265 HydrophobicContact CG1-CG2 3.48Å; V248-T265 VanDerWaalsContact CG1-CG2 3.48Å; R261-T265 PolarHBondContact O-N 3.29Å; R261-T265 VanDerWaalsContact O-N 3.17Å; V262-T265 WeakPolarHBondContact O-CB 3.24Å; V262-T265 PolarHBondContact O-N 2.82Å; T265-L267 PolarHBondContact O-N 3.33Å; T265-T268 PolarHBondContact O-N 2.92Å; T265-V269 PolarHBondContact O-N 2.88Å
266	G	97	Very high	95.7	Very high	0 Å²	0	12 Å²	12	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-60.8	-43.3	175.7	0	0	0	0	0	112.8	V212 V262 A263 T268 V269 A270	V212-G266 WeakPolarHBondContact CG1-O 3.39Å; V262-G266 PolarHBondContact O-N 3.47Å; A263-G266 PolarHBondContact O-N 3.05Å; G266-T268 VanDerWaalsContact C-N 3.31Å; G266-T268 PolarHBondContact O-N 2.9Å; G266-V269 PolarHBondContact O-N 2.79Å; G266-A270 PolarHBondContact O-N 2.75Å; G266-A270 VanDerWaalsContact O-N 3.09Å
267	L	97.5	Very high	95.5	Very high	0 Å²	0	15 Å²	15	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-60.3	-41.1	176	179.4	55.3	0	0	0	112.2	A263 L264 T265 V269 A270 E271 L283 M322 R325 I326 I334	A263-L267 VanDerWaalsContact O-CB 3.27Å; A263-L267 WeakPolarHBondContact O-CB 3.32Å; A263-L267 PolarHBondContact O-N 3.32Å; L264-L267 PolarHBondContact O-N 3.27Å; T265-L267 PolarHBondContact O-N 3.33Å; L267-V269 VanDerWaalsContact C-N 3.3Å; L267-V269 PolarHBondContact O-N 2.8Å; L267-A270 CarbonylContact O-C 3.57Å; L267-A270 WeakPolarHBondContact O-CA 3.37Å; L267-A270 WeakPolarHBondContact O-CB 3.43Å; L267-A270 PolarHBondContact O-N 2.85Å; L267-E271 HydrophobicContact CD1-CG 4.16Å; L267-E271 HydrophobicContact CG-CG 4.32Å; L267-E271 VanDerWaalsContact O-CG 3.28Å; L267-E271 WeakPolarHBondContact O-CG 3.47Å; L267-E271 PolarHBondContact O-N 2.88Å; L267-L283 HydrophobicContact CB-CD2 4.23Å; L267-L283 HydrophobicContact CD1-CD2 3.66Å; L267-M322 HydrophobicContact CD2-CG 3.94Å; L267-M322 HydrophobicContact CD2-SD 4.14Å; L267-R325 HydrophobicContact CD2-CB 3.63Å; L267-R325 HydrophobicContact CD2-CG 4.46Å; L267-R325 HydrophobicContact CG-CB 4.34Å; L267-I326 HydrophobicContact CD1-CG1 3.72Å; L267-I326 HydrophobicContact CD2-CG1 4.31Å; L267-I334 HydrophobicContact CD1-CD1 4.02Å
268	T	97.9	Very high	95.3	Very high	1 Å²	1	16.5 Å²	16.5	1%	0.006	9%	0.09	C	C	.	.	H	α-helix	trans	-63.8	-35.5	179	-57.9	0	0	0	0	112.3	I114 V116 A145 I146 L264 T265 G266 Y272 R325	I114-T268 HydrophobicContact CD1-CG2 3.95Å; I114-T268 HydrophobicContact CG1-CG2 4.14Å; V116-T268 HydrophobicContact CG1-CG2 4.23Å; A145-T268 WeakPolarHBondContact O-CG2 3.38Å; I146-T268 WeakPolarHBondContact CA-OG1 3.44Å; I146-T268 PolarHBondContact O-OG1 3.09Å; L264-T268 WeakPolarHBondContact O-CB 3.48Å; L264-T268 PolarHBondContact O-N 2.82Å; L264-T268 PolarHBondContact O-OG1 2.78Å; T265-T268 PolarHBondContact O-N 2.92Å; G266-T268 VanDerWaalsContact C-N 3.31Å; G266-T268 PolarHBondContact O-N 2.9Å; T268-Y272 PolarHBondContact O-N 3.14Å; T268-R325 PolarHBondContact OG1-NH2 3.43Å
269	V	97.1	Very high	95	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-65.8	-42.8	171.8	177.9	0	0	0	0	110.5	I114 M125 V212 A246 T265 G266 L267 Y272 F273	I114-V269 HydrophobicContact CD1-CG2 3.81Å; M125-V269 HydrophobicContact CE-CG2 3.89Å; M125-V269 HydrophobicContact SD-CG2 4.06Å; V212-V269 HydrophobicContact CG1-CB 4.24Å; V212-V269 HydrophobicContact CG1-CG1 4.34Å; V212-V269 HydrophobicContact CG2-CB 4.38Å; V212-V269 HydrophobicContact CG2-CG1 3.91Å; A246-V269 HydrophobicContact CB-CG1 3.97Å; T265-V269 PolarHBondContact O-N 2.88Å; G266-V269 PolarHBondContact O-N 2.79Å; L267-V269 VanDerWaalsContact C-N 3.3Å; L267-V269 PolarHBondContact O-N 2.8Å; V269-Y272 WeakPolarHBondContact O-CB 3.48Å; V269-Y272 PolarHBondContact O-N 3Å; V269-F273 HydrophobicContact CG1-CD2 4.35Å; V269-F273 HydrophobicContact CG1-CE2 3.83Å; V269-F273 WeakPolarHBondContact O-CD2 3.39Å
270	A	96.4	Very high	94.8	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-65.2	-40.7	177.8	0	0	0	0	0	112.5	V212 G266 L267 Y272 F273 R274 V281 L283 I334	V212-A270 HydrophobicContact CB-CB 4.28Å; V212-A270 HydrophobicContact CG2-CB 3.94Å; G266-A270 PolarHBondContact O-N 2.75Å; G266-A270 VanDerWaalsContact O-N 3.09Å; L267-A270 CarbonylContact O-C 3.57Å; L267-A270 WeakPolarHBondContact O-CA 3.37Å; L267-A270 WeakPolarHBondContact O-CB 3.43Å; L267-A270 PolarHBondContact O-N 2.85Å; A270-Y272 VanDerWaalsContact C-N 3.3Å; A270-Y272 PolarHBondContact O-N 3.33Å; A270-F273 PolarHBondContact O-N 3.18Å; A270-F273 VanDerWaalsContact O-N 3.15Å; A270-R274 PolarHBondContact O-N 3.48Å; A270-V281 HydrophobicContact CB-CG1 3.95Å; A270-L283 HydrophobicContact CB-CD1 4.35Å; A270-I334 HydrophobicContact CB-CD1 4Å; A270-I334 HydrophobicContact CB-CG1 4.27Å; A270-I334 HydrophobicContact CB-CG2 4.42Å
271	E	96.4	Very high	94.7	Very high	11 Å²	11	22 Å²	22	5%	0.051	12%	0.118	C	C	.	.	H	α-helix	trans	-60.2	-38.3	176.5	-72.4	175	150.2	0	0	112.3	L267 F273 R274 D275 R325 I334	L267-E271 HydrophobicContact CD1-CG 4.16Å; L267-E271 HydrophobicContact CG-CG 4.32Å; L267-E271 VanDerWaalsContact O-CG 3.28Å; L267-E271 WeakPolarHBondContact O-CG 3.47Å; L267-E271 PolarHBondContact O-N 2.88Å; E271-F273 VanDerWaalsContact C-N 3.33Å; E271-F273 PolarHBondContact O-N 3.4Å; E271-R274 PolarHBondContact O-N 2.83Å; E271-R274 IonicContact OE1-NH2 3.07Å; E271-D275 VanDerWaalsContact O-CB 3.31Å; E271-D275 WeakPolarHBondContact O-CB 3.31Å; E271-D275 PolarHBondContact O-N 3.46Å; E271-R325 WeakPolarHBondContact OE1-CB 3.4Å; E271-R325 IonicContact OE1-CZ 3.72Å; E271-R325 IonicContact OE1-NE 3.57Å; E271-R325 PolarHBondContact OE1-NE 3.17Å; E271-R325 IonicContact OE1-NH2 2.74Å; E271-R325 PolarHBondContact OE1-NH2 3.5Å; E271-R325 IonicContact OE2-CZ 3.33Å; E271-R325 IonicContact OE2-NE 2.86Å; E271-R325 IonicContact OE2-NH2 3.24Å; E271-R325 PolarHBondContact OE2-NH2 3.23Å; E271-I334 HydrophobicContact CB-CD1 4.49Å; E271-I334 HydrophobicContact CG-CD1 3.81Å
272	Y	95.9	Very high	94.5	Very high	18 Å²	18	20.4 Å²	20.4	7%	0.071	11%	0.113	C	C	.	.	H	α-helix	trans	-56.6	-48.8	173.8	172.8	-82.2	0	0	0	111.5	V116 R142 T268 V269 A270 R274 D275 V276 E277	V116-Y272 HydrophobicContact CB-CD2 3.89Å; V116-Y272 HydrophobicContact CB-CG 3.9Å; V116-Y272 HydrophobicContact CG2-CD2 3.5Å; V116-Y272 VanDerWaalsContact CG2-CD2 3.5Å; V116-Y272 HydrophobicContact CG2-CE2 4.14Å; V116-Y272 HydrophobicContact CG2-CG 4.05Å; R142-Y272 HydrophobicContact CB-CE2 4.39Å; R142-Y272 VanDerWaalsContact CD-CE2 3.49Å; R142-Y272 PolarHBondContact NH1-OH 3.46Å; T268-Y272 PolarHBondContact O-N 3.14Å; V269-Y272 WeakPolarHBondContact O-CB 3.48Å; V269-Y272 PolarHBondContact O-N 3Å; A270-Y272 VanDerWaalsContact C-N 3.3Å; A270-Y272 PolarHBondContact O-N 3.33Å; Y272-R274 VanDerWaalsContact C-N 3.33Å; Y272-R274 PolarHBondContact O-N 3.29Å; Y272-D275 PolarHBondContact O-N 3.11Å; Y272-V276 HydrophobicContact CD2-CB 4.07Å; Y272-V276 HydrophobicContact CD2-CG2 3.79Å; Y272-V276 HydrophobicContact CE1-CB 4.49Å; Y272-V276 HydrophobicContact CE2-CB 3.9Å; Y272-V276 HydrophobicContact CE2-CG1 3.89Å; Y272-V276 HydrophobicContact CE2-CG2 3.95Å; Y272-V276 HydrophobicContact CG-CB 4.49Å; Y272-V276 HydrophobicContact CG-CG2 4.41Å; Y272-V276 WeakPolarHBondContact O-CA 3.48Å; Y272-V276 VanDerWaalsContact O-CB 3.24Å; Y272-V276 WeakPolarHBondContact O-CB 3.49Å; Y272-V276 PolarHBondContact O-N 2.94Å; Y272-E277 HydrophobicContact CD1-CG 4.28Å; Y272-E277 HydrophobicContact CE1-CG 3.53Å; Y272-E277 WeakPolarHBondContact CE1-OE1 3.09Å; Y272-E277 PolarHBondContact O-N 3.3Å; Y272-E277 PolarHBondContact OH-OE1 3.14Å
273	F	94.4	Very high	94.5	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-67.7	-35.1	-178.9	-68.7	-65.9	0	0	0	111.6	P118 L121 Y210 V269 A270 E271 E277 G278 Q279 V281	P118-F273 HydrophobicContact CG-CE1 4.46Å; L121-F273 HydrophobicContact CD1-CE1 4.31Å; L121-F273 HydrophobicContact CD1-CZ 4.17Å; L121-F273 HydrophobicContact CD2-CE2 4.14Å; L121-F273 HydrophobicContact CD2-CZ 3.77Å; L121-F273 HydrophobicContact CG-CE1 4.5Å; L121-F273 HydrophobicContact CG-CZ 3.86Å; Y210-F273 HydrophobicContact CD2-CB 4.39Å; Y210-F273 AromaticContact CD2-CD1 3.5Å; Y210-F273 HydrophobicContact CD2-CD1 3.5Å; Y210-F273 AromaticContact CD2-CE1 3.91Å; Y210-F273 HydrophobicContact CD2-CE1 3.91Å; Y210-F273 AromaticContact CD2-CG 3.99Å; Y210-F273 HydrophobicContact CD2-CG 3.99Å; Y210-F273 AromaticContact CE2-CD1 3.84Å; Y210-F273 HydrophobicContact CE2-CD1 3.84Å; Y210-F273 HydrophobicContact CE2-CE1 4.02Å; Y210-F273 HydrophobicContact CG-CD1 4.24Å; Y210-F273 HydrophobicContact CG-CE1 4.38Å; V269-F273 HydrophobicContact CG1-CD2 4.35Å; V269-F273 HydrophobicContact CG1-CE2 3.83Å; V269-F273 WeakPolarHBondContact O-CD2 3.39Å; A270-F273 PolarHBondContact O-N 3.18Å; A270-F273 VanDerWaalsContact O-N 3.15Å; E271-F273 VanDerWaalsContact C-N 3.33Å; E271-F273 PolarHBondContact O-N 3.4Å; F273-E277 HydrophobicContact CD1-CG 4.11Å; F273-E277 CarbonylContact O-C 3.53Å; F273-E277 WeakPolarHBondContact O-CB 3.34Å; F273-G278 PolarHBondContact O-N 3.08Å; F273-G278 VanDerWaalsContact O-N 3.14Å; F273-Q279 PolarHBondContact O-N 2.79Å; F273-V281 HydrophobicContact CB-CG2 3.48Å; F273-V281 VanDerWaalsContact CB-CG2 3.48Å
274	R	93.5	Very high	94.4	Very high	3 Å²	3	20.4 Å²	20.4	1%	0.011	11%	0.113	C	C	.	.	H	α-helix	trans	-65.5	-52.1	173.4	-175.4	-167.3	60.7	-153.6	-7.2	112.6	A270 E271 Y272 G278 R325 I334	A270-R274 PolarHBondContact O-N 3.48Å; E271-R274 PolarHBondContact O-N 2.83Å; E271-R274 IonicContact OE1-NH2 3.07Å; Y272-R274 VanDerWaalsContact C-N 3.33Å; Y272-R274 PolarHBondContact O-N 3.29Å; R274-G278 VanDerWaalsContact O-CA 3.26Å; R274-G278 WeakPolarHBondContact O-CA 2.97Å; R274-G278 PolarHBondContact O-N 3.46Å; R274-R325 PolarHBondContact NH1-O 2.84Å; R274-I334 HydrophobicContact CB-CD1 4.23Å; R274-I334 HydrophobicContact CB-CG1 3.97Å; R274-I334 HydrophobicContact CG-CG1 4.31Å
275	D	93.6	Very high	94.3	Very high	46 Å²	46	20 Å²	20	25%	0.246	11%	0.11	C	C	.	.	H	α-helix	trans	-93.2	-30.9	-163.1	-64	-32.5	0	0	0	113.7	E271 Y272 K331	E271-D275 VanDerWaalsContact O-CB 3.31Å; E271-D275 WeakPolarHBondContact O-CB 3.31Å; E271-D275 PolarHBondContact O-N 3.46Å; Y272-D275 PolarHBondContact O-N 3.11Å; D275-K331 WeakPolarHBondContact O-CD 3.47Å; D275-K331 PolarHBondContact O-NZ 3.39Å
276	V	92.6	Very high	94	Very high	82 Å²	82	20.5 Å²	20.5	50%	0.497	11%	0.113	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.7	-46.4	-178.1	-173	0	0	0	0	111	Y272	Y272-V276 HydrophobicContact CD2-CB 4.07Å; Y272-V276 HydrophobicContact CD2-CG2 3.79Å; Y272-V276 HydrophobicContact CE1-CB 4.49Å; Y272-V276 HydrophobicContact CE2-CB 3.9Å; Y272-V276 HydrophobicContact CE2-CG1 3.89Å; Y272-V276 HydrophobicContact CE2-CG2 3.95Å; Y272-V276 HydrophobicContact CG-CB 4.49Å; Y272-V276 HydrophobicContact CG-CG2 4.41Å; Y272-V276 WeakPolarHBondContact O-CA 3.48Å; Y272-V276 VanDerWaalsContact O-CB 3.24Å; Y272-V276 WeakPolarHBondContact O-CB 3.49Å; Y272-V276 PolarHBondContact O-N 2.94Å
277	E	90.8	Very high	93.6	Very high	77 Å²	77	21 Å²	21	36%	0.36	12%	0.116	S	C	.	.	S	Bend	trans	-91.2	-10.7	-179.5	-55.9	-66	159.6	0	0	113.2	R142 Y272 F273 Q279	R142-E277 IonicContact NH1-OE1 3.92Å; Y272-E277 HydrophobicContact CD1-CG 4.28Å; Y272-E277 HydrophobicContact CE1-CG 3.53Å; Y272-E277 WeakPolarHBondContact CE1-OE1 3.09Å; Y272-E277 PolarHBondContact O-N 3.3Å; Y272-E277 PolarHBondContact OH-OE1 3.14Å; F273-E277 HydrophobicContact CD1-CG 4.11Å; F273-E277 CarbonylContact O-C 3.53Å; F273-E277 WeakPolarHBondContact O-CB 3.34Å; E277-Q279 VanDerWaalsContact C-N 3.31Å; E277-Q279 HydrophobicContact CB-CG 3.87Å; E277-Q279 PolarHBondContact O-N 2.62Å; E277-Q279 PolarHBondContact O-NE2 3.09Å
278	G	89.9	Confident	93.4	Very high	32 Å²	32	21 Å²	21	33%	0.33	12%	0.116	S	C	.	.			trans	64.1	34.5	179.4	0	0	0	0	0	113.5	F273 R274 K331	F273-G278 PolarHBondContact O-N 3.08Å; F273-G278 VanDerWaalsContact O-N 3.14Å; R274-G278 VanDerWaalsContact O-CA 3.26Å; R274-G278 WeakPolarHBondContact O-CA 2.97Å; R274-G278 PolarHBondContact O-N 3.46Å; G278-K331 CarbonylContact C-O 3.46Å; G278-K331 VanDerWaalsContact C-O 3.26Å; G278-K331 VanDerWaalsContact CA-O 3.24Å; G278-K331 WeakPolarHBondContact CA-O 3.46Å
279	Q	88.7	Confident	93.1	Very high	75 Å²	75	21.9 Å²	21.9	35%	0.35	12%	0.12	S	C	.	.			trans	-99.7	155.7	-176.4	-63.8	-63.5	-47.5	0	0	111.8	Y210 F273 E277 V281 S333	Y210-Q279 HydrophobicContact CD2-CB 4.39Å; Y210-Q279 HydrophobicContact CD2-CG 4.14Å; Y210-Q279 HydrophobicContact CE2-CG 4.15Å; F273-Q279 PolarHBondContact O-N 2.79Å; E277-Q279 VanDerWaalsContact C-N 3.31Å; E277-Q279 HydrophobicContact CB-CG 3.87Å; E277-Q279 PolarHBondContact O-N 2.62Å; E277-Q279 PolarHBondContact O-NE2 3.09Å; Q279-V281 HydrophobicContact CB-CG2 4.41Å; Q279-S333 PolarHBondContact O-N 3.25Å
280	D	89.8	Confident	92.8	Very high	64 Å²	64	24.9 Å²	24.9	34%	0.342	13%	0.131	S	C	.	.			trans	-86.5	123.2	164.8	-62.4	-51.2	0	0	0	109.4	K178 S333	K178-D280 WeakPolarHBondContact CE-OD1 3.46Å; K178-D280 WeakPolarHBondContact CE-OD2 3.14Å; K178-D280 VanDerWaalsContact NZ-CG 3.32Å; K178-D280 IonicContact NZ-OD1 3.69Å; K178-D280 PolarHBondContact NZ-OD1 2.92Å; K178-D280 IonicContact NZ-OD2 2.8Å; K178-D280 PolarHBondContact NZ-OD2 3.35Å; D280-S333 WeakPolarHBondContact CA-O 3.43Å; D280-S333 WeakPolarHBondContact OD1-CB 3.49Å; D280-S333 PolarHBondContact OD1-N 3.25Å; D280-S333 PolarHBondContact OD1-OG 2.69Å
281	V	92.2	Very high	92.7	Very high	1 Å²	1	25.5 Å²	25.5	1%	0.006	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	136.6	-170.2	-169.9	0	0	0	0	109.5	Y210 V212 A270 F273 Q279 S333 I334 T335	Y210-V281 VanDerWaalsContact O-CA 3.32Å; Y210-V281 WeakPolarHBondContact O-CA 3.34Å; Y210-V281 WeakPolarHBondContact O-CG1 3.34Å; V212-V281 HydrophobicContact CG2-CG1 4.14Å; A270-V281 HydrophobicContact CB-CG1 3.95Å; F273-V281 HydrophobicContact CB-CG2 3.48Å; F273-V281 VanDerWaalsContact CB-CG2 3.48Å; Q279-V281 HydrophobicContact CB-CG2 4.41Å; V281-S333 PolarHBondContact N-O 3.18Å; V281-I334 HydrophobicContact CB-CG1 4.47Å; V281-I334 WeakPolarHBondContact O-CA 3.3Å; V281-T335 PolarHBondContact O-N 3.47Å
282	L	92.9	Very high	92.6	Very high	9 Å²	9	25 Å²	25	5%	0.047	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	123.3	166	-70.9	175.9	0	0	0	110.6	L163 V203 Y210 S211 V212 F284 T335	L163-L282 HydrophobicContact CD2-CD2 3.8Å; V203-L282 HydrophobicContact CB-CD1 3.47Å; V203-L282 VanDerWaalsContact CB-CD1 3.47Å; V203-L282 HydrophobicContact CG1-CD1 3.52Å; V203-L282 HydrophobicContact CG1-CG 4.12Å; V203-L282 HydrophobicContact CG2-CD1 3.56Å; Y210-L282 PolarHBondContact O-N 2.67Å; S211-L282 CarbonylContact C-O 3.51Å; S211-L282 VanDerWaalsContact CA-O 3.28Å; S211-L282 WeakPolarHBondContact CA-O 3.28Å; V212-L282 PolarHBondContact N-O 3.46Å; L282-F284 HydrophobicContact CB-CD2 4.28Å; L282-F284 HydrophobicContact CB-CE2 3.47Å; L282-F284 VanDerWaalsContact CB-CE2 3.47Å; L282-F284 HydrophobicContact CB-CZ 4.02Å; L282-F284 HydrophobicContact CD1-CE2 4.03Å; L282-F284 HydrophobicContact CD1-CZ 3.88Å; L282-F284 HydrophobicContact CG-CE2 4.39Å; L282-T335 CarbonylContact C-O 3.54Å; L282-T335 VanDerWaalsContact CA-O 3.31Å; L282-T335 WeakPolarHBondContact CA-O 3.07Å; L282-T335 HydrophobicContact CD2-CG2 3.93Å
283	L	95.7	Very high	92.4	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	118.3	173.3	177	65.2	0	0	0	109.9	V212 L267 A270 I285 I326 I334 T335 S336 V337	V212-L283 HydrophobicContact CB-CD1 4.07Å; V212-L283 HydrophobicContact CG1-CD1 4.15Å; V212-L283 CarbonylContact O-C 3.48Å; V212-L283 WeakPolarHBondContact O-CA 3.43Å; L267-L283 HydrophobicContact CB-CD2 4.23Å; L267-L283 HydrophobicContact CD1-CD2 3.66Å; A270-L283 HydrophobicContact CB-CD1 4.35Å; L283-I285 HydrophobicContact CD2-CD1 4.02Å; L283-I285 HydrophobicContact CD2-CG1 4.34Å; L283-I285 HydrophobicContact CG-CD1 4.32Å; L283-I285 HydrophobicContact CG-CG1 4.11Å; L283-I326 HydrophobicContact CD2-CD1 3.93Å; L283-I326 HydrophobicContact CD2-CG1 4.03Å; L283-I334 HydrophobicContact CB-CG2 3.61Å; L283-I334 HydrophobicContact CD2-CG2 4.14Å; L283-T335 PolarHBondContact N-O 3.26Å; L283-S336 CarbonylContact O-C 3.59Å; L283-S336 WeakPolarHBondContact O-CA 3.41Å; L283-V337 PolarHBondContact O-N 2.88Å
284	F	94.7	Very high	92.3	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	127.5	174.5	-63.5	-89.7	0	0	0	109.4	I196 L199 I200 V212 F213 A214 L282 V337	I196-F284 HydrophobicContact CB-CD1 4.19Å; I196-F284 HydrophobicContact CB-CE1 4.39Å; I196-F284 HydrophobicContact CG1-CD1 4.11Å; I196-F284 HydrophobicContact CG2-CB 4.34Å; I196-F284 HydrophobicContact CG2-CD1 3.38Å; I196-F284 HydrophobicContact CG2-CE1 3.8Å; I196-F284 HydrophobicContact CG2-CG 3.94Å; L199-F284 HydrophobicContact CB-CE1 4.15Å; L199-F284 HydrophobicContact CB-CZ 4.15Å; L199-F284 HydrophobicContact CD1-CE1 4.5Å; I200-F284 HydrophobicContact CB-CE2 4.43Å; I200-F284 HydrophobicContact CB-CZ 4.45Å; I200-F284 HydrophobicContact CD1-CD2 3.85Å; I200-F284 HydrophobicContact CD1-CE2 3.84Å; I200-F284 HydrophobicContact CD1-CG 4.23Å; I200-F284 HydrophobicContact CD1-CZ 4.17Å; I200-F284 HydrophobicContact CG1-CD2 3.73Å; I200-F284 HydrophobicContact CG1-CE1 4.03Å; I200-F284 HydrophobicContact CG1-CE2 3.16Å; I200-F284 HydrophobicContact CG1-CG 4.37Å; I200-F284 HydrophobicContact CG1-CZ 3.32Å; V212-F284 PolarHBondContact O-N 2.93Å; F213-F284 HydrophobicContact CB-CB 4.5Å; F213-F284 HydrophobicContact CD2-CB 3.58Å; F213-F284 HydrophobicContact CD2-CG 4.36Å; F213-F284 HydrophobicContact CE2-CB 4.17Å; F213-F284 HydrophobicContact CG-CB 4.35Å; A214-F284 PolarHBondContact N-O 3.46Å; L282-F284 HydrophobicContact CB-CD2 4.28Å; L282-F284 HydrophobicContact CB-CE2 3.47Å; L282-F284 VanDerWaalsContact CB-CE2 3.47Å; L282-F284 HydrophobicContact CB-CZ 4.02Å; L282-F284 HydrophobicContact CD1-CE2 4.03Å; L282-F284 HydrophobicContact CD1-CZ 3.88Å; L282-F284 HydrophobicContact CG-CE2 4.39Å; F284-V337 WeakPolarHBondContact CA-O 3.14Å; F284-V337 HydrophobicContact CD1-CB 3.63Å; F284-V337 HydrophobicContact CD1-CG1 4.09Å; F284-V337 HydrophobicContact CD1-CG2 4.29Å; F284-V337 HydrophobicContact CE1-CB 3.7Å; F284-V337 HydrophobicContact CE1-CG1 4.13Å; F284-V337 HydrophobicContact CE1-CG2 3.87Å
285	I	95	Very high	92.3	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	103.4	174.9	-60.6	167.5	0	0	0	107.7	A214 V216 L283 I288 M322 I326 V337 Q338 A339	A214-I285 HydrophobicContact CB-CG1 4.35Å; A214-I285 WeakPolarHBondContact O-CA 3.47Å; V216-I285 HydrophobicContact CG2-CG2 3.84Å; L283-I285 HydrophobicContact CD2-CD1 4.02Å; L283-I285 HydrophobicContact CD2-CG1 4.34Å; L283-I285 HydrophobicContact CG-CD1 4.32Å; L283-I285 HydrophobicContact CG-CG1 4.11Å; I285-I288 HydrophobicContact CG2-CB 4.17Å; I285-I288 HydrophobicContact CG2-CD1 4.24Å; I285-M322 HydrophobicContact CD1-CE 4.24Å; I285-M322 HydrophobicContact CD1-SD 4.04Å; I285-I326 HydrophobicContact CD1-CD1 4.21Å; I285-V337 PolarHBondContact N-O 2.98Å; I285-Q338 HydrophobicContact CB-CB 4.45Å; I285-Q338 HydrophobicContact CB-CG 4.26Å; I285-Q338 HydrophobicContact CD1-CG 4.2Å; I285-Q338 CarbonylContact O-C 3.57Å; I285-Q338 WeakPolarHBondContact O-CA 3.37Å; I285-A339 PolarHBondContact O-N 2.77Å
286	D	91.6	Very high	92.3	Very high	12 Å²	12	26.2 Å²	26.2	6%	0.064	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	108.4	168.7	-157.6	-4.2	0	0	0	107.5	F213 A214 G215 V216 E218 A339	F213-D286 HydrophobicContact CZ-CB 4.04Å; A214-D286 PolarHBondContact O-N 3.1Å; A214-D286 VanDerWaalsContact O-N 3.13Å; G215-D286 CarbonylContact C-O 3.57Å; G215-D286 VanDerWaalsContact CA-O 3.24Å; G215-D286 WeakPolarHBondContact CA-O 2.95Å; V216-D286 PolarHBondContact N-O 2.92Å; E218-D286 VanDerWaalsContact CG-O 3.26Å; E218-D286 WeakPolarHBondContact CG-O 3.49Å; E218-D286 VanDerWaalsContact OE1-C 3.24Å; E218-D286 WeakPolarHBondContact OE1-CB 3.43Å; D286-A339 HydrophobicContact CB-CB 4.16Å; D286-A339 WeakPolarHBondContact OD1-CB 3.24Å
287	N	89.3	Confident	92.3	Very high	11 Å²	11	25.3 Å²	25.3	6%	0.059	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	cis	-123.3	134.3	3.3	-158.6	-78.4	0	0	0	112.3	V216 F289 R290 F291 A339 Y341	V216-N287 PolarHBondContact O-N 2.81Å; V216-N287 VanDerWaalsContact O-N 3.12Å; N287-F289 PolarHBondContact O-N 3.5Å; N287-F289 WeakPolarHBondContact OD1-CB 2.93Å; N287-F289 PolarHBondContact OD1-N 3.27Å; N287-R290 HydrophobicContact CB-CB 4.42Å; N287-R290 HydrophobicContact CB-CG 3.96Å; N287-R290 WeakPolarHBondContact O-CB 3.34Å; N287-R290 PolarHBondContact O-N 2.91Å; N287-F291 PolarHBondContact O-N 3.48Å; N287-A339 VanDerWaalsContact ND2-C 3.34Å; N287-A339 VanDerWaalsContact ND2-CB 3.34Å; N287-A339 WeakPolarHBondContact ND2-CB 3.36Å; N287-A339 PolarHBondContact ND2-O 3.34Å; N287-A339 VanDerWaalsContact ND2-O 3.12Å; N287-A339 PolarHBondContact OD1-O 3.4Å; N287-Y341 PolarHBondContact OD1-N 3.39Å
288	I	92.9	Very high	92.4	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-65.5	-26.5	179.3	-168.7	61.2	0	0	0	112.3	I285 R290 F291 T292 M319 M322 Q338 A339 I340 T355	I285-I288 HydrophobicContact CG2-CB 4.17Å; I285-I288 HydrophobicContact CG2-CD1 4.24Å; I288-R290 PolarHBondContact O-N 2.83Å; I288-F291 HydrophobicContact CD1-CB 4.01Å; I288-F291 HydrophobicContact CD1-CD1 4.03Å; I288-F291 HydrophobicContact CD1-CG 4.2Å; I288-F291 WeakPolarHBondContact O-CB 3.13Å; I288-F291 PolarHBondContact O-N 3.32Å; I288-T292 PolarHBondContact O-N 2.92Å; I288-M319 HydrophobicContact CD1-CE 4.27Å; I288-M319 HydrophobicContact CD1-SD 4.06Å; I288-M319 HydrophobicContact CG1-CE 3.99Å; I288-M319 HydrophobicContact CG1-SD 4.03Å; I288-M322 HydrophobicContact CD1-CE 3.23Å; I288-M322 HydrophobicContact CG1-CE 4.35Å; I288-Q338 HydrophobicContact CB-CB 4.39Å; I288-Q338 HydrophobicContact CG2-CB 4.3Å; I288-A339 WeakPolarHBondContact CG2-O 3.34Å; I288-A339 PolarHBondContact N-O 2.81Å; I288-I340 HydrophobicContact CG2-CB 4.32Å; I288-I340 HydrophobicContact CG2-CD1 4.35Å; I288-I340 HydrophobicContact CG2-CG1 3.35Å; I288-T355 HydrophobicContact CG1-CG2 4.47Å; I288-T355 HydrophobicContact CG2-CG2 4.06Å
289	F	91.5	Very high	92.5	Very high	18 Å²	18	20.8 Å²	20.8	8%	0.079	10%	0.104	C	C	.	.	H	α-helix	trans	-62.3	-35.1	171.8	-179.6	-97.3	0	0	0	111.8	N287 F291 T292 Q293 Y341 P343 A351	N287-F289 PolarHBondContact O-N 3.5Å; N287-F289 WeakPolarHBondContact OD1-CB 2.93Å; N287-F289 PolarHBondContact OD1-N 3.27Å; F289-F291 VanDerWaalsContact C-N 3.34Å; F289-T292 WeakPolarHBondContact O-CB 3.45Å; F289-T292 PolarHBondContact O-N 3.29Å; F289-Q293 HydrophobicContact CE1-CB 4.46Å; F289-Q293 PolarHBondContact O-N 2.88Å; F289-Y341 AromaticContact CD1-CD1 3.72Å; F289-Y341 HydrophobicContact CD1-CD1 3.72Å; F289-Y341 HydrophobicContact CD1-CG 4.34Å; F289-Y341 WeakPolarHBondContact CD2-O 3.43Å; F289-Y341 AromaticContact CE1-CD1 3.76Å; F289-Y341 HydrophobicContact CE1-CD1 3.76Å; F289-Y341 HydrophobicContact CE1-CE1 4.36Å; F289-Y341 HydrophobicContact CG-CD1 4.16Å; F289-Y341 HydrophobicContact CZ-CD1 4.23Å; F289-P343 HydrophobicContact CD2-CG 4.29Å; F289-P343 HydrophobicContact CE1-CG 4.45Å; F289-P343 HydrophobicContact CE2-CG 3.36Å; F289-P343 HydrophobicContact CZ-CG 3.46Å; F289-P343 VanDerWaalsContact CZ-CG 3.46Å; F289-A351 HydrophobicContact CD2-CB 3.91Å; F289-A351 HydrophobicContact CE2-CB 3.79Å
290	R	91.5	Very high	92.7	Very high	64 Å²	64	20.3 Å²	20.3	24%	0.242	11%	0.113	C	C	.	.	H	α-helix	trans	-71.6	-30.3	178.6	-65.9	-64.7	-174.8	-166.9	-1.2	112.3	V216 N287 I288 A294	V216-R290 HydrophobicContact CG1-CB 4.08Å; V216-R290 VanDerWaalsContact O-CB 3.24Å; V216-R290 WeakPolarHBondContact O-CB 2.96Å; N287-R290 HydrophobicContact CB-CB 4.42Å; N287-R290 HydrophobicContact CB-CG 3.96Å; N287-R290 WeakPolarHBondContact O-CB 3.34Å; N287-R290 PolarHBondContact O-N 2.91Å; I288-R290 PolarHBondContact O-N 2.83Å; R290-A294 WeakPolarHBondContact O-CB 3.41Å; R290-A294 PolarHBondContact O-N 3.05Å
291	F	94.5	Very high	92.7	Very high	12 Å²	12	20.3 Å²	20.3	5%	0.053	11%	0.112	C	C	.	.	H	α-helix	trans	-59	-49.6	168.6	171.3	-98.6	0	0	0	110.4	V216 A260 A263 N287 I288 F289 A294 G295 M319 M322	V216-F291 HydrophobicContact CG1-CB 4.02Å; A260-F291 VanDerWaalsContact O-CE2 3.26Å; A260-F291 WeakPolarHBondContact O-CE2 3.37Å; A263-F291 HydrophobicContact CB-CD2 3.88Å; A263-F291 HydrophobicContact CB-CE2 4.35Å; N287-F291 PolarHBondContact O-N 3.48Å; I288-F291 HydrophobicContact CD1-CB 4.01Å; I288-F291 HydrophobicContact CD1-CD1 4.03Å; I288-F291 HydrophobicContact CD1-CG 4.2Å; I288-F291 WeakPolarHBondContact O-CB 3.13Å; I288-F291 PolarHBondContact O-N 3.32Å; F289-F291 VanDerWaalsContact C-N 3.34Å; F291-A294 PolarHBondContact O-N 2.83Å; F291-G295 PolarHBondContact O-N 3.29Å; F291-M319 HydrophobicContact CD1-CE 4.13Å; F291-M319 HydrophobicContact CE1-CE 4.47Å; F291-M322 HydrophobicContact CZ-CB 4.47Å
292	T	92.9	Very high	92.6	Very high	1 Å²	1	20.7 Å²	20.7	1%	0.006	11%	0.114	C	C	.	.	H	α-helix	trans	-60.7	-48.3	177.2	-63.9	0	0	0	0	112.3	I288 F289 A294 G295 S296 Y311 Q312 L315 M319 A351	I288-T292 PolarHBondContact O-N 2.92Å; F289-T292 WeakPolarHBondContact O-CB 3.45Å; F289-T292 PolarHBondContact O-N 3.29Å; T292-A294 PolarHBondContact O-N 2.89Å; T292-G295 WeakPolarHBondContact O-CA 3.27Å; T292-G295 PolarHBondContact O-N 2.95Å; T292-G295 VanDerWaalsContact O-N 3.1Å; T292-S296 PolarHBondContact O-N 3.37Å; T292-S296 PolarHBondContact O-OG 2.84Å; T292-Y311 HydrophobicContact CG2-CD1 3.74Å; T292-Y311 HydrophobicContact CG2-CE1 3.68Å; T292-Q312 PolarHBondContact O-NE2 3.43Å; T292-L315 HydrophobicContact CG2-CD1 3.39Å; T292-L315 HydrophobicContact CG2-CD2 4.48Å; T292-M319 WeakPolarHBondContact OG1-CE 3.21Å; T292-A351 HydrophobicContact CG2-CB 3.6Å
293	Q	91.9	Very high	92.4	Very high	60 Å²	60	23.2 Å²	23.2	28%	0.28	14%	0.142	S	C	.	.	H	α-helix	trans	-61	-44.1	179.2	-175.2	-172	-18.2	0	0	112	F289 G295 S296 E297	F289-Q293 HydrophobicContact CE1-CB 4.46Å; F289-Q293 PolarHBondContact O-N 2.88Å; Q293-G295 PolarHBondContact O-N 3.47Å; Q293-S296 WeakPolarHBondContact O-CB 3.37Å; Q293-S296 PolarHBondContact O-N 3.33Å; Q293-S296 VanDerWaalsContact O-N 3.1Å; Q293-E297 PolarHBondContact O-N 3.19Å
294	A	93.5	Very high	92	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-60.7	-38.5	175.1	0	0	0	0	0	111.1	R259 A260 R290 F291 T292 E297 V298	R259-A294 HydrophobicContact CB-CB 3.54Å; A260-A294 HydrophobicContact CB-CB 3.92Å; R290-A294 WeakPolarHBondContact O-CB 3.41Å; R290-A294 PolarHBondContact O-N 3.05Å; F291-A294 PolarHBondContact O-N 2.83Å; T292-A294 PolarHBondContact O-N 2.89Å; A294-E297 PolarHBondContact O-N 3.31Å; A294-V298 WeakPolarHBondContact O-CG2 3.48Å; A294-V298 PolarHBondContact O-N 2.83Å
295	G	93.3	Very high	91.9	Very high	12 Å²	12	33.7 Å²	33.7	12%	0.124	19%	0.191	C	C	.	.	H	α-helix	trans	-59.7	-41.9	171.4	0	0	0	0	0	113.3	F291 T292 Q293 V298 S299	F291-G295 PolarHBondContact O-N 3.29Å; T292-G295 WeakPolarHBondContact O-CA 3.27Å; T292-G295 PolarHBondContact O-N 2.95Å; T292-G295 VanDerWaalsContact O-N 3.1Å; Q293-G295 PolarHBondContact O-N 3.47Å; G295-V298 PolarHBondContact O-N 3.26Å; G295-S299 WeakPolarHBondContact O-CB 3.46Å; G295-S299 PolarHBondContact O-N 2.86Å
296	S	93.4	Very high	91.7	Very high	20 Å²	20	37.6 Å²	37.6	14%	0.14	22%	0.216	C	C	.	.	H	α-helix	trans	-60.9	-45.7	173.3	-58.9	0	0	0	0	112.1	T292 Q293 S299 A300 Y311 Q312	T292-S296 PolarHBondContact O-N 3.37Å; T292-S296 PolarHBondContact O-OG 2.84Å; Q293-S296 WeakPolarHBondContact O-CB 3.37Å; Q293-S296 PolarHBondContact O-N 3.33Å; Q293-S296 VanDerWaalsContact O-N 3.1Å; S296-S299 PolarHBondContact O-N 3.45Å; S296-A300 PolarHBondContact O-N 2.82Å; S296-Y311 VanDerWaalsContact OG-CD1 3.23Å; S296-Y311 WeakPolarHBondContact OG-CD1 3.42Å; S296-Q312 PolarHBondContact OG-OE1 2.85Å
297	E	92.9	Very high	91.6	Very high	63 Å²	63	40.4 Å²	40.4	29%	0.294	24%	0.237	S	C	.	.	H	α-helix	trans	-61.7	-48.4	178	-68.3	172.8	-123.6	0	0	111.4	P256 R259 Q293 A294 S299 A300 L301	P256-E297 HydrophobicContact CB-CB 3.71Å; P256-E297 HydrophobicContact CG-CB 4.25Å; R259-E297 IonicContact CZ-OE1 3.29Å; R259-E297 IonicContact CZ-OE2 2.78Å; R259-E297 IonicContact NH1-OE1 3.71Å; R259-E297 PolarHBondContact NH1-OE1 3.5Å; R259-E297 IonicContact NH1-OE2 2.92Å; R259-E297 IonicContact NH2-OE1 3.47Å; R259-E297 PolarHBondContact NH2-OE1 3.37Å; R259-E297 IonicContact NH2-OE2 3.74Å; R259-E297 PolarHBondContact NH2-OE2 2.99Å; Q293-E297 PolarHBondContact O-N 3.19Å; A294-E297 PolarHBondContact O-N 3.31Å; E297-S299 VanDerWaalsContact C-N 3.34Å; E297-S299 PolarHBondContact O-N 2.84Å; E297-A300 PolarHBondContact O-N 2.89Å; E297-L301 WeakPolarHBondContact O-CG 3.27Å; E297-L301 PolarHBondContact O-N 2.98Å
298	V	92.4	Very high	91.4	Very high	11 Å²	11	42.6 Å²	42.6	7%	0.067	26%	0.257	C	S	.	.	H	α-helix	trans	-59.1	-45.8	175	169.3	0	0	0	0	110.8	I91 P256 A260 A294 G295 A300 L301 L302	I91-V298 HydrophobicContact CD1-CG1 3.38Å; I91-V298 HydrophobicContact CG1-CG1 4Å; I91-V298 HydrophobicContact CG2-CG2 4.35Å; P256-V298 HydrophobicContact CB-CG2 3.98Å; P256-V298 HydrophobicContact CG-CG2 4.46Å; A260-V298 HydrophobicContact CB-CG2 4.12Å; A294-V298 WeakPolarHBondContact O-CG2 3.48Å; A294-V298 PolarHBondContact O-N 2.83Å; G295-V298 PolarHBondContact O-N 3.26Å; V298-A300 VanDerWaalsContact C-N 3.32Å; V298-A300 PolarHBondContact O-N 2.81Å; V298-L301 PolarHBondContact O-N 3.48Å; V298-L302 HydrophobicContact CG1-CD1 3.96Å; V298-L302 HydrophobicContact CG1-CG 4.27Å; V298-L302 VanDerWaalsContact O-CG 3.31Å; V298-L302 WeakPolarHBondContact O-CG 3.25Å; V298-L302 PolarHBondContact O-N 3.21Å
299	S	92.7	Very high	91.1	Very high	4 Å²	4	48 Å²	48	3%	0.028	29%	0.289	C	S	.	.	H	α-helix	trans	-60.4	-41.7	-179.4	179	0	0	0	0	112.4	G295 S296 E297 L302 G303 R304 Q312	G295-S299 WeakPolarHBondContact O-CB 3.46Å; G295-S299 PolarHBondContact O-N 2.86Å; S296-S299 PolarHBondContact O-N 3.45Å; E297-S299 VanDerWaalsContact C-N 3.34Å; E297-S299 PolarHBondContact O-N 2.84Å; S299-L302 PolarHBondContact O-N 3.3Å; S299-G303 PolarHBondContact O-N 3.06Å; S299-R304 WeakPolarHBondContact O-CB 3.29Å; S299-R304 PolarHBondContact O-N 2.75Å; S299-R304 VanDerWaalsContact O-N 3.1Å; S299-R304 WeakPolarHBondContact OG-CB 3.5Å; S299-R304 WeakPolarHBondContact OG-CD 3.31Å; S299-Q312 VanDerWaalsContact OG-CB 3.27Å; S299-Q312 WeakPolarHBondContact OG-CB 3.41Å
300	A	91.9	Very high	90.9	Very high	65 Å²	65	49.2 Å²	49.2	54%	0.537	31%	0.307	S	S	.	.	H	α-helix	trans	-64.4	-43.2	175.5	0	0	0	0	0	111.6	S296 E297 V298 L302 G303	S296-A300 PolarHBondContact O-N 2.82Å; E297-A300 PolarHBondContact O-N 2.89Å; V298-A300 VanDerWaalsContact C-N 3.32Å; V298-A300 PolarHBondContact O-N 2.81Å; A300-L302 VanDerWaalsContact C-N 3.29Å; A300-L302 PolarHBondContact O-N 2.92Å; A300-G303 PolarHBondContact O-N 3.43Å
301	L	90.2	Very high	91	Very high	64 Å²	64	47.1 Å²	47.1	34%	0.335	30%	0.299	S	S	.	.	H	α-helix	trans	-64.8	-32.2	176.4	-67.2	173.1	0	0	0	112.9	A49 V50 P256 E297 V298 G303	A49-L301 HydrophobicContact CB-CD1 4.11Å; V50-L301 HydrophobicContact CG2-CB 3.55Å; V50-L301 HydrophobicContact CG2-CD1 4.48Å; P256-L301 HydrophobicContact CG-CD1 4.08Å; E297-L301 WeakPolarHBondContact O-CG 3.27Å; E297-L301 PolarHBondContact O-N 2.98Å; V298-L301 PolarHBondContact O-N 3.48Å; L301-G303 PolarHBondContact O-N 2.98Å
302	L	90.1	Very high	90.9	Very high	9 Å²	9	46.8 Å²	46.8	5%	0.047	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-6.5	173	-67.2	177	0	0	0	113.1	V50 A80 R89 I91 V298 S299 A300 R304	V50-L302 HydrophobicContact CG2-CD2 4.24Å; A80-L302 HydrophobicContact CB-CD1 4.32Å; A80-L302 HydrophobicContact CB-CD2 3.98Å; R89-L302 HydrophobicContact CG-CD2 3.72Å; I91-L302 HydrophobicContact CD1-CD1 4.38Å; I91-L302 HydrophobicContact CG1-CD2 4.33Å; V298-L302 HydrophobicContact CG1-CD1 3.96Å; V298-L302 HydrophobicContact CG1-CG 4.27Å; V298-L302 VanDerWaalsContact O-CG 3.31Å; V298-L302 WeakPolarHBondContact O-CG 3.25Å; V298-L302 PolarHBondContact O-N 3.21Å; S299-L302 PolarHBondContact O-N 3.3Å; A300-L302 VanDerWaalsContact C-N 3.29Å; A300-L302 PolarHBondContact O-N 2.92Å; L302-R304 HydrophobicContact CB-CG 4.34Å
303	G	87.7	Confident	90.9	Very high	61 Å²	61	50.3 Å²	50.3	63%	0.629	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.9	20.9	-179.8	0	0	0	0	0	114	S299 A300 L301	S299-G303 PolarHBondContact O-N 3.06Å; A300-G303 PolarHBondContact O-N 3.43Å; L301-G303 PolarHBondContact O-N 2.98Å
304	R	88.4	Confident	90.9	Very high	75 Å²	75	49.1 Å²	49.1	28%	0.283	32%	0.318	S	S	.	.	P	Polyproline II helix	trans	-73.4	142.9	174.8	-62.5	178	-178.7	178.1	0.5	109.7	S299 L302 P306 P313 T314	S299-R304 WeakPolarHBondContact O-CB 3.29Å; S299-R304 PolarHBondContact O-N 2.75Å; S299-R304 VanDerWaalsContact O-N 3.1Å; S299-R304 WeakPolarHBondContact OG-CB 3.5Å; S299-R304 WeakPolarHBondContact OG-CD 3.31Å; L302-R304 HydrophobicContact CB-CG 4.34Å; R304-P306 WeakPolarHBondContact O-CD 3.17Å; R304-P313 HydrophobicContact CB-CG 4.32Å; R304-T314 PolarHBondContact NH1-OG1 2.85Å
305	I	92.2	Very high	90.9	Very high	145 Å²	145	49.7 Å²	49.7	74%	0.744	32%	0.321	S	S	*	.	P	Polyproline II helix	trans	-66	125.8	174	-59.4	176.3	0	0	0	108.3
306	P	90.6	Very high	90.9	Very high	82 Å²	82	52.2 Å²	52.2	53%	0.532	34%	0.34	S	S	.	.	P	Polyproline II helix	trans	-63.2	146.8	175.6	-20.5	32	0	0	0	112.2	R304	R304-P306 WeakPolarHBondContact O-CD 3.17Å
307	S	90.3	Very high	90.8	Very high	71 Å²	71	56.1 Å²	56.1	50%	0.497	36%	0.363	S	S	.	.			trans	-91.7	-156.8	173.6	-168.8	0	0	0	0	110.7	V309 G310 Y311	S307-V309 PolarHBondContact O-N 3.42Å; S307-G310 PolarHBondContact O-N 2.92Å; S307-G310 VanDerWaalsContact O-N 3.16Å; S307-Y311 WeakPolarHBondContact CB-O 3.36Å; S307-Y311 PolarHBondContact N-O 3.47Å
308	A	84.8	Confident	90.8	Very high	57 Å²	57	55.4 Å²	55.4	47%	0.471	36%	0.362	S	S	.	.	G	3₁₀ helix	trans	-50.7	133.7	175.9	0	0	0	0	0	111.5	G310 Y311 P350	A308-G310 PolarHBondContact O-N 3.28Å; A308-Y311 WeakPolarHBondContact O-CD2 3.19Å; A308-Y311 PolarHBondContact O-N 3.2Å; A308-Y311 VanDerWaalsContact O-N 3.14Å; A308-P350 HydrophobicContact CB-CG 4.09Å
309	V	86.4	Confident	90.9	Very high	113 Å²	113	55 Å²	55	69%	0.685	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	59	12.4	177.2	-160.8	0	0	0	0	113.8	S307 Y311 P350	S307-V309 PolarHBondContact O-N 3.42Å; V309-Y311 HydrophobicContact CB-CD2 4.04Å; V309-Y311 HydrophobicContact CB-CE2 4.05Å; V309-Y311 HydrophobicContact CG1-CE2 4.3Å; V309-P350 HydrophobicContact CB-CG 4.37Å; V309-P350 HydrophobicContact CG2-CG 3.92Å
310	G	88.1	Confident	91	Very high	44 Å²	44	55.3 Å²	55.3	45%	0.454	36%	0.363	S	S	.	.	G	3₁₀ helix	trans	89.4	5.8	180	0	0	0	0	0	115	S307 A308	S307-G310 PolarHBondContact O-N 2.92Å; S307-G310 VanDerWaalsContact O-N 3.16Å; A308-G310 PolarHBondContact O-N 3.28Å
311	Y	92.7	Very high	91	Very high	21 Å²	21	55.3 Å²	55.3	8%	0.082	36%	0.359	C	S	.	.			trans	-70.4	159.4	175.5	-70.8	-74.3	0	0	0	112.8	T292 S296 S307 A308 V309 L315 D349 P350 A351	T292-Y311 HydrophobicContact CG2-CD1 3.74Å; T292-Y311 HydrophobicContact CG2-CE1 3.68Å; S296-Y311 VanDerWaalsContact OG-CD1 3.23Å; S296-Y311 WeakPolarHBondContact OG-CD1 3.42Å; S307-Y311 WeakPolarHBondContact CB-O 3.36Å; S307-Y311 PolarHBondContact N-O 3.47Å; A308-Y311 WeakPolarHBondContact O-CD2 3.19Å; A308-Y311 PolarHBondContact O-N 3.2Å; A308-Y311 VanDerWaalsContact O-N 3.14Å; V309-Y311 HydrophobicContact CB-CD2 4.04Å; V309-Y311 HydrophobicContact CB-CE2 4.05Å; V309-Y311 HydrophobicContact CG1-CE2 4.3Å; Y311-L315 HydrophobicContact CD1-CD2 4.33Å; Y311-L315 HydrophobicContact CG-CD2 4.12Å; Y311-D349 WeakPolarHBondContact CE2-OD1 3.41Å; Y311-D349 VanDerWaalsContact CZ-OD1 3.23Å; Y311-D349 PolarHBondContact OH-OD1 2.84Å; Y311-D349 PolarHBondContact OH-OD2 3.35Å; Y311-P350 HydrophobicContact CD2-CB 3.71Å; Y311-P350 HydrophobicContact CD2-CG 3.86Å; Y311-P350 HydrophobicContact CE2-CB 4.04Å; Y311-P350 HydrophobicContact CE2-CG 4.12Å; Y311-P350 HydrophobicContact CG-CB 4.48Å; Y311-A351 HydrophobicContact CD1-CB 4.48Å; Y311-A351 HydrophobicContact CE1-CB 3.68Å; Y311-A351 HydrophobicContact CE2-CB 4.31Å; Y311-A351 WeakPolarHBondContact OH-CB 3.38Å
312	Q	92.6	Very high	91.3	Very high	4 Å²	4	52.2 Å²	52.2	2%	0.019	34%	0.343	C	S	.	.			trans	-62.4	141.7	174.2	69.1	-81.8	41.5	0	0	111.7	T292 S296 S299 T314 L315	T292-Q312 PolarHBondContact O-NE2 3.43Å; S296-Q312 PolarHBondContact OG-OE1 2.85Å; S299-Q312 VanDerWaalsContact OG-CB 3.27Å; S299-Q312 WeakPolarHBondContact OG-CB 3.41Å; Q312-T314 PolarHBondContact O-N 2.93Å; Q312-T314 VanDerWaalsContact O-N 3.14Å; Q312-L315 HydrophobicContact CG-CB 4.11Å; Q312-L315 WeakPolarHBondContact O-CB 3.45Å; Q312-L315 PolarHBondContact O-N 3.49Å; Q312-L315 VanDerWaalsContact O-N 3.15Å
313	P	92.8	Very high	91.5	Very high	75 Å²	75	51.8 Å²	51.8	49%	0.487	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-17.1	177.2	27.5	-34.8	0	0	0	112.8	R304	R304-P313 HydrophobicContact CB-CG 4.32Å
314	T	92	Very high	91.8	Very high	35 Å²	35	52.9 Å²	52.9	22%	0.215	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	7.2	178.5	52.9	0	0	0	0	113.8	R304 Q312 A316 T317 D318	R304-T314 PolarHBondContact NH1-OG1 2.85Å; Q312-T314 PolarHBondContact O-N 2.93Å; Q312-T314 VanDerWaalsContact O-N 3.14Å; T314-A316 VanDerWaalsContact C-N 3.33Å; T314-A316 PolarHBondContact O-N 3.28Å; T314-T317 WeakPolarHBondContact O-CA 3.43Å; T314-T317 PolarHBondContact O-N 2.86Å; T314-D318 WeakPolarHBondContact CB-OD2 3.47Å; T314-D318 PolarHBondContact O-N 3.37Å; T314-D318 PolarHBondContact OG1-OD2 3.42Å
315	L	92.9	Very high	92.1	Very high	13 Å²	13	49.5 Å²	49.5	7%	0.068	32%	0.317	C	S	.	.	H	α-helix	trans	-50.7	-50.7	-170.7	172.7	57.5	0	0	0	112.6	T292 Y311 Q312 T317 D318 M319 P350 T354	T292-L315 HydrophobicContact CG2-CD1 3.39Å; T292-L315 HydrophobicContact CG2-CD2 4.48Å; Y311-L315 HydrophobicContact CD1-CD2 4.33Å; Y311-L315 HydrophobicContact CG-CD2 4.12Å; Q312-L315 HydrophobicContact CG-CB 4.11Å; Q312-L315 WeakPolarHBondContact O-CB 3.45Å; Q312-L315 PolarHBondContact O-N 3.49Å; Q312-L315 VanDerWaalsContact O-N 3.15Å; L315-T317 VanDerWaalsContact C-N 3.31Å; L315-T317 PolarHBondContact O-N 3.33Å; L315-D318 PolarHBondContact O-N 3.08Å; L315-M319 VanDerWaalsContact O-CB 3.24Å; L315-M319 WeakPolarHBondContact O-CB 3.44Å; L315-M319 PolarHBondContact O-N 3.19Å; L315-P350 HydrophobicContact CD2-CB 4.11Å; L315-T354 HydrophobicContact CG-CG2 4.42Å
316	A	93.4	Very high	92.3	Very high	65 Å²	65	42.7 Å²	42.7	54%	0.537	28%	0.282	S	S	.	.	H	α-helix	trans	-62.1	-38.4	-179.8	0	0	0	0	0	112.6	T314 G320 T354	T314-A316 VanDerWaalsContact C-N 3.33Å; T314-A316 PolarHBondContact O-N 3.28Å; A316-G320 WeakPolarHBondContact O-CA 3.28Å; A316-G320 PolarHBondContact O-N 2.88Å; A316-T354 HydrophobicContact CB-CG2 4.4Å
317	T	92.8	Very high	92.3	Very high	101 Å²	101	40 Å²	40	62%	0.62	26%	0.264	S	S	*	.	H	α-helix	trans	-72.7	-45.5	179.2	-50.3	0	0	0	0	111.5	T314 L315 G320 S321	T314-T317 WeakPolarHBondContact O-CA 3.43Å; T314-T317 PolarHBondContact O-N 2.86Å; L315-T317 VanDerWaalsContact C-N 3.31Å; L315-T317 PolarHBondContact O-N 3.33Å; T317-G320 PolarHBondContact O-N 2.86Å; T317-S321 VanDerWaalsContact O-CB 3.3Å; T317-S321 WeakPolarHBondContact O-CB 3.44Å; T317-S321 PolarHBondContact O-N 3.04Å; T317-S321 PolarHBondContact O-OG 3.32Å
318	D	92.7	Very high	92.4	Very high	49 Å²	49	37.4 Å²	37.4	26%	0.262	25%	0.245	S	C	.	.	H	α-helix	trans	-63.3	-45.8	-179.9	-62.5	-28.1	0	0	0	109.9	T314 L315 S321	T314-D318 WeakPolarHBondContact CB-OD2 3.47Å; T314-D318 PolarHBondContact O-N 3.37Å; T314-D318 PolarHBondContact OG1-OD2 3.42Å; L315-D318 PolarHBondContact O-N 3.08Å; D318-S321 PolarHBondContact O-OG 3.28Å
319	M	94.2	Very high	92.7	Very high	1 Å²	1	35 Å²	35	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-62.3	-52	174.3	-172.9	60.9	67.4	0	0	111.2	I288 F291 T292 L315 S321 M322 Q323 T354	I288-M319 HydrophobicContact CD1-CE 4.27Å; I288-M319 HydrophobicContact CD1-SD 4.06Å; I288-M319 HydrophobicContact CG1-CE 3.99Å; I288-M319 HydrophobicContact CG1-SD 4.03Å; F291-M319 HydrophobicContact CD1-CE 4.13Å; F291-M319 HydrophobicContact CE1-CE 4.47Å; T292-M319 WeakPolarHBondContact OG1-CE 3.21Å; L315-M319 VanDerWaalsContact O-CB 3.24Å; L315-M319 WeakPolarHBondContact O-CB 3.44Å; L315-M319 PolarHBondContact O-N 3.19Å; M319-S321 VanDerWaalsContact C-N 3.33Å; M319-S321 PolarHBondContact O-N 3.17Å; M319-M322 PolarHBondContact O-N 2.99Å; M319-M322 VanDerWaalsContact O-N 3.16Å; M319-M322 HydrophobicContact SD-CE 4.24Å; M319-Q323 HydrophobicContact CG-CG 3.88Å; M319-Q323 WeakPolarHBondContact O-CB 3.48Å; M319-Q323 VanDerWaalsContact O-CG 3.27Å; M319-Q323 WeakPolarHBondContact O-CG 3.34Å; M319-Q323 PolarHBondContact O-N 3.44Å; M319-Q323 HydrophobicContact SD-CG 3.77Å; M319-Q323 PolarHBondContact SD-NE2 2.94Å; M319-Q323 VanDerWaalsContact SD-NE2 3.42Å; M319-T354 HydrophobicContact CB-CG2 4.09Å; M319-T354 HydrophobicContact CG-CG2 4.16Å
320	G	94.1	Very high	92.8	Very high	12 Å²	12	37.3 Å²	37.3	12%	0.124	23%	0.225	C	C	.	.	H	α-helix	trans	-58.7	-42.5	-178.8	0	0	0	0	0	112.7	A316 T317 M322 Q323 E324	A316-G320 WeakPolarHBondContact O-CA 3.28Å; A316-G320 PolarHBondContact O-N 2.88Å; T317-G320 PolarHBondContact O-N 2.86Å; G320-M322 PolarHBondContact O-N 3.04Å; G320-Q323 PolarHBondContact O-N 3.33Å; G320-E324 WeakPolarHBondContact O-CB 3.38Å; G320-E324 VanDerWaalsContact O-CG 3.27Å; G320-E324 WeakPolarHBondContact O-CG 3.42Å; G320-E324 PolarHBondContact O-N 3.32Å
321	S	92.9	Very high	92.9	Very high	64 Å²	64	41.9 Å²	41.9	45%	0.448	23%	0.233	S	C	.	.	H	α-helix	trans	-59	-33.3	179.3	71.8	0	0	0	0	113.4	T317 D318 M319 R325	T317-S321 VanDerWaalsContact O-CB 3.3Å; T317-S321 WeakPolarHBondContact O-CB 3.44Å; T317-S321 PolarHBondContact O-N 3.04Å; T317-S321 PolarHBondContact O-OG 3.32Å; D318-S321 PolarHBondContact O-OG 3.28Å; M319-S321 VanDerWaalsContact C-N 3.33Å; M319-S321 PolarHBondContact O-N 3.17Å; S321-R325 VanDerWaalsContact O-CD 3.25Å; S321-R325 WeakPolarHBondContact O-CD 3.29Å; S321-R325 WeakPolarHBondContact O-CG 3.43Å
322	M	95.1	Very high	92.8	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-83.5	-47.1	175.8	-172.7	-77.4	-65.2	0	0	111.2	L264 L267 I285 I288 F291 M319 G320 E324 R325 I326	L264-M322 HydrophobicContact CD2-CB 3.82Å; L264-M322 HydrophobicContact CD2-CG 3.65Å; L267-M322 HydrophobicContact CD2-CG 3.94Å; L267-M322 HydrophobicContact CD2-SD 4.14Å; I285-M322 HydrophobicContact CD1-CE 4.24Å; I285-M322 HydrophobicContact CD1-SD 4.04Å; I288-M322 HydrophobicContact CD1-CE 3.23Å; I288-M322 HydrophobicContact CG1-CE 4.35Å; F291-M322 HydrophobicContact CZ-CB 4.47Å; M319-M322 PolarHBondContact O-N 2.99Å; M319-M322 VanDerWaalsContact O-N 3.16Å; M319-M322 HydrophobicContact SD-CE 4.24Å; G320-M322 PolarHBondContact O-N 3.04Å; M322-E324 PolarHBondContact O-N 2.67Å; M322-R325 WeakPolarHBondContact O-CB 3.47Å; M322-R325 PolarHBondContact O-N 3.28Å; M322-I326 HydrophobicContact SD-CD1 3.61Å; M322-I326 HydrophobicContact SD-CG1 4.4Å
323	Q	95.6	Very high	92.7	Very high	0 Å²	0	41 Å²	41	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-64.7	-38.9	-176.7	-65.9	-67	-5.2	0	0	112.2	K181 M319 G320 R325 I326 H358	K181-Q323 WeakPolarHBondContact CE-O 3.37Å; K181-Q323 PolarHBondContact NZ-O 2.67Å; M319-Q323 HydrophobicContact CG-CG 3.88Å; M319-Q323 WeakPolarHBondContact O-CB 3.48Å; M319-Q323 VanDerWaalsContact O-CG 3.27Å; M319-Q323 WeakPolarHBondContact O-CG 3.34Å; M319-Q323 PolarHBondContact O-N 3.44Å; M319-Q323 HydrophobicContact SD-CG 3.77Å; M319-Q323 PolarHBondContact SD-NE2 2.94Å; M319-Q323 VanDerWaalsContact SD-NE2 3.42Å; G320-Q323 PolarHBondContact O-N 3.33Å; Q323-R325 PolarHBondContact O-N 3.12Å; Q323-I326 WeakPolarHBondContact O-CB 3.26Å; Q323-I326 PolarHBondContact O-N 2.95Å; Q323-H358 HydrophobicContact CB-CB 3.96Å; Q323-H358 HydrophobicContact CG-CB 3.96Å
324	E	94	Very high	92.8	Very high	84 Å²	84	37.4 Å²	37.4	39%	0.393	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-17.9	-178.1	-65.1	-49	126.5	0	0	113.4	A150 K181 G320 M322 I326 H358	A150-E324 HydrophobicContact CB-CB 3.98Å; A150-E324 WeakPolarHBondContact CB-O 3.31Å; K181-E324 IonicContact NZ-OE1 3.41Å; G320-E324 WeakPolarHBondContact O-CB 3.38Å; G320-E324 VanDerWaalsContact O-CG 3.27Å; G320-E324 WeakPolarHBondContact O-CG 3.42Å; G320-E324 PolarHBondContact O-N 3.32Å; M322-E324 PolarHBondContact O-N 2.67Å; E324-I326 VanDerWaalsContact C-N 3.33Å; E324-H358 IonicContact OE1-CE1 2.84Å; E324-H358 IonicContact OE1-ND1 2.75Å; E324-H358 PolarHBondContact OE1-ND1 3.4Å; E324-H358 VanDerWaalsContact OE1-ND1 3.08Å
325	R	95.2	Very high	92.9	Very high	4 Å²	4	36 Å²	36	2%	0.015	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-23.1	170.6	-76	166.9	66.8	178	2.6	112.7	I146 Q148 A150 L267 T268 E271 R274 S321 M322 Q323 T327	I146-R325 PolarHBondContact O-NH1 2.98Å; I146-R325 PolarHBondContact O-NH2 2.79Å; Q148-R325 WeakPolarHBondContact O-CD 3.42Å; A150-R325 HydrophobicContact CB-CG 4.17Å; L267-R325 HydrophobicContact CD2-CB 3.63Å; L267-R325 HydrophobicContact CD2-CG 4.46Å; L267-R325 HydrophobicContact CG-CB 4.34Å; T268-R325 PolarHBondContact OG1-NH2 3.43Å; E271-R325 WeakPolarHBondContact OE1-CB 3.4Å; E271-R325 IonicContact OE1-CZ 3.72Å; E271-R325 IonicContact OE1-NE 3.57Å; E271-R325 PolarHBondContact OE1-NE 3.17Å; E271-R325 IonicContact OE1-NH2 2.74Å; E271-R325 PolarHBondContact OE1-NH2 3.5Å; E271-R325 IonicContact OE2-CZ 3.33Å; E271-R325 IonicContact OE2-NE 2.86Å; E271-R325 IonicContact OE2-NH2 3.24Å; E271-R325 PolarHBondContact OE2-NH2 3.23Å; R274-R325 PolarHBondContact NH1-O 2.84Å; S321-R325 VanDerWaalsContact O-CD 3.25Å; S321-R325 WeakPolarHBondContact O-CD 3.29Å; S321-R325 WeakPolarHBondContact O-CG 3.43Å; M322-R325 WeakPolarHBondContact O-CB 3.47Å; M322-R325 PolarHBondContact O-N 3.28Å; Q323-R325 PolarHBondContact O-N 3.12Å; R325-T327 PolarHBondContact O-N 3.39Å
326	I	94.7	Very high	93	Very high	1 Å²	1	35.3 Å²	35.3	1%	0.005	20%	0.196	C	C	.	.	S	Bend	trans	-83.2	98.7	174.5	-59.7	169.4	0	0	0	108	K181 L267 L283 I285 M322 Q323 E324 I334	K181-I326 WeakPolarHBondContact CE-O 3.13Å; K181-I326 HydrophobicContact CG-CB 4.43Å; K181-I326 HydrophobicContact CG-CG2 3.93Å; L267-I326 HydrophobicContact CD1-CG1 3.72Å; L267-I326 HydrophobicContact CD2-CG1 4.31Å; L283-I326 HydrophobicContact CD2-CD1 3.93Å; L283-I326 HydrophobicContact CD2-CG1 4.03Å; I285-I326 HydrophobicContact CD1-CD1 4.21Å; M322-I326 HydrophobicContact SD-CD1 3.61Å; M322-I326 HydrophobicContact SD-CG1 4.4Å; Q323-I326 WeakPolarHBondContact O-CB 3.26Å; Q323-I326 PolarHBondContact O-N 2.95Å; E324-I326 VanDerWaalsContact C-N 3.33Å; I326-I334 HydrophobicContact CG2-CB 4.45Å; I326-I334 HydrophobicContact CG2-CG2 4.04Å; I326-I334 WeakPolarHBondContact CG2-O 3.5Å
327	T	91.8	Very high	93	Very high	26 Å²	26	32.3 Å²	32.3	16%	0.16	17%	0.171	C	C	.	.	S	Bend	trans	-160.4	167.2	-178.5	-169.9	0	0	0	0	111.7	P151 M156 R325 I334	P151-T327 HydrophobicContact CB-CG2 4.17Å; P151-T327 HydrophobicContact CG-CG2 3.71Å; M156-T327 HydrophobicContact CE-CG2 4.37Å; R325-T327 PolarHBondContact O-N 3.39Å; T327-I334 PolarHBondContact O-N 2.79Å
328	T	91.5	Very high	93.1	Very high	17 Å²	17	27.5 Å²	27.5	10%	0.104	14%	0.141	C	C	.	.	B	Isolated β-bridge	trans	-84.7	129.2	169.4	-60.6	0	0	0	0	110.9	M156 N157 K178 G179 S333	M156-T328 WeakPolarHBondContact CA-O 3.13Å; N157-T328 HydrophobicContact CB-CG2 3.79Å; N157-T328 PolarHBondContact N-O 3.06Å; N157-T328 VanDerWaalsContact N-O 3.17Å; K178-T328 PolarHBondContact O-OG1 3.26Å; G179-T328 VanDerWaalsContact CA-OG1 3.26Å; G179-T328 WeakPolarHBondContact CA-OG1 3.41Å; T328-S333 VanDerWaalsContact OG1-CB 3.32Å; T328-S333 WeakPolarHBondContact OG1-CB 3.45Å
329	T	91.8	Very high	93	Very high	7 Å²	7	25.2 Å²	25.2	4%	0.043	13%	0.129	C	C	.	.	B	Isolated β-bridge	trans	-107.8	174.3	169.1	71.1	0	0	0	0	110.5	P151 E155 K331 G332	P151-T329 HydrophobicContact CB-CG2 3.84Å; P151-T329 HydrophobicContact CG-CG2 3.85Å; E155-T329 CarbonylContact O-C 3.57Å; E155-T329 WeakPolarHBondContact O-CA 3.45Å; T329-K331 PolarHBondContact O-N 3.33Å; T329-K331 PolarHBondContact OG1-N 3.14Å; T329-G332 PolarHBondContact N-O 3.44Å; T329-G332 PolarHBondContact OG1-N 3.49Å; T329-G332 PolarHBondContact OG1-O 2.91Å
330	K	88.8	Confident	92.7	Very high	160 Å²	160	25.2 Å²	25.2	70%	0.696	13%	0.129	S	C	*	.	S	Bend	trans	-60.9	-19.3	172.7	-73.1	169.9	177.4	170.2	0	114.1	V154 E155	V154-K330 WeakPolarHBondContact O-CE 3.25Å; V154-K330 PolarHBondContact O-NZ 2.92Å; E155-K330 WeakPolarHBondContact O-CG 3.28Å; E155-K330 PolarHBondContact O-N 2.9Å
331	K	88.9	Confident	92.3	Very high	140 Å²	140	29.6 Å²	29.6	61%	0.609	14%	0.142	S	C	*	.	S	Bend	trans	-95.2	-35.9	-176.7	-67.3	-178.3	176.4	175.4	0	112.8	D275 G278 T329	D275-K331 WeakPolarHBondContact O-CD 3.47Å; D275-K331 PolarHBondContact O-NZ 3.39Å; G278-K331 CarbonylContact C-O 3.46Å; G278-K331 VanDerWaalsContact C-O 3.26Å; G278-K331 VanDerWaalsContact CA-O 3.24Å; G278-K331 WeakPolarHBondContact CA-O 3.46Å; T329-K331 PolarHBondContact O-N 3.33Å; T329-K331 PolarHBondContact OG1-N 3.14Å
332	G	90.7	Very high	91.6	Very high	6 Å²	6	27.3 Å²	27.3	6%	0.062	13%	0.126	C	C	.	.			trans	-175.2	-177.3	-176.9	0	0	0	0	0	110.9	T329	T329-G332 PolarHBondContact N-O 3.44Å; T329-G332 PolarHBondContact OG1-N 3.49Å; T329-G332 PolarHBondContact OG1-O 2.91Å
333	S	91.6	Very high	90.8	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	13%	0.134	C	C	.	.	B	Isolated β-bridge	trans	-128.1	150.7	-179	63.4	0	0	0	0	112.9	K178 Q279 D280 V281 T328	K178-S333 WeakPolarHBondContact CE-OG 3.44Å; K178-S333 WeakPolarHBondContact CG-OG 3.33Å; Q279-S333 PolarHBondContact O-N 3.25Å; D280-S333 WeakPolarHBondContact CA-O 3.43Å; D280-S333 WeakPolarHBondContact OD1-CB 3.49Å; D280-S333 PolarHBondContact OD1-N 3.25Å; D280-S333 PolarHBondContact OD1-OG 2.69Å; V281-S333 PolarHBondContact N-O 3.18Å; T328-S333 VanDerWaalsContact OG1-CB 3.32Å; T328-S333 WeakPolarHBondContact OG1-CB 3.45Å
334	I	94.3	Very high	89.9	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	107.1	162.2	-62.7	167.5	0	0	0	107.1	G179 L267 A270 E271 R274 V281 L283 I326 T327	G179-I334 CarbonylContact C-O 3.59Å; G179-I334 WeakPolarHBondContact CA-O 3.15Å; L267-I334 HydrophobicContact CD1-CD1 4.02Å; A270-I334 HydrophobicContact CB-CD1 4Å; A270-I334 HydrophobicContact CB-CG1 4.27Å; A270-I334 HydrophobicContact CB-CG2 4.42Å; E271-I334 HydrophobicContact CB-CD1 4.49Å; E271-I334 HydrophobicContact CG-CD1 3.81Å; R274-I334 HydrophobicContact CB-CD1 4.23Å; R274-I334 HydrophobicContact CB-CG1 3.97Å; R274-I334 HydrophobicContact CG-CG1 4.31Å; V281-I334 HydrophobicContact CB-CG1 4.47Å; V281-I334 WeakPolarHBondContact O-CA 3.3Å; L283-I334 HydrophobicContact CB-CG2 3.61Å; L283-I334 HydrophobicContact CD2-CG2 4.14Å; I326-I334 HydrophobicContact CG2-CB 4.45Å; I326-I334 HydrophobicContact CG2-CG2 4.04Å; I326-I334 WeakPolarHBondContact CG2-O 3.5Å; T327-I334 PolarHBondContact O-N 2.79Å
335	T	93.4	Very high	88.9	Confident	5 Å²	5	36 Å²	36	3%	0.031	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	124.7	170.3	-51	0	0	0	0	107.8	L163 G179 I182 V281 L282 L283	L163-T335 HydrophobicContact CD2-CG2 3.87Å; G179-T335 PolarHBondContact N-OG1 3Å; I182-T335 HydrophobicContact CD1-CG2 3.59Å; V281-T335 PolarHBondContact O-N 3.47Å; L282-T335 CarbonylContact C-O 3.54Å; L282-T335 VanDerWaalsContact CA-O 3.31Å; L282-T335 WeakPolarHBondContact CA-O 3.07Å; L282-T335 HydrophobicContact CD2-CG2 3.93Å; L283-T335 PolarHBondContact N-O 3.26Å
336	S	94.8	Very high	88.1	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	139.4	-177.5	72	0	0	0	0	113.2	G180 K181 I182 L283 Q338	G180-S336 PolarHBondContact O-N 3.25Å; K181-S336 WeakPolarHBondContact CA-OG 3.35Å; I182-S336 WeakPolarHBondContact CB-O 3.38Å; I182-S336 WeakPolarHBondContact CD1-O 3.45Å; I182-S336 PolarHBondContact N-O 3.4Å; L283-S336 CarbonylContact O-C 3.59Å; L283-S336 WeakPolarHBondContact O-CA 3.41Å; S336-Q338 PolarHBondContact OG-NE2 3.15Å
337	V	94.4	Very high	87.1	Confident	2 Å²	2	43.8 Å²	43.8	1%	0.012	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	109.3	170.6	-179.3	0	0	0	0	107.5	I182 L184 I196 L199 L283 F284 I285	I182-V337 HydrophobicContact CB-CG2 4.35Å; I182-V337 HydrophobicContact CD1-CG2 4.35Å; L184-V337 HydrophobicContact CD1-CG1 3.38Å; L184-V337 HydrophobicContact CD2-CG1 4.12Å; L184-V337 HydrophobicContact CG-CG1 3.52Å; I196-V337 HydrophobicContact CG1-CG1 4.41Å; L199-V337 HydrophobicContact CD1-CG1 4.26Å; L199-V337 HydrophobicContact CD1-CG2 4.31Å; L283-V337 PolarHBondContact O-N 2.88Å; F284-V337 WeakPolarHBondContact CA-O 3.14Å; F284-V337 HydrophobicContact CD1-CB 3.63Å; F284-V337 HydrophobicContact CD1-CG1 4.09Å; F284-V337 HydrophobicContact CD1-CG2 4.29Å; F284-V337 HydrophobicContact CE1-CB 3.7Å; F284-V337 HydrophobicContact CE1-CG1 4.13Å; F284-V337 HydrophobicContact CE1-CG2 3.87Å; I285-V337 PolarHBondContact N-O 2.98Å
338	Q	94.5	Very high	86.7	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	115.7	-168.5	-51.3	-175.6	25.5	0	0	109.1	I182 G183 L184 I285 I288 S336 I340	I182-Q338 PolarHBondContact O-N 3.32Å; G183-Q338 CarbonylContact C-O 3.58Å; G183-Q338 WeakPolarHBondContact CA-O 3.11Å; L184-Q338 PolarHBondContact N-O 3.39Å; I285-Q338 HydrophobicContact CB-CB 4.45Å; I285-Q338 HydrophobicContact CB-CG 4.26Å; I285-Q338 HydrophobicContact CD1-CG 4.2Å; I285-Q338 CarbonylContact O-C 3.57Å; I285-Q338 WeakPolarHBondContact O-CA 3.37Å; I288-Q338 HydrophobicContact CB-CB 4.39Å; I288-Q338 HydrophobicContact CG2-CB 4.3Å; S336-Q338 PolarHBondContact OG-NE2 3.15Å; Q338-I340 PolarHBondContact O-N 3.03Å
339	A	91.2	Very high	86.5	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	131.7	174	0	0	0	0	0	109.3	L184 K192 I285 D286 N287 I288	L184-A339 WeakPolarHBondContact O-CA 3.5Å; K192-A339 HydrophobicContact CD-CB 4.44Å; I285-A339 PolarHBondContact O-N 2.77Å; D286-A339 HydrophobicContact CB-CB 4.16Å; D286-A339 WeakPolarHBondContact OD1-CB 3.24Å; N287-A339 VanDerWaalsContact ND2-C 3.34Å; N287-A339 VanDerWaalsContact ND2-CB 3.34Å; N287-A339 WeakPolarHBondContact ND2-CB 3.36Å; N287-A339 PolarHBondContact ND2-O 3.34Å; N287-A339 VanDerWaalsContact ND2-O 3.12Å; N287-A339 PolarHBondContact OD1-O 3.4Å; I288-A339 WeakPolarHBondContact CG2-O 3.34Å; I288-A339 PolarHBondContact N-O 2.81Å
340	I	88.7	Confident	86.4	Confident	1 Å²	1	49 Å²	49	1%	0.005	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	119	-178.5	-61.8	158.6	0	0	0	108.5	L184 F185 I288 Q338 P352 T355 L359	L184-I340 PolarHBondContact O-N 3.26Å; F185-I340 HydrophobicContact CD1-CB 3.91Å; F185-I340 HydrophobicContact CD1-CG2 3.91Å; F185-I340 HydrophobicContact CE1-CB 3.67Å; F185-I340 HydrophobicContact CE1-CD1 3.8Å; F185-I340 HydrophobicContact CE1-CG1 4.33Å; F185-I340 HydrophobicContact CE1-CG2 3.42Å; F185-I340 VanDerWaalsContact CE1-CG2 3.42Å; F185-I340 HydrophobicContact CE2-CD1 3.7Å; F185-I340 HydrophobicContact CZ-CB 4.08Å; F185-I340 HydrophobicContact CZ-CD1 3.27Å; F185-I340 HydrophobicContact CZ-CG1 4.25Å; F185-I340 HydrophobicContact CZ-CG2 4.11Å; I288-I340 HydrophobicContact CG2-CB 4.32Å; I288-I340 HydrophobicContact CG2-CD1 4.35Å; I288-I340 HydrophobicContact CG2-CG1 3.35Å; Q338-I340 PolarHBondContact O-N 3.03Å; I340-P352 HydrophobicContact CG2-CB 4.36Å; I340-T355 HydrophobicContact CD1-CG2 3.79Å; I340-T355 HydrophobicContact CG1-CG2 4.21Å; I340-L359 HydrophobicContact CD1-CD1 3.6Å; I340-L359 HydrophobicContact CD1-CD2 4.44Å
341	Y	84	Confident	86.3	Confident	104 Å²	104	41.4 Å²	41.4	41%	0.408	23%	0.23	S	C	.	.			trans	-84.4	128.1	166.8	177.6	-100.8	0	0	0	109.6	N287 F289 P343	N287-Y341 PolarHBondContact OD1-N 3.39Å; F289-Y341 AromaticContact CD1-CD1 3.72Å; F289-Y341 HydrophobicContact CD1-CD1 3.72Å; F289-Y341 HydrophobicContact CD1-CG 4.34Å; F289-Y341 WeakPolarHBondContact CD2-O 3.43Å; F289-Y341 AromaticContact CE1-CD1 3.76Å; F289-Y341 HydrophobicContact CE1-CD1 3.76Å; F289-Y341 HydrophobicContact CE1-CE1 4.36Å; F289-Y341 HydrophobicContact CG-CD1 4.16Å; F289-Y341 HydrophobicContact CZ-CD1 4.23Å; Y341-P343 HydrophobicContact CD1-CG 4.28Å; Y341-P343 HydrophobicContact CE1-CB 4.28Å; Y341-P343 HydrophobicContact CE1-CG 4.2Å
342	V	78.2	Confident	86.2	Confident	16 Å²	16	34.8 Å²	34.8	10%	0.097	20%	0.202	C	C	.	.			trans	-101.1	112.4	175.3	-172.7	0	0	0	0	108.1	F185 A344 D345 D346 L347	F185-V342 HydrophobicContact CD1-CG2 3.57Å; F185-V342 HydrophobicContact CE1-CG2 4.02Å; V342-A344 PolarHBondContact O-N 2.79Å; V342-D345 PolarHBondContact O-N 2.79Å; V342-D346 WeakPolarHBondContact CG1-O 3.45Å; V342-L347 HydrophobicContact CG1-CD2 3.9Å; V342-L347 HydrophobicContact CG2-CD2 3.93Å
343	P	79.2	Confident	86.1	Confident	27 Å²	27	36.6 Å²	36.6	18%	0.175	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-62.9	126.5	178	-21.6	34.2	0	0	0	111	F289 Y341 D345 D346	F289-P343 HydrophobicContact CD2-CG 4.29Å; F289-P343 HydrophobicContact CE1-CG 4.45Å; F289-P343 HydrophobicContact CE2-CG 3.36Å; F289-P343 HydrophobicContact CZ-CG 3.46Å; F289-P343 VanDerWaalsContact CZ-CG 3.46Å; Y341-P343 HydrophobicContact CD1-CG 4.28Å; Y341-P343 HydrophobicContact CE1-CB 4.28Å; Y341-P343 HydrophobicContact CE1-CG 4.2Å; P343-D345 PolarHBondContact O-N 3.45Å; P343-D346 PolarHBondContact O-N 2.79Å
344	A	77	Confident	86	Confident	97 Å²	97	38.1 Å²	38.1	80%	0.802	23%	0.225	S	C	*	.	G	3₁₀ helix	trans	50.9	27.3	178.6	0	0	0	0	0	114.2	V342 D346	V342-A344 PolarHBondContact O-N 2.79Å; A344-D346 PolarHBondContact O-N 2.76Å; A344-D346 VanDerWaalsContact O-N 3.11Å
345	D	71.5	Confident	85.8	Confident	142 Å²	142	38.2 Å²	38.2	76%	0.759	23%	0.226	S	C	*	.	G	3₁₀ helix	trans	56.2	20.7	-175.1	-55.4	-48.9	0	0	0	114.2	V342 P343 L347	V342-D345 PolarHBondContact O-N 2.79Å; P343-D345 PolarHBondContact O-N 3.45Å; D345-L347 PolarHBondContact O-N 3.3Å
346	D	78.9	Confident	85.5	Confident	72 Å²	72	41 Å²	41	39%	0.385	24%	0.238	S	C	.	.			trans	-89.3	101.6	177.1	-173.7	1.2	0	0	0	111.6	V342 P343 A344 T348 D349	V342-D346 WeakPolarHBondContact CG1-O 3.45Å; P343-D346 PolarHBondContact O-N 2.79Å; A344-D346 PolarHBondContact O-N 2.76Å; A344-D346 VanDerWaalsContact O-N 3.11Å; D346-T348 PolarHBondContact O-N 2.87Å; D346-T348 WeakPolarHBondContact OD1-CA 3.36Å; D346-T348 VanDerWaalsContact OD1-CB 3.3Å; D346-T348 WeakPolarHBondContact OD1-CB 3.4Å; D346-T348 PolarHBondContact OD1-N 3.26Å; D346-T348 PolarHBondContact OD1-OG1 3.12Å; D346-T348 PolarHBondContact OD2-OG1 3.2Å; D346-D349 WeakPolarHBondContact O-CB 3.23Å; D346-D349 PolarHBondContact O-N 3.16Å
347	L	73.5	Confident	85.2	Confident	98 Å²	98	44.3 Å²	44.3	51%	0.513	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-13.6	176.6	-59.5	174.2	0	0	0	113.4	V342 D345 D349 F356	V342-L347 HydrophobicContact CG1-CD2 3.9Å; V342-L347 HydrophobicContact CG2-CD2 3.93Å; D345-L347 PolarHBondContact O-N 3.3Å; L347-D349 VanDerWaalsContact C-N 3.3Å; L347-F356 HydrophobicContact CB-CE2 4.49Å; L347-F356 HydrophobicContact CD2-CE2 3.77Å; L347-F356 HydrophobicContact CD2-CZ 3.88Å
348	T	83.7	Confident	85.1	Confident	112 Å²	112	45.9 Å²	45.9	69%	0.687	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-6.6	177.2	76	0	0	0	0	112.7	D346	D346-T348 PolarHBondContact O-N 2.87Å; D346-T348 WeakPolarHBondContact OD1-CA 3.36Å; D346-T348 VanDerWaalsContact OD1-CB 3.3Å; D346-T348 WeakPolarHBondContact OD1-CB 3.4Å; D346-T348 PolarHBondContact OD1-N 3.26Å; D346-T348 PolarHBondContact OD1-OG1 3.12Å; D346-T348 PolarHBondContact OD2-OG1 3.2Å
349	D	87.8	Confident	85	Confident	16 Å²	16	46.1 Å²	46.1	9%	0.086	27%	0.273	C	S	.	.	S	Bend	trans	-56.1	135.3	170.7	-177.1	-77.1	0	0	0	110.2	Y311 D346 L347 A351 P352 A353	Y311-D349 WeakPolarHBondContact CE2-OD1 3.41Å; Y311-D349 VanDerWaalsContact CZ-OD1 3.23Å; Y311-D349 PolarHBondContact OH-OD1 2.84Å; Y311-D349 PolarHBondContact OH-OD2 3.35Å; D346-D349 WeakPolarHBondContact O-CB 3.23Å; D346-D349 PolarHBondContact O-N 3.16Å; L347-D349 VanDerWaalsContact C-N 3.3Å; D349-A351 PolarHBondContact O-N 3.38Å; D349-A351 VanDerWaalsContact O-N 3.12Å; D349-A351 WeakPolarHBondContact OD1-CB 3.14Å; D349-A351 PolarHBondContact OD1-N 2.87Å; D349-P352 HydrophobicContact CB-CG 3.83Å; D349-P352 WeakPolarHBondContact O-CD 3.44Å; D349-P352 VanDerWaalsContact O-CG 3.31Å; D349-P352 WeakPolarHBondContact O-CG 3.48Å; D349-P352 VanDerWaalsContact OD1-CD 3.25Å; D349-P352 WeakPolarHBondContact OD1-CD 3.45Å; D349-A353 WeakPolarHBondContact O-CB 3.32Å; D349-A353 PolarHBondContact O-N 2.81Å
350	P	88.6	Confident	85	Confident	31 Å²	31	48.2 Å²	48.2	20%	0.201	29%	0.285	C	S	.	.	H	α-helix	trans	-54.7	-31.9	-176.6	-28.9	34.2	0	0	0	115.2	A308 V309 Y311 L315 T354	A308-P350 HydrophobicContact CB-CG 4.09Å; V309-P350 HydrophobicContact CB-CG 4.37Å; V309-P350 HydrophobicContact CG2-CG 3.92Å; Y311-P350 HydrophobicContact CD2-CB 3.71Å; Y311-P350 HydrophobicContact CD2-CG 3.86Å; Y311-P350 HydrophobicContact CE2-CB 4.04Å; Y311-P350 HydrophobicContact CE2-CG 4.12Å; Y311-P350 HydrophobicContact CG-CB 4.48Å; L315-P350 HydrophobicContact CD2-CB 4.11Å; P350-T354 VanDerWaalsContact O-CB 3.29Å; P350-T354 WeakPolarHBondContact O-CB 3.45Å; P350-T354 PolarHBondContact O-N 3.25Å; P350-T354 PolarHBondContact O-OG1 3.01Å
351	A	87.5	Confident	85.2	Confident	1 Å²	1	48.3 Å²	48.3	1%	0.008	29%	0.286	C	S	.	.	H	α-helix	trans	-68.3	-58.1	-178.6	0	0	0	0	0	113.5	F289 T292 Y311 D349 A353 T355	F289-A351 HydrophobicContact CD2-CB 3.91Å; F289-A351 HydrophobicContact CE2-CB 3.79Å; T292-A351 HydrophobicContact CG2-CB 3.6Å; Y311-A351 HydrophobicContact CD1-CB 4.48Å; Y311-A351 HydrophobicContact CE1-CB 3.68Å; Y311-A351 HydrophobicContact CE2-CB 4.31Å; Y311-A351 WeakPolarHBondContact OH-CB 3.38Å; D349-A351 PolarHBondContact O-N 3.38Å; D349-A351 VanDerWaalsContact O-N 3.12Å; D349-A351 WeakPolarHBondContact OD1-CB 3.14Å; D349-A351 PolarHBondContact OD1-N 2.87Å; A351-A353 VanDerWaalsContact C-N 3.34Å; A351-T355 PolarHBondContact O-N 2.88Å; A351-T355 PolarHBondContact O-OG1 3.23Å
352	P	86.7	Confident	85.6	Confident	1 Å²	1	44.2 Å²	44.2	1%	0.006	27%	0.271	C	S	.	.	H	α-helix	trans	-62.2	-41.9	173.7	24.3	-32.5	0	0	0	111.1	I340 D349 T354 T355 F356	I340-P352 HydrophobicContact CG2-CB 4.36Å; D349-P352 HydrophobicContact CB-CG 3.83Å; D349-P352 WeakPolarHBondContact O-CD 3.44Å; D349-P352 VanDerWaalsContact O-CG 3.31Å; D349-P352 WeakPolarHBondContact O-CG 3.48Å; D349-P352 VanDerWaalsContact OD1-CD 3.25Å; D349-P352 WeakPolarHBondContact OD1-CD 3.45Å; P352-T354 VanDerWaalsContact C-N 3.33Å; P352-T354 PolarHBondContact O-N 3.36Å; P352-T355 CarbonylContact O-C 3.45Å; P352-T355 WeakPolarHBondContact O-CA 3.39Å; P352-T355 WeakPolarHBondContact O-CB 3.24Å; P352-T355 PolarHBondContact O-N 3.12Å; P352-F356 HydrophobicContact CB-CD2 4.3Å; P352-F356 HydrophobicContact CB-CE2 4.12Å; P352-F356 WeakPolarHBondContact O-CD2 3.49Å; P352-F356 PolarHBondContact O-N 2.94Å
353	A	88.4	Confident	86.3	Confident	44 Å²	44	43.4 Å²	43.4	36%	0.364	27%	0.267	S	S	.	.	H	α-helix	trans	-57.7	-43.2	-179.2	0	0	0	0	0	112.8	D349 A351 F356	D349-A353 WeakPolarHBondContact O-CB 3.32Å; D349-A353 PolarHBondContact O-N 2.81Å; A351-A353 VanDerWaalsContact C-N 3.34Å; A353-F356 PolarHBondContact O-N 3.26Å
354	T	89.9	Confident	86.9	Confident	31 Å²	31	43.7 Å²	43.7	19%	0.19	27%	0.268	C	S	.	.	H	α-helix	trans	-66.5	-40.6	175.8	-55.2	0	0	0	0	111	L315 A316 M319 P350 P352 A357 H358	L315-T354 HydrophobicContact CG-CG2 4.42Å; A316-T354 HydrophobicContact CB-CG2 4.4Å; M319-T354 HydrophobicContact CB-CG2 4.09Å; M319-T354 HydrophobicContact CG-CG2 4.16Å; P350-T354 VanDerWaalsContact O-CB 3.29Å; P350-T354 WeakPolarHBondContact O-CB 3.45Å; P350-T354 PolarHBondContact O-N 3.25Å; P350-T354 PolarHBondContact O-OG1 3.01Å; P352-T354 VanDerWaalsContact C-N 3.33Å; P352-T354 PolarHBondContact O-N 3.36Å; T354-A357 PolarHBondContact O-N 3.39Å; T354-H358 PolarHBondContact O-CD2 2.95Å; T354-H358 VanDerWaalsContact O-CD2 3.28Å
355	T	89.1	Confident	87.6	Confident	2 Å²	2	39.3 Å²	39.3	1%	0.012	23%	0.231	C	C	.	.	H	α-helix	trans	-64.1	-42.8	178.7	-51.4	0	0	0	0	111	I288 I340 A351 P352 A357 H358 L359	I288-T355 HydrophobicContact CG1-CG2 4.47Å; I288-T355 HydrophobicContact CG2-CG2 4.06Å; I340-T355 HydrophobicContact CD1-CG2 3.79Å; I340-T355 HydrophobicContact CG1-CG2 4.21Å; A351-T355 PolarHBondContact O-N 2.88Å; A351-T355 PolarHBondContact O-OG1 3.23Å; P352-T355 CarbonylContact O-C 3.45Å; P352-T355 WeakPolarHBondContact O-CA 3.39Å; P352-T355 WeakPolarHBondContact O-CB 3.24Å; P352-T355 PolarHBondContact O-N 3.12Å; T355-A357 PolarHBondContact O-N 3.01Å; T355-H358 PolarHBondContact O-N 2.84Å; T355-L359 HydrophobicContact CG2-CD2 4.36Å; T355-L359 HydrophobicContact CG2-CG 4.48Å; T355-L359 PolarHBondContact O-N 3.2Å
356	F	88	Confident	88.4	Confident	65 Å²	65	34 Å²	34	29%	0.285	21%	0.205	S	C	.	.	H	α-helix	trans	-54.6	-35.4	178.8	-88.4	-67.5	0	0	0	113.6	F185 L347 P352 A353 H358 L359 T362	F185-F356 HydrophobicContact CD1-CZ 4.21Å; F185-F356 AromaticContact CE1-CE1 3.97Å; F185-F356 HydrophobicContact CE1-CE1 3.97Å; F185-F356 AromaticContact CE1-CE2 3.7Å; F185-F356 HydrophobicContact CE1-CE2 3.7Å; F185-F356 AromaticContact CE1-CZ 3.29Å; F185-F356 HydrophobicContact CE1-CZ 3.29Å; F185-F356 AromaticContact CE2-CE1 3.74Å; F185-F356 HydrophobicContact CE2-CE1 3.74Å; F185-F356 AromaticContact CE2-CZ 3.91Å; F185-F356 HydrophobicContact CE2-CZ 3.91Å; F185-F356 HydrophobicContact CZ-CD1 4.01Å; F185-F356 HydrophobicContact CZ-CD2 4.45Å; F185-F356 AromaticContact CZ-CE1 3.26Å; F185-F356 HydrophobicContact CZ-CE1 3.26Å; F185-F356 AromaticContact CZ-CE2 3.76Å; F185-F356 HydrophobicContact CZ-CE2 3.76Å; F185-F356 AromaticContact CZ-CZ 3.11Å; F185-F356 HydrophobicContact CZ-CZ 3.11Å; L347-F356 HydrophobicContact CB-CE2 4.49Å; L347-F356 HydrophobicContact CD2-CE2 3.77Å; L347-F356 HydrophobicContact CD2-CZ 3.88Å; P352-F356 HydrophobicContact CB-CD2 4.3Å; P352-F356 HydrophobicContact CB-CE2 4.12Å; P352-F356 WeakPolarHBondContact O-CD2 3.49Å; P352-F356 PolarHBondContact O-N 2.94Å; A353-F356 PolarHBondContact O-N 3.26Å; F356-H358 PolarHBondContact O-N 3.44Å; F356-H358 VanDerWaalsContact O-N 3.14Å; F356-L359 HydrophobicContact CD1-CD1 4.09Å; F356-L359 PolarHBondContact O-N 2.93Å; F356-T362 HydrophobicContact CD1-CG2 4.09Å; F356-T362 HydrophobicContact CE1-CG2 3.76Å
357	A	89.1	Confident	88.8	Confident	69 Å²	69	38 Å²	38	57%	0.57	21%	0.214	S	C	*	.	H	α-helix	trans	-58.8	-28.4	179.2	0	0	0	0	0	112.5	T354 T355	T354-A357 PolarHBondContact O-N 3.39Å; T355-A357 PolarHBondContact O-N 3.01Å
358	H	92.1	Very high	89.5	Confident	34 Å²	34	35 Å²	35	16%	0.157	21%	0.207	C	C	.	.	H	α-helix	trans	-95.3	-13.3	-178.8	-58.4	-80.4	0	0	0	113.9	K181 Q323 E324 T354 T355 F356	K181-H358 HydrophobicContact CD-CB 4.25Å; K181-H358 WeakPolarHBondContact CD-O 3.2Å; Q323-H358 HydrophobicContact CB-CB 3.96Å; Q323-H358 HydrophobicContact CG-CB 3.96Å; E324-H358 IonicContact OE1-CE1 2.84Å; E324-H358 IonicContact OE1-ND1 2.75Å; E324-H358 PolarHBondContact OE1-ND1 3.4Å; E324-H358 VanDerWaalsContact OE1-ND1 3.08Å; T354-H358 PolarHBondContact O-CD2 2.95Å; T354-H358 VanDerWaalsContact O-CD2 3.28Å; T355-H358 PolarHBondContact O-N 2.84Å; F356-H358 PolarHBondContact O-N 3.44Å; F356-H358 VanDerWaalsContact O-N 3.14Å
359	L	92.4	Very high	89.9	Confident	6 Å²	6	30.6 Å²	30.6	3%	0.031	18%	0.179	C	C	.	.			trans	-79.4	141.6	-174.6	-59.2	177.6	0	0	0	112.6	K181 F185 I340 T355 F356 T362 R386	K181-L359 HydrophobicContact CB-CD2 4.17Å; K181-L359 CarbonylContact O-C 3.59Å; K181-L359 WeakPolarHBondContact O-CA 3.43Å; F185-L359 HydrophobicContact CE2-CD1 3.92Å; F185-L359 HydrophobicContact CZ-CD1 3.89Å; I340-L359 HydrophobicContact CD1-CD1 3.6Å; I340-L359 HydrophobicContact CD1-CD2 4.44Å; T355-L359 HydrophobicContact CG2-CD2 4.36Å; T355-L359 HydrophobicContact CG2-CG 4.48Å; T355-L359 PolarHBondContact O-N 3.2Å; F356-L359 HydrophobicContact CD1-CD1 4.09Å; F356-L359 PolarHBondContact O-N 2.93Å; L359-T362 HydrophobicContact CD1-CG2 4.17Å; L359-R386 PolarHBondContact O-NE 3.3Å; L359-R386 PolarHBondContact O-NH1 2.99Å; L359-R386 PolarHBondContact O-NH2 3.32Å; L359-R386 VanDerWaalsContact O-NH2 3.13Å
360	D	91.6	Very high	89.9	Confident	44 Å²	44	30.5 Å²	30.5	24%	0.235	18%	0.18	C	C	.	.	S	Bend	trans	-96.7	-27.2	173.6	-59.6	-58.7	0	0	0	112.7	G180 K181 R386	G180-D360 VanDerWaalsContact CA-OD2 3.25Å; G180-D360 WeakPolarHBondContact CA-OD2 3.44Å; K181-D360 PolarHBondContact N-OD2 2.79Å; K181-D360 PolarHBondContact O-N 2.89Å; D360-R386 WeakPolarHBondContact O-CB 3.24Å; D360-R386 WeakPolarHBondContact O-CG 3.44Å; D360-R386 PolarHBondContact O-N 2.87Å; D360-R386 IonicContact OD1-CZ 3.22Å; D360-R386 IonicContact OD1-NH1 3.18Å; D360-R386 PolarHBondContact OD1-NH1 3.25Å
361	A	92.7	Very high	90	Very high	3 Å²	3	36 Å²	36	3%	0.025	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	150.3	174.8	0	0	0	0	0	111.4	Y176 K181 I182 G183 T384	Y176-A361 HydrophobicContact CD1-CB 4.22Å; K181-A361 PolarHBondContact O-N 3.15Å; I182-A361 WeakPolarHBondContact CA-O 3.49Å; I182-A361 HydrophobicContact CG1-CB 4.3Å; G183-A361 PolarHBondContact N-O 2.92Å; A361-T384 CarbonylContact C-O 3.33Å; A361-T384 WeakPolarHBondContact CA-O 3.42Å
362	T	92.4	Very high	90	Very high	17 Å²	17	41.2 Å²	41.2	10%	0.104	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	120.6	179.1	63.4	0	0	0	0	108.2	F185 F356 L359 S383 T384	F185-T362 HydrophobicContact CE2-CG2 3.99Å; F356-T362 HydrophobicContact CD1-CG2 4.09Å; F356-T362 HydrophobicContact CE1-CG2 3.76Å; L359-T362 HydrophobicContact CD1-CG2 4.17Å; T362-S383 CarbonylContact O-C 3.57Å; T362-S383 WeakPolarHBondContact O-CA 3.41Å; T362-S383 WeakPolarHBondContact O-CB 3.29Å; T362-T384 PolarHBondContact N-O 3.09Å; T362-T384 PolarHBondContact O-N 3.39Å; T362-T384 PolarHBondContact OG1-N 3.04Å; T362-T384 PolarHBondContact OG1-OG1 3.37Å
363	T	93.1	Very high	90.1	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	113.5	173.9	-60.3	0	0	0	0	107.9	Y176 G183 L184 F185 L195 V378	Y176-T363 PolarHBondContact OH-OG1 2.79Å; Y176-T363 VanDerWaalsContact OH-OG1 3.09Å; G183-T363 PolarHBondContact O-N 3.15Å; L184-T363 WeakPolarHBondContact CA-O 3.33Å; L184-T363 HydrophobicContact CD2-CG2 4.06Å; F185-T363 PolarHBondContact N-O 2.9Å; L195-T363 HydrophobicContact CD2-CG2 4.35Å; T363-V378 HydrophobicContact CG2-CB 4.39Å; T363-V378 HydrophobicContact CG2-CG1 3.74Å; T363-V378 HydrophobicContact CG2-CG2 3.73Å
364	V	91.3	Very high	90.2	Very high	33 Å²	33	40.9 Å²	40.9	20%	0.2	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	121.6	-176.8	-178.9	0	0	0	0	108.6	F185 V378 D379 D382 S383	F185-V364 HydrophobicContact CB-CB 4.49Å; F185-V364 HydrophobicContact CB-CG1 4.47Å; F185-V364 HydrophobicContact CB-CG2 4.15Å; V364-V378 CarbonylContact O-C 3.56Å; V364-V378 WeakPolarHBondContact O-CA 3.48Å; V364-D379 HydrophobicContact CB-CB 4.33Å; V364-D379 HydrophobicContact CG1-CB 4.42Å; V364-D379 PolarHBondContact O-N 2.96Å; V364-D382 HydrophobicContact CB-CB 4.08Å; V364-D382 HydrophobicContact CG1-CB 4.25Å; V364-D382 HydrophobicContact CG2-CB 4Å; V364-D382 WeakPolarHBondContact CG2-O 3.24Å; V364-S383 PolarHBondContact N-OG 3.23Å
365	L	90.7	Very high	90.3	Very high	5 Å²	5	44 Å²	44	3%	0.026	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	113.2	172.7	-67.5	163.1	0	0	0	109.2	F185 G186 V190 K192 L195 A377 V378	F185-L365 WeakPolarHBondContact O-CB 3.35Å; F185-L365 PolarHBondContact O-N 3.16Å; G186-L365 WeakPolarHBondContact CA-O 3.39Å; V190-L365 HydrophobicContact CB-CB 3.96Å; V190-L365 HydrophobicContact CG2-CB 3.42Å; V190-L365 VanDerWaalsContact CG2-CB 3.42Å; V190-L365 HydrophobicContact CG2-CD1 4.14Å; V190-L365 HydrophobicContact CG2-CG 4.4Å; K192-L365 HydrophobicContact CB-CD1 4.18Å; K192-L365 HydrophobicContact CG-CD1 3.41Å; K192-L365 VanDerWaalsContact CG-CD1 3.41Å; L195-L365 HydrophobicContact CD2-CD1 4.23Å; L195-L365 HydrophobicContact CD2-CD2 4.31Å; L365-A377 CarbonylContact C-O 3.18Å; L365-A377 VanDerWaalsContact CA-O 3.25Å; L365-A377 WeakPolarHBondContact CA-O 3.28Å; L365-A377 HydrophobicContact CD2-CB 4.33Å; L365-V378 HydrophobicContact CD2-CB 4.45Å; L365-V378 HydrophobicContact CD2-CG2 3.62Å
366	S	88.7	Confident	90.5	Very high	31 Å²	31	44.3 Å²	44.3	22%	0.217	24%	0.239	C	C	.	.			trans	-96.8	135.5	-173.3	176.3	0	0	0	0	111.6	G368 I369 A370 A377	S366-G368 VanDerWaalsContact C-N 3.31Å; S366-G368 PolarHBondContact O-N 3.14Å; S366-G368 PolarHBondContact OG-N 3.42Å; S366-I369 PolarHBondContact O-N 3.21Å; S366-A370 PolarHBondContact O-N 3.01Å; S366-A377 PolarHBondContact N-O 3.44Å
367	R	88.1	Confident	90.8	Very high	155 Å²	155	41.2 Å²	41.2	59%	0.585	23%	0.225	S	C	*	.	H	α-helix	trans	-63	-39.6	172.6	-174.4	-179.3	-63.2	174	4.7	111.5	V190 I369 A370 E371	V190-R367 HydrophobicContact CG1-CB 4.38Å; R367-I369 PolarHBondContact O-N 3.08Å; R367-A370 WeakPolarHBondContact O-CB 3.43Å; R367-A370 PolarHBondContact O-N 2.99Å; R367-A370 VanDerWaalsContact O-N 3.11Å; R367-E371 WeakPolarHBondContact CD-OE1 3.38Å; R367-E371 HydrophobicContact CG-CG 4.2Å; R367-E371 WeakPolarHBondContact CG-OE1 3.47Å; R367-E371 WeakPolarHBondContact O-CG 3.49Å; R367-E371 PolarHBondContact O-N 2.89Å
368	G	87.9	Confident	91	Very high	35 Å²	35	38.2 Å²	38.2	36%	0.361	20%	0.2	S	C	.	.	H	α-helix	trans	-60.4	-35.2	-179.5	0	0	0	0	0	112.3	S366 L372	S366-G368 VanDerWaalsContact C-N 3.31Å; S366-G368 PolarHBondContact O-N 3.14Å; S366-G368 PolarHBondContact OG-N 3.42Å; G368-L372 WeakPolarHBondContact O-CG 3.34Å; G368-L372 PolarHBondContact O-N 2.9Å
369	I	91.1	Very high	91.1	Very high	20 Å²	20	37.5 Å²	37.5	10%	0.103	20%	0.197	C	C	.	.	H	α-helix	trans	-73.2	-39.7	176.5	-61.3	-179.9	0	0	0	111.2	S366 R367 E371 L372 G373 I374 A377 V378 D379	S366-I369 PolarHBondContact O-N 3.21Å; R367-I369 PolarHBondContact O-N 3.08Å; I369-E371 VanDerWaalsContact C-N 3.32Å; I369-E371 PolarHBondContact O-N 2.69Å; I369-L372 WeakPolarHBondContact O-CB 3.3Å; I369-L372 PolarHBondContact O-N 2.71Å; I369-G373 PolarHBondContact O-N 3.46Å; I369-I374 HydrophobicContact CG2-CB 3.7Å; I369-I374 HydrophobicContact CG2-CG2 3.72Å; I369-I374 PolarHBondContact O-N 3.16Å; I369-A377 HydrophobicContact CB-CB 4.36Å; I369-A377 HydrophobicContact CG2-CB 4.28Å; I369-V378 VanDerWaalsContact CD1-O 3.28Å; I369-V378 WeakPolarHBondContact CD1-O 3.37Å; I369-D379 VanDerWaalsContact CD1-CA 3.43Å; I369-D379 HydrophobicContact CD1-CB 3.98Å
370	A	89	Confident	91.1	Very high	13 Å²	13	37.7 Å²	37.7	11%	0.107	20%	0.199	C	C	.	.	H	α-helix	trans	-62.8	-38.2	174.6	0	0	0	0	0	112.3	S366 R367 L372 G373 Y375 A377	S366-A370 PolarHBondContact O-N 3.01Å; R367-A370 WeakPolarHBondContact O-CB 3.43Å; R367-A370 PolarHBondContact O-N 2.99Å; R367-A370 VanDerWaalsContact O-N 3.11Å; A370-L372 VanDerWaalsContact C-N 3.29Å; A370-L372 PolarHBondContact O-N 2.96Å; A370-G373 WeakPolarHBondContact O-CA 3.32Å; A370-G373 PolarHBondContact O-N 3.28Å; A370-Y375 HydrophobicContact CB-CE1 4.17Å; A370-Y375 PolarHBondContact O-OH 3.37Å; A370-A377 HydrophobicContact CB-CB 3.87Å
371	E	89.7	Confident	91.2	Very high	148 Å²	148	37.4 Å²	37.4	69%	0.692	20%	0.197	S	C	*	.	H	α-helix	trans	-65.7	-30.6	176	-74.1	171.6	-176.5	0	0	112.6	R367 I369 G373	R367-E371 WeakPolarHBondContact CD-OE1 3.38Å; R367-E371 HydrophobicContact CG-CG 4.2Å; R367-E371 WeakPolarHBondContact CG-OE1 3.47Å; R367-E371 WeakPolarHBondContact O-CG 3.49Å; R367-E371 PolarHBondContact O-N 2.89Å; I369-E371 VanDerWaalsContact C-N 3.32Å; I369-E371 PolarHBondContact O-N 2.69Å; E371-G373 PolarHBondContact O-N 2.72Å
372	L	88.2	Confident	91.1	Very high	110 Å²	110	41.5 Å²	41.5	58%	0.576	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73	-3.5	170.4	-65.2	172.2	0	0	0	113	G368 I369 A370 I374	G368-L372 WeakPolarHBondContact O-CG 3.34Å; G368-L372 PolarHBondContact O-N 2.9Å; I369-L372 WeakPolarHBondContact O-CB 3.3Å; I369-L372 PolarHBondContact O-N 2.71Å; A370-L372 VanDerWaalsContact C-N 3.29Å; A370-L372 PolarHBondContact O-N 2.96Å; L372-I374 VanDerWaalsContact C-N 3.3Å; L372-I374 HydrophobicContact CB-CD1 4.14Å; L372-I374 HydrophobicContact CB-CG1 4.34Å; L372-I374 HydrophobicContact CD1-CD1 4.49Å
373	G	89.2	Confident	91.1	Very high	22 Å²	22	40.7 Å²	40.7	23%	0.227	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.3	15.4	-177.4	0	0	0	0	0	113.9	I369 A370 E371 Y375 Y488	I369-G373 PolarHBondContact O-N 3.46Å; A370-G373 WeakPolarHBondContact O-CA 3.32Å; A370-G373 PolarHBondContact O-N 3.28Å; E371-G373 PolarHBondContact O-N 2.72Å; G373-Y375 WeakPolarHBondContact O-CD2 3.27Å; G373-Y488 WeakPolarHBondContact O-CE2 3.4Å; G373-Y488 PolarHBondContact O-OH 2.93Å
374	I	90.7	Very high	91.1	Very high	15 Å²	15	44.5 Å²	44.5	8%	0.077	24%	0.237	C	C	.	.			trans	-90.9	120	-178.7	-66.7	167.6	0	0	0	109.1	I369 L372 Q441	I369-I374 HydrophobicContact CG2-CB 3.7Å; I369-I374 HydrophobicContact CG2-CG2 3.72Å; I369-I374 PolarHBondContact O-N 3.16Å; L372-I374 VanDerWaalsContact C-N 3.3Å; L372-I374 HydrophobicContact CB-CD1 4.14Å; L372-I374 HydrophobicContact CB-CG1 4.34Å; L372-I374 HydrophobicContact CD1-CD1 4.49Å; I374-Q441 HydrophobicContact CD1-CB 3.94Å
375	Y	91.2	Very high	91.2	Very high	97 Å²	97	43.7 Å²	43.7	38%	0.38	23%	0.233	S	C	.	.	S	Bend	trans	-127.5	136	178.5	-65.1	-82.9	0	0	0	111.4	A370 G373 S445 Q446 M489	A370-Y375 HydrophobicContact CB-CE1 4.17Å; A370-Y375 PolarHBondContact O-OH 3.37Å; G373-Y375 WeakPolarHBondContact O-CD2 3.27Å; Y375-S445 CarbonylContact O-C 3.54Å; Y375-S445 WeakPolarHBondContact O-CA 3.35Å; Y375-S445 VanDerWaalsContact O-CB 3.26Å; Y375-S445 WeakPolarHBondContact O-CB 3.31Å; Y375-Q446 PolarHBondContact O-N 3.26Å; Y375-M489 HydrophobicContact CD2-CE 4.39Å
376	P	94.1	Very high	91.2	Very high	8 Å²	8	50.6 Å²	50.6	5%	0.052	26%	0.258	C	S	.	.	S	Bend	cis	-68.1	147.2	-0.2	32.2	-38.2	0	0	0	112.1	I167 V169 L195 V378 F448	I167-P376 HydrophobicContact CG2-CG 4.13Å; V169-P376 HydrophobicContact CG1-CG 3.69Å; L195-P376 HydrophobicContact CD1-CB 4.39Å; P376-V378 HydrophobicContact CB-CG2 4.12Å; P376-V378 HydrophobicContact CG-CG2 4.28Å; P376-V378 PolarHBondContact O-N 3.12Å; P376-F448 HydrophobicContact CB-CE1 4.5Å; P376-F448 HydrophobicContact CB-CE2 3.95Å; P376-F448 HydrophobicContact CB-CZ 3.57Å; P376-F448 HydrophobicContact CG-CE1 4.12Å; P376-F448 HydrophobicContact CG-CE2 4.44Å; P376-F448 HydrophobicContact CG-CZ 3.57Å
377	A	92.8	Very high	91.3	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.249	C	C	.	.			trans	-78.8	37.2	-172.2	0	0	0	0	0	113.3	L365 S366 I369 A370	L365-A377 CarbonylContact C-O 3.18Å; L365-A377 VanDerWaalsContact CA-O 3.25Å; L365-A377 WeakPolarHBondContact CA-O 3.28Å; L365-A377 HydrophobicContact CD2-CB 4.33Å; S366-A377 PolarHBondContact N-O 3.44Å; I369-A377 HydrophobicContact CB-CB 4.36Å; I369-A377 HydrophobicContact CG2-CB 4.28Å; A370-A377 HydrophobicContact CB-CB 3.87Å
378	V	94.7	Very high	91.5	Very high	7 Å²	7	42.8 Å²	42.8	4%	0.042	23%	0.225	C	C	.	.	B	Isolated β-bridge	trans	-76.1	127.6	-174.9	177.2	0	0	0	0	109.9	V169 T363 V364 L365 I369 P376 P380 S383	V169-V378 HydrophobicContact CB-CB 4.45Å; V169-V378 HydrophobicContact CG1-CB 3.83Å; V169-V378 HydrophobicContact CG1-CG1 4.29Å; V169-V378 HydrophobicContact CG1-CG2 3.87Å; V169-V378 HydrophobicContact CG2-CB 3.74Å; V169-V378 HydrophobicContact CG2-CG1 3.61Å; T363-V378 HydrophobicContact CG2-CB 4.39Å; T363-V378 HydrophobicContact CG2-CG1 3.74Å; T363-V378 HydrophobicContact CG2-CG2 3.73Å; V364-V378 CarbonylContact O-C 3.56Å; V364-V378 WeakPolarHBondContact O-CA 3.48Å; L365-V378 HydrophobicContact CD2-CB 4.45Å; L365-V378 HydrophobicContact CD2-CG2 3.62Å; I369-V378 VanDerWaalsContact CD1-O 3.28Å; I369-V378 WeakPolarHBondContact CD1-O 3.37Å; P376-V378 HydrophobicContact CB-CG2 4.12Å; P376-V378 HydrophobicContact CG-CG2 4.28Å; P376-V378 PolarHBondContact O-N 3.12Å; V378-P380 VanDerWaalsContact O-CD 3.32Å; V378-P380 WeakPolarHBondContact O-CD 3.48Å; V378-S383 WeakPolarHBondContact CG1-OG 3.26Å
379	D	93.8	Very high	91.7	Very high	19 Å²	19	44 Å²	44	10%	0.102	22%	0.224	C	C	.	.			trans	-76.8	113.2	174.3	-162.3	-52	0	0	0	110.7	V364 I369 L381 D382 S383	V364-D379 HydrophobicContact CB-CB 4.33Å; V364-D379 HydrophobicContact CG1-CB 4.42Å; V364-D379 PolarHBondContact O-N 2.96Å; I369-D379 VanDerWaalsContact CD1-CA 3.43Å; I369-D379 HydrophobicContact CD1-CB 3.98Å; D379-L381 PolarHBondContact O-N 2.98Å; D379-L381 PolarHBondContact OD1-N 3.07Å; D379-D382 HydrophobicContact CB-CB 4.13Å; D379-D382 PolarHBondContact OD1-N 3.3Å; D379-D382 VanDerWaalsContact OD1-N 3.14Å; D379-S383 WeakPolarHBondContact O-CB 3.24Å; D379-S383 PolarHBondContact O-N 2.94Å; D379-S383 PolarHBondContact O-OG 3.45Å
380	P	92.6	Very high	91.7	Very high	9 Å²	9	44.6 Å²	44.6	6%	0.058	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-16.9	-176.4	29.5	-34.8	0	0	0	113.9	L173 V378 Q405 L408 L444	L173-P380 HydrophobicContact CD1-CB 3.23Å; V378-P380 VanDerWaalsContact O-CD 3.32Å; V378-P380 WeakPolarHBondContact O-CD 3.48Å; P380-Q405 PolarHBondContact O-NE2 3Å; P380-L408 HydrophobicContact CB-CD1 3.68Å; P380-L408 HydrophobicContact CG-CD1 3.54Å; P380-L444 HydrophobicContact CB-CD1 4.21Å; P380-L444 HydrophobicContact CG-CD1 4.33Å
381	L	93.2	Very high	91.8	Very high	39 Å²	39	50.9 Å²	50.9	20%	0.204	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.1	-36.9	-178.6	-61.8	177.5	0	0	0	111.6	D379 Q405 L408 Q409 K412	D379-L381 PolarHBondContact O-N 2.98Å; D379-L381 PolarHBondContact OD1-N 3.07Å; L381-Q405 HydrophobicContact CD2-CB 4.45Å; L381-L408 HydrophobicContact CD2-CB 4.2Å; L381-Q409 HydrophobicContact CD2-CB 4.21Å; L381-K412 HydrophobicContact CD1-CD 3.86Å
382	D	90.8	Very high	91.9	Very high	89 Å²	89	46.5 Å²	46.5	48%	0.476	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-12.9	-179.9	-65.6	-22.9	0	0	0	113.3	V364 D379	V364-D382 HydrophobicContact CB-CB 4.08Å; V364-D382 HydrophobicContact CG1-CB 4.25Å; V364-D382 HydrophobicContact CG2-CB 4Å; V364-D382 WeakPolarHBondContact CG2-O 3.24Å; D379-D382 HydrophobicContact CB-CB 4.13Å; D379-D382 PolarHBondContact OD1-N 3.3Å; D379-D382 VanDerWaalsContact OD1-N 3.14Å
383	S	92.9	Very high	92.1	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.219	C	C	.	.			trans	-84.3	135	173.2	-56.3	0	0	0	0	111.5	T362 V364 V378 D379	T362-S383 CarbonylContact O-C 3.57Å; T362-S383 WeakPolarHBondContact O-CA 3.41Å; T362-S383 WeakPolarHBondContact O-CB 3.29Å; V364-S383 PolarHBondContact N-OG 3.23Å; V378-S383 WeakPolarHBondContact CG1-OG 3.26Å; D379-S383 WeakPolarHBondContact O-CB 3.24Å; D379-S383 PolarHBondContact O-N 2.94Å; D379-S383 PolarHBondContact O-OG 3.45Å
384	T	92.6	Very high	92.3	Very high	79 Å²	79	42.4 Å²	42.4	49%	0.485	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	156.5	-175.1	72.7	0	0	0	0	111.8	A361 T362	A361-T384 CarbonylContact C-O 3.33Å; A361-T384 WeakPolarHBondContact CA-O 3.42Å; T362-T384 PolarHBondContact N-O 3.09Å; T362-T384 PolarHBondContact O-N 3.39Å; T362-T384 PolarHBondContact OG1-N 3.04Å; T362-T384 PolarHBondContact OG1-OG1 3.37Å
385	S	93.6	Very high	92.5	Very high	17 Å²	17	47.6 Å²	47.6	12%	0.119	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	138.6	173.4	177.1	0	0	0	0	110.4	P175 I387 M388	P175-S385 WeakPolarHBondContact O-CB 3.14Å; P175-S385 PolarHBondContact O-OG 3.24Å; S385-I387 PolarHBondContact O-N 3.39Å; S385-I387 WeakPolarHBondContact OG-CG1 3.28Å; S385-I387 PolarHBondContact OG-N 3.21Å; S385-M388 WeakPolarHBondContact O-CB 3.5Å; S385-M388 PolarHBondContact O-N 2.95Å
386	R	90.2	Very high	92.8	Very high	149 Å²	149	48 Å²	48	56%	0.562	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-28.3	176.8	-72.5	-177.6	-177.7	167.1	-4.3	112.8	L359 D360 M388	L359-R386 PolarHBondContact O-NE 3.3Å; L359-R386 PolarHBondContact O-NH1 2.99Å; L359-R386 PolarHBondContact O-NH2 3.32Å; L359-R386 VanDerWaalsContact O-NH2 3.13Å; D360-R386 WeakPolarHBondContact O-CB 3.24Å; D360-R386 WeakPolarHBondContact O-CG 3.44Å; D360-R386 PolarHBondContact O-N 2.87Å; D360-R386 IonicContact OD1-CZ 3.22Å; D360-R386 IonicContact OD1-NH1 3.18Å; D360-R386 PolarHBondContact OD1-NH1 3.25Å; R386-M388 PolarHBondContact O-N 2.87Å
387	I	91.1	Very high	92.9	Very high	5 Å²	5	47.9 Å²	47.9	3%	0.026	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.1	2.3	179.9	60.7	152.8	0	0	0	113.1	I162 P175 A177 S385 D389 I392 V393	I162-I387 HydrophobicContact CG1-CD1 4.04Å; P175-I387 HydrophobicContact CB-CD1 3.88Å; P175-I387 HydrophobicContact CB-CG1 4.47Å; P175-I387 HydrophobicContact CG-CD1 3.95Å; P175-I387 HydrophobicContact CG-CG1 4.06Å; P175-I387 WeakPolarHBondContact O-CD1 3.21Å; P175-I387 WeakPolarHBondContact O-CG1 3.26Å; A177-I387 HydrophobicContact CB-CD1 4.32Å; A177-I387 HydrophobicContact CB-CG2 3.9Å; S385-I387 PolarHBondContact O-N 3.39Å; S385-I387 WeakPolarHBondContact OG-CG1 3.28Å; S385-I387 PolarHBondContact OG-N 3.21Å; I387-D389 PolarHBondContact O-N 3.42Å; I387-I392 HydrophobicContact CB-CD1 4.27Å; I387-I392 HydrophobicContact CB-CG2 4.08Å; I387-I392 HydrophobicContact CG2-CD1 4.29Å; I387-I392 HydrophobicContact CG2-CG2 4.45Å; I387-V393 VanDerWaalsContact O-CG1 3.26Å; I387-V393 WeakPolarHBondContact O-CG1 3.27Å
388	M	92.5	Very high	93.1	Very high	17 Å²	17	51 Å²	51	8%	0.084	26%	0.258	C	S	.	.			trans	-74	60	171.3	-167.9	56.5	74.7	0	0	111.1	L172 L173 P175 S385 R386 V393 Y398 A401	L172-M388 WeakPolarHBondContact O-CE 2.98Å; L173-M388 WeakPolarHBondContact O-CE 3.37Å; P175-M388 HydrophobicContact CG-CE 3.74Å; S385-M388 WeakPolarHBondContact O-CB 3.5Å; S385-M388 PolarHBondContact O-N 2.95Å; R386-M388 PolarHBondContact O-N 2.87Å; M388-V393 HydrophobicContact SD-CG2 4.14Å; M388-Y398 HydrophobicContact CG-CD2 4.29Å; M388-Y398 HydrophobicContact CG-CE2 4.5Å; M388-Y398 WeakPolarHBondContact O-CE2 3.36Å; M388-Y398 HydrophobicContact SD-CD2 4.31Å; M388-A401 HydrophobicContact CE-CB 4.12Å; M388-A401 HydrophobicContact SD-CB 4.06Å
389	D	91.1	Very high	93.2	Very high	62 Å²	62	54.5 Å²	54.5	33%	0.332	28%	0.279	S	S	.	.	S	Bend	trans	-122.6	133.1	177.7	-173	-57.7	0	0	0	108.5	I387 N391 I392 V393	I387-D389 PolarHBondContact O-N 3.42Å; D389-N391 PolarHBondContact O-N 3.04Å; D389-N391 VanDerWaalsContact OD1-CB 3.29Å; D389-N391 WeakPolarHBondContact OD1-CB 3.36Å; D389-N391 PolarHBondContact OD1-N 3.22Å; D389-N391 PolarHBondContact OD1-ND2 3.31Å; D389-I392 HydrophobicContact CB-CD1 3.99Å; D389-I392 HydrophobicContact CB-CG1 4.35Å; D389-I392 PolarHBondContact O-N 2.65Å; D389-V393 VanDerWaalsContact O-CG2 3.25Å; D389-V393 WeakPolarHBondContact O-CG2 3.4Å; D389-V393 PolarHBondContact O-N 3.39Å
390	P	92.7	Very high	93.4	Very high	31 Å²	31	54.3 Å²	54.3	20%	0.201	28%	0.278	C	S	.	.	H	α-helix	trans	-57.4	-24.2	-178.8	24.8	-35.6	0	0	0	113.7	I392 G394 E395 Y398	P390-I392 VanDerWaalsContact C-N 3.3Å; P390-I392 PolarHBondContact O-N 2.69Å; P390-G394 CarbonylContact O-C 3.55Å; P390-G394 WeakPolarHBondContact O-CA 3.45Å; P390-G394 PolarHBondContact O-N 3.24Å; P390-E395 HydrophobicContact CB-CG 4.39Å; P390-Y398 HydrophobicContact CB-CD1 4.35Å; P390-Y398 HydrophobicContact CB-CG 4.11Å; P390-Y398 HydrophobicContact CG-CG 4.48Å
391	N	91.1	Very high	93.6	Very high	145 Å²	145	54 Å²	54	78%	0.775	28%	0.276	S	S	*	.	H	α-helix	trans	-75	-18	176.4	-59.3	-67.8	0	0	0	113.5	D389	D389-N391 PolarHBondContact O-N 3.04Å; D389-N391 VanDerWaalsContact OD1-CB 3.29Å; D389-N391 WeakPolarHBondContact OD1-CB 3.36Å; D389-N391 PolarHBondContact OD1-N 3.22Å; D389-N391 PolarHBondContact OD1-ND2 3.31Å
392	I	90.2	Very high	93.8	Very high	56 Å²	56	57.1 Å²	57.1	29%	0.287	29%	0.285	S	S	.	.	H	α-helix	trans	-105.1	-56.5	-178.6	-58.2	163.2	0	0	0	110.4	I387 D389 P390 G394	I387-I392 HydrophobicContact CB-CD1 4.27Å; I387-I392 HydrophobicContact CB-CG2 4.08Å; I387-I392 HydrophobicContact CG2-CD1 4.29Å; I387-I392 HydrophobicContact CG2-CG2 4.45Å; D389-I392 HydrophobicContact CB-CD1 3.99Å; D389-I392 HydrophobicContact CB-CG1 4.35Å; D389-I392 PolarHBondContact O-N 2.65Å; P390-I392 VanDerWaalsContact C-N 3.3Å; P390-I392 PolarHBondContact O-N 2.69Å; I392-G394 VanDerWaalsContact C-N 3.35Å
393	V	92.2	Very high	94.1	Very high	18 Å²	18	54 Å²	54	11%	0.109	27%	0.273	C	S	.	.	H	α-helix	trans	-82.4	-14.7	-178.7	-66.9	0	0	0	0	113.5	I162 P175 I387 M388 D389 H397	I162-V393 HydrophobicContact CD1-CB 4.33Å; I162-V393 HydrophobicContact CD1-CG1 3.79Å; P175-V393 HydrophobicContact CG-CG1 4.03Å; I387-V393 VanDerWaalsContact O-CG1 3.26Å; I387-V393 WeakPolarHBondContact O-CG1 3.27Å; M388-V393 HydrophobicContact SD-CG2 4.14Å; D389-V393 VanDerWaalsContact O-CG2 3.25Å; D389-V393 WeakPolarHBondContact O-CG2 3.4Å; D389-V393 PolarHBondContact O-N 3.39Å; V393-H397 HydrophobicContact CB-CB 4.07Å; V393-H397 HydrophobicContact CG2-CB 4.25Å; V393-H397 WeakPolarHBondContact O-CB 3.38Å
394	G	93.6	Very high	94.3	Very high	29 Å²	29	54 Å²	54	30%	0.299	27%	0.273	S	S	.	.			trans	87.5	150	-173.5	0	0	0	0	0	113.3	P390 I392 R396 H397 Y398	P390-G394 CarbonylContact O-C 3.55Å; P390-G394 WeakPolarHBondContact O-CA 3.45Å; P390-G394 PolarHBondContact O-N 3.24Å; I392-G394 VanDerWaalsContact C-N 3.35Å; G394-R396 VanDerWaalsContact C-N 3.26Å; G394-R396 PolarHBondContact O-N 2.91Å; G394-H397 PolarHBondContact O-N 2.85Å; G394-Y398 WeakPolarHBondContact O-CB 3.3Å; G394-Y398 PolarHBondContact O-N 3.47Å
395	E	95.4	Very high	94.4	Very high	123 Å²	123	51.6 Å²	51.6	58%	0.575	26%	0.257	S	S	*	.	H	α-helix	trans	-55.3	-39	-177.9	-76.4	-68.6	174.6	0	0	113.5	P390 T399	P390-E395 HydrophobicContact CB-CG 4.39Å; E395-T399 VanDerWaalsContact O-CB 3.23Å; E395-T399 WeakPolarHBondContact O-CB 3.45Å; E395-T399 PolarHBondContact O-N 3.41Å; E395-T399 PolarHBondContact O-OG1 2.69Å
396	R	97	Very high	94.6	Very high	107 Å²	107	57.3 Å²	57.3	40%	0.404	28%	0.28	S	S	.	.	H	α-helix	trans	-65.4	-52.8	-179.2	-175.9	178.1	172.9	-134.9	-3.3	110.7	G394 Y398 T399 I400 E465 I468 E472	G394-R396 VanDerWaalsContact C-N 3.26Å; G394-R396 PolarHBondContact O-N 2.91Å; R396-Y398 PolarHBondContact O-N 3.48Å; R396-T399 PolarHBondContact O-N 2.99Å; R396-I400 VanDerWaalsContact O-CG1 3.25Å; R396-I400 WeakPolarHBondContact O-CG1 3.4Å; R396-I400 PolarHBondContact O-N 2.78Å; R396-I400 VanDerWaalsContact O-N 3.13Å; R396-E465 IonicContact CZ-OE2 3.28Å; R396-E465 IonicContact NH1-OE2 3.95Å; R396-E465 PolarHBondContact NH1-OE2 3.13Å; R396-I468 HydrophobicContact CG-CG2 4.02Å; R396-E472 IonicContact CZ-OE2 2.68Å; R396-E472 IonicContact NE-OE2 3.04Å; R396-E472 PolarHBondContact NE-OE2 3.28Å; R396-E472 IonicContact NH2-OE2 3.06Å; R396-E472 PolarHBondContact NH2-OE2 2.93Å
397	H	97.3	Very high	94.9	Very high	4 Å²	4	51.2 Å²	51.2	2%	0.019	26%	0.258	C	S	.	.	H	α-helix	trans	-58.5	-50.9	178.3	-171.8	166.8	0	0	0	110.1	D171 L172 V393 G394 T399 I400 A401 I468	D171-H397 PolarHBondContact O-CE1 3.01Å; D171-H397 PolarHBondContact O-NE2 3.14Å; L172-H397 PolarHBondContact O-NE2 2.84Å; V393-H397 HydrophobicContact CB-CB 4.07Å; V393-H397 HydrophobicContact CG2-CB 4.25Å; V393-H397 WeakPolarHBondContact O-CB 3.38Å; G394-H397 PolarHBondContact O-N 2.85Å; H397-T399 PolarHBondContact O-N 3.16Å; H397-I400 PolarHBondContact O-N 3.45Å; H397-A401 WeakPolarHBondContact O-CB 3.48Å; H397-A401 PolarHBondContact O-N 2.9Å; H397-I468 HydrophobicContact CB-CD1 3.77Å
398	Y	96.7	Very high	95.2	Very high	67 Å²	67	51.3 Å²	51.3	26%	0.263	26%	0.258	S	S	.	.	H	α-helix	trans	-56.6	-49.9	-179.4	-177.3	-93.7	0	0	0	112.6	M388 P390 G394 R396 I400 A401 R402	M388-Y398 HydrophobicContact CG-CD2 4.29Å; M388-Y398 HydrophobicContact CG-CE2 4.5Å; M388-Y398 WeakPolarHBondContact O-CE2 3.36Å; M388-Y398 HydrophobicContact SD-CD2 4.31Å; P390-Y398 HydrophobicContact CB-CD1 4.35Å; P390-Y398 HydrophobicContact CB-CG 4.11Å; P390-Y398 HydrophobicContact CG-CG 4.48Å; G394-Y398 WeakPolarHBondContact O-CB 3.3Å; G394-Y398 PolarHBondContact O-N 3.47Å; R396-Y398 PolarHBondContact O-N 3.48Å; Y398-I400 PolarHBondContact O-N 3.49Å; Y398-A401 PolarHBondContact O-N 2.67Å; Y398-R402 HydrophobicContact CD1-CG 4.1Å; Y398-R402 HydrophobicContact CD2-CG 4.5Å; Y398-R402 HydrophobicContact CE1-CG 3.73Å; Y398-R402 HydrophobicContact CE2-CG 4.19Å; Y398-R402 HydrophobicContact CG-CG 4.47Å; Y398-R402 WeakPolarHBondContact O-CB 3.4Å; Y398-R402 VanDerWaalsContact O-CG 3.32Å; Y398-R402 WeakPolarHBondContact O-CG 3.44Å; Y398-R402 PolarHBondContact O-N 2.86Å; Y398-R402 PolarHBondContact OH-NE 3.42Å
399	T	97.5	Very high	95.4	Very high	80 Å²	80	54.4 Å²	54.4	49%	0.491	27%	0.273	S	S	.	.	H	α-helix	trans	-62	-43	-178.3	-61.3	0	0	0	0	111.9	E395 R396 H397 G403	E395-T399 VanDerWaalsContact O-CB 3.23Å; E395-T399 WeakPolarHBondContact O-CB 3.45Å; E395-T399 PolarHBondContact O-N 3.41Å; E395-T399 PolarHBondContact O-OG1 2.69Å; R396-T399 PolarHBondContact O-N 2.99Å; H397-T399 PolarHBondContact O-N 3.16Å; T399-G403 PolarHBondContact O-N 2.68Å
400	I	97.7	Very high	95.6	Very high	15 Å²	15	54.1 Å²	54.1	8%	0.077	27%	0.271	C	S	.	.	H	α-helix	trans	-67.6	-44.7	178.7	-61.4	-53.8	0	0	0	110.8	L172 R396 H397 Y398 R402 G403 V404 I468 F471 E472 L475	L172-I400 HydrophobicContact CD1-CG2 4.27Å; R396-I400 VanDerWaalsContact O-CG1 3.25Å; R396-I400 WeakPolarHBondContact O-CG1 3.4Å; R396-I400 PolarHBondContact O-N 2.78Å; R396-I400 VanDerWaalsContact O-N 3.13Å; H397-I400 PolarHBondContact O-N 3.45Å; Y398-I400 PolarHBondContact O-N 3.49Å; I400-R402 PolarHBondContact O-N 2.91Å; I400-G403 PolarHBondContact O-N 3.36Å; I400-V404 WeakPolarHBondContact O-CG2 3.36Å; I400-V404 PolarHBondContact O-N 3.1Å; I400-I468 HydrophobicContact CG1-CG2 4.23Å; I400-F471 HydrophobicContact CG2-CB 3.64Å; I400-E472 HydrophobicContact CD1-CB 3.71Å; I400-E472 HydrophobicContact CD1-CG 3.78Å; I400-E472 HydrophobicContact CG1-CB 4.12Å; I400-L475 HydrophobicContact CB-CD1 4.39Å; I400-L475 HydrophobicContact CD1-CD1 3.94Å; I400-L475 HydrophobicContact CG2-CD1 3.98Å
401	A	96.6	Very high	95.7	Very high	1 Å²	1	53.7 Å²	53.7	1%	0.008	27%	0.266	C	S	.	.	H	α-helix	trans	-59.1	-46.2	176.5	0	0	0	0	0	111.8	L172 L173 M388 H397 Y398 V404 Q405	L172-A401 HydrophobicContact CD1-CB 4.45Å; L172-A401 HydrophobicContact CG-CB 4.34Å; L172-A401 WeakPolarHBondContact O-CB 3.29Å; L173-A401 HydrophobicContact CD2-CB 4.13Å; M388-A401 HydrophobicContact CE-CB 4.12Å; M388-A401 HydrophobicContact SD-CB 4.06Å; H397-A401 WeakPolarHBondContact O-CB 3.48Å; H397-A401 PolarHBondContact O-N 2.9Å; Y398-A401 PolarHBondContact O-N 2.67Å; A401-V404 PolarHBondContact O-N 2.98Å; A401-Q405 WeakPolarHBondContact O-CG 3.32Å; A401-Q405 PolarHBondContact O-N 3.46Å
402	R	96.6	Very high	95.8	Very high	106 Å²	106	51.4 Å²	51.4	40%	0.4	25%	0.249	S	C	.	.	H	α-helix	trans	-65.4	-38	175.9	-66.8	-57.6	-179.1	-170.4	0.9	112.8	Y398 I400 Q405 K406	Y398-R402 HydrophobicContact CD1-CG 4.1Å; Y398-R402 HydrophobicContact CD2-CG 4.5Å; Y398-R402 HydrophobicContact CE1-CG 3.73Å; Y398-R402 HydrophobicContact CE2-CG 4.19Å; Y398-R402 HydrophobicContact CG-CG 4.47Å; Y398-R402 WeakPolarHBondContact O-CB 3.4Å; Y398-R402 VanDerWaalsContact O-CG 3.32Å; Y398-R402 WeakPolarHBondContact O-CG 3.44Å; Y398-R402 PolarHBondContact O-N 2.86Å; Y398-R402 PolarHBondContact OH-NE 3.42Å; I400-R402 PolarHBondContact O-N 2.91Å; R402-Q405 PolarHBondContact O-N 3.34Å; R402-K406 WeakPolarHBondContact O-CB 3.25Å; R402-K406 PolarHBondContact O-N 3.1Å
403	G	97	Very high	96	Very high	22 Å²	22	52.1 Å²	52.1	23%	0.227	26%	0.259	C	S	.	.	H	α-helix	trans	-61.3	-43.3	173.9	0	0	0	0	0	112.4	T399 I400 K406 I407	T399-G403 PolarHBondContact O-N 2.68Å; I400-G403 PolarHBondContact O-N 3.36Å; G403-K406 PolarHBondContact O-N 3.43Å; G403-I407 PolarHBondContact O-N 3.39Å; G403-I407 VanDerWaalsContact O-N 3.12Å
404	V	97.1	Very high	96.1	Very high	0 Å²	0	52 Å²	52	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-62.3	-49.8	174.9	166	0	0	0	0	111	L172 L173 I400 A401 K406 I407 L408 I440 F471 L475	L172-V404 HydrophobicContact CD2-CB 4.49Å; L172-V404 HydrophobicContact CD2-CG1 4.44Å; L172-V404 HydrophobicContact CD2-CG2 4.16Å; L173-V404 HydrophobicContact CD2-CB 4.45Å; L173-V404 HydrophobicContact CD2-CG1 4.13Å; I400-V404 WeakPolarHBondContact O-CG2 3.36Å; I400-V404 PolarHBondContact O-N 3.1Å; A401-V404 PolarHBondContact O-N 2.98Å; V404-K406 VanDerWaalsContact C-N 3.29Å; V404-K406 PolarHBondContact O-N 2.97Å; V404-I407 PolarHBondContact O-N 3.14Å; V404-L408 HydrophobicContact CG1-CD1 3.78Å; V404-L408 VanDerWaalsContact O-CG 3.3Å; V404-L408 WeakPolarHBondContact O-CG 3.28Å; V404-L408 PolarHBondContact O-N 2.81Å; V404-L408 VanDerWaalsContact O-N 3.07Å; V404-I440 HydrophobicContact CG1-CG2 3.69Å; V404-I440 HydrophobicContact CG2-CD1 4.47Å; V404-F471 HydrophobicContact CG2-CB 3.95Å; V404-F471 HydrophobicContact CG2-CD1 3.62Å; V404-F471 HydrophobicContact CG2-CE1 4.48Å; V404-F471 HydrophobicContact CG2-CG 4.03Å; V404-L475 HydrophobicContact CG2-CD1 4.24Å; V404-L475 HydrophobicContact CG2-CD2 4.18Å; V404-L475 HydrophobicContact CG2-CG 4.32Å
405	Q	96.3	Very high	96	Very high	29 Å²	29	54.2 Å²	54.2	14%	0.136	26%	0.26	C	S	.	.	H	α-helix	trans	-59.1	-41.3	177.9	-73.5	-175.4	-39.5	0	0	112	L173 P380 L381 A401 R402 L408 Q409	L173-Q405 HydrophobicContact CD2-CG 4.07Å; P380-Q405 PolarHBondContact O-NE2 3Å; L381-Q405 HydrophobicContact CD2-CB 4.45Å; A401-Q405 WeakPolarHBondContact O-CG 3.32Å; A401-Q405 PolarHBondContact O-N 3.46Å; R402-Q405 PolarHBondContact O-N 3.34Å; Q405-L408 PolarHBondContact O-N 2.85Å; Q405-Q409 VanDerWaalsContact O-CB 3.31Å; Q405-Q409 WeakPolarHBondContact O-CB 3.21Å; Q405-Q409 PolarHBondContact O-N 3.41Å
406	K	96.8	Very high	95.8	Very high	138 Å²	138	53.9 Å²	53.9	60%	0.6	26%	0.262	S	S	*	.	H	α-helix	trans	-60	-50.9	177.9	-173	-173.5	174.2	-163.1	0	111.6	R402 G403 V404 L408 Q409 D410	R402-K406 WeakPolarHBondContact O-CB 3.25Å; R402-K406 PolarHBondContact O-N 3.1Å; G403-K406 PolarHBondContact O-N 3.43Å; V404-K406 VanDerWaalsContact C-N 3.29Å; V404-K406 PolarHBondContact O-N 2.97Å; K406-L408 VanDerWaalsContact C-N 3.27Å; K406-L408 PolarHBondContact O-N 2.78Å; K406-Q409 PolarHBondContact O-N 3.01Å; K406-Q409 VanDerWaalsContact O-N 3.16Å; K406-D410 WeakPolarHBondContact O-CB 3.43Å; K406-D410 PolarHBondContact O-N 3.06Å
407	I	97	Very high	95.5	Very high	21 Å²	21	52.2 Å²	52.2	11%	0.108	26%	0.261	C	S	.	.	H	α-helix	trans	-60	-40.3	179.1	-69.1	-176.4	0	0	0	111.4	G403 V404 Y411 I433 R436 A437 I440 L475	G403-I407 PolarHBondContact O-N 3.39Å; G403-I407 VanDerWaalsContact O-N 3.12Å; V404-I407 PolarHBondContact O-N 3.14Å; I407-Y411 WeakPolarHBondContact O-CB 3.43Å; I407-Y411 PolarHBondContact O-N 3Å; I407-I433 HydrophobicContact CG2-CG2 4.47Å; I407-R436 HydrophobicContact CG2-CB 4.37Å; I407-A437 HydrophobicContact CG2-CB 3.77Å; I407-I440 HydrophobicContact CB-CD1 4.12Å; I407-I440 HydrophobicContact CD1-CD1 4.11Å; I407-I440 HydrophobicContact CG2-CD1 3.87Å; I407-L475 HydrophobicContact CD1-CD2 3.39Å; I407-L475 HydrophobicContact CG1-CD2 4.28Å
408	L	96.3	Very high	95.3	Very high	6 Å²	6	53.6 Å²	53.6	3%	0.031	27%	0.268	C	S	.	.	H	α-helix	trans	-68.5	-36.6	178.2	-67.2	171	0	0	0	112.4	P380 L381 V404 Q405 K406 K412 A437 I440 Q441 L444	P380-L408 HydrophobicContact CB-CD1 3.68Å; P380-L408 HydrophobicContact CG-CD1 3.54Å; L381-L408 HydrophobicContact CD2-CB 4.2Å; V404-L408 HydrophobicContact CG1-CD1 3.78Å; V404-L408 VanDerWaalsContact O-CG 3.3Å; V404-L408 WeakPolarHBondContact O-CG 3.28Å; V404-L408 PolarHBondContact O-N 2.81Å; V404-L408 VanDerWaalsContact O-N 3.07Å; Q405-L408 PolarHBondContact O-N 2.85Å; K406-L408 VanDerWaalsContact C-N 3.27Å; K406-L408 PolarHBondContact O-N 2.78Å; L408-K412 PolarHBondContact O-N 3.05Å; L408-A437 HydrophobicContact CD2-CB 4.4Å; L408-I440 HydrophobicContact CD1-CG2 3.9Å; L408-I440 HydrophobicContact CD2-CB 4.36Å; L408-I440 HydrophobicContact CD2-CG2 3.85Å; L408-I440 HydrophobicContact CG-CG2 4Å; L408-Q441 HydrophobicContact CD2-CG 3.62Å; L408-L444 HydrophobicContact CD1-CD1 4.23Å
409	Q	96.5	Very high	95.1	Very high	83 Å²	83	54.4 Å²	54.4	39%	0.388	29%	0.289	S	S	.	.	H	α-helix	trans	-68.1	-44.2	175.1	-177.1	58	57	0	0	111.6	L381 Q405 K406 Y411 K412 S413	L381-Q409 HydrophobicContact CD2-CB 4.21Å; Q405-Q409 VanDerWaalsContact O-CB 3.31Å; Q405-Q409 WeakPolarHBondContact O-CB 3.21Å; Q405-Q409 PolarHBondContact O-N 3.41Å; K406-Q409 PolarHBondContact O-N 3.01Å; K406-Q409 VanDerWaalsContact O-N 3.16Å; Q409-Y411 VanDerWaalsContact C-N 3.31Å; Q409-Y411 PolarHBondContact O-N 2.9Å; Q409-K412 WeakPolarHBondContact O-CB 3.04Å; Q409-K412 PolarHBondContact O-N 3.17Å; Q409-S413 PolarHBondContact O-N 2.95Å; Q409-S413 VanDerWaalsContact O-N 3.09Å; Q409-S413 PolarHBondContact O-OG 3.35Å
410	D	96.1	Very high	94.9	Very high	56 Å²	56	57.3 Å²	57.3	30%	0.299	30%	0.3	S	S	.	.	H	α-helix	trans	-61.5	-42.9	176	-65.2	-20.3	0	0	0	110	K406 K412 S413 L414 I433	K406-D410 WeakPolarHBondContact O-CB 3.43Å; K406-D410 PolarHBondContact O-N 3.06Å; D410-K412 PolarHBondContact O-N 3.17Å; D410-S413 PolarHBondContact O-N 2.73Å; D410-L414 WeakPolarHBondContact O-CG 3.17Å; D410-L414 PolarHBondContact O-N 3.48Å; D410-I433 HydrophobicContact CB-CG2 3.83Å
411	Y	95.5	Very high	94.6	Very high	21 Å²	21	62 Å²	62	8%	0.082	32%	0.324	C	S	.	.	H	α-helix	trans	-59.9	-44.2	173.7	174.2	-127	0	0	0	112.9	I407 Q409 S413 L414 Q415 I418 V434 A437	I407-Y411 WeakPolarHBondContact O-CB 3.43Å; I407-Y411 PolarHBondContact O-N 3Å; Q409-Y411 VanDerWaalsContact C-N 3.31Å; Q409-Y411 PolarHBondContact O-N 2.9Å; Y411-S413 VanDerWaalsContact C-N 3.26Å; Y411-S413 PolarHBondContact O-N 3.09Å; Y411-L414 PolarHBondContact O-N 2.81Å; Y411-Q415 HydrophobicContact CD2-CG 4.23Å; Y411-Q415 HydrophobicContact CE1-CG 4.18Å; Y411-Q415 VanDerWaalsContact CE1-NE2 3.28Å; Y411-Q415 HydrophobicContact CE2-CG 3.73Å; Y411-Q415 VanDerWaalsContact CZ-NE2 3.28Å; Y411-Q415 WeakPolarHBondContact O-CG 3.39Å; Y411-Q415 PolarHBondContact O-N 2.87Å; Y411-Q415 PolarHBondContact OH-NE2 3Å; Y411-Q415 VanDerWaalsContact OH-NE2 3.1Å; Y411-I418 HydrophobicContact CE2-CD1 4.34Å; Y411-V434 HydrophobicContact CD2-CB 4.27Å; Y411-V434 HydrophobicContact CD2-CG1 4.12Å; Y411-V434 HydrophobicContact CD2-CG2 3.98Å; Y411-V434 HydrophobicContact CE2-CB 4.49Å; Y411-V434 HydrophobicContact CE2-CG1 3.85Å; Y411-V434 HydrophobicContact CE2-CG2 4.35Å; Y411-A437 HydrophobicContact CD1-CB 3.78Å; Y411-A437 HydrophobicContact CD2-CB 4.23Å; Y411-A437 HydrophobicContact CG-CB 3.51Å
412	K	93.6	Very high	94.3	Very high	97 Å²	97	63.2 Å²	63.2	42%	0.422	34%	0.337	S	S	.	.	H	α-helix	trans	-58	-40	176.2	-172.7	174.3	-178.2	173.8	0	111.5	L381 L408 Q409 D410 Q415	L381-K412 HydrophobicContact CD1-CD 3.86Å; L408-K412 PolarHBondContact O-N 3.05Å; Q409-K412 WeakPolarHBondContact O-CB 3.04Å; Q409-K412 PolarHBondContact O-N 3.17Å; D410-K412 PolarHBondContact O-N 3.17Å; K412-Q415 PolarHBondContact O-N 3.21Å
413	S	93.2	Very high	93.9	Very high	72 Å²	72	60.7 Å²	60.7	50%	0.503	33%	0.331	S	S	.	.	H	α-helix	trans	-68.3	-31.8	175.1	-66.1	0	0	0	0	113.5	Q409 D410 Y411	Q409-S413 PolarHBondContact O-N 2.95Å; Q409-S413 VanDerWaalsContact O-N 3.09Å; Q409-S413 PolarHBondContact O-OG 3.35Å; D410-S413 PolarHBondContact O-N 2.73Å; Y411-S413 VanDerWaalsContact C-N 3.26Å; Y411-S413 PolarHBondContact O-N 3.09Å
414	L	94.8	Very high	93.7	Very high	15 Å²	15	66.2 Å²	66.2	8%	0.079	36%	0.355	C	S	.	.	H	α-helix	trans	-78.1	-22.4	176.5	-67.2	172.4	0	0	0	113.1	D410 Y411 D416 I417 I418 L426 D430 I433 V434	D410-L414 WeakPolarHBondContact O-CG 3.17Å; D410-L414 PolarHBondContact O-N 3.48Å; Y411-L414 PolarHBondContact O-N 2.81Å; L414-D416 VanDerWaalsContact C-N 3.33Å; L414-D416 PolarHBondContact O-N 2.87Å; L414-I417 HydrophobicContact CD2-CD1 4.21Å; L414-I417 WeakPolarHBondContact O-CB 3.4Å; L414-I417 PolarHBondContact O-N 2.92Å; L414-I417 VanDerWaalsContact O-N 3.16Å; L414-I418 HydrophobicContact CB-CD1 4.21Å; L414-I418 WeakPolarHBondContact O-CB 3.47Å; L414-I418 WeakPolarHBondContact O-CD1 3.35Å; L414-I418 VanDerWaalsContact O-CG1 3.25Å; L414-I418 WeakPolarHBondContact O-CG1 3.17Å; L414-I418 PolarHBondContact O-N 3.27Å; L414-L426 HydrophobicContact CD2-CD2 4.03Å; L414-D430 HydrophobicContact CD1-CB 3.88Å; L414-D430 HydrophobicContact CD2-CB 4.17Å; L414-I433 HydrophobicContact CD1-CB 4.39Å; L414-I433 HydrophobicContact CD1-CG2 4.13Å; L414-V434 HydrophobicContact CB-CG2 4.32Å; L414-V434 HydrophobicContact CD1-CG2 3.84Å
415	Q	92.2	Very high	93.4	Very high	75 Å²	75	73 Å²	73	35%	0.35	39%	0.386	S	S	.	.	H	α-helix	trans	-58.8	-40.8	-178.5	-80.6	-177.1	-33.5	0	0	113	Y411 K412 I417 I418 A419	Y411-Q415 HydrophobicContact CD2-CG 4.23Å; Y411-Q415 HydrophobicContact CE1-CG 4.18Å; Y411-Q415 VanDerWaalsContact CE1-NE2 3.28Å; Y411-Q415 HydrophobicContact CE2-CG 3.73Å; Y411-Q415 VanDerWaalsContact CZ-NE2 3.28Å; Y411-Q415 WeakPolarHBondContact O-CG 3.39Å; Y411-Q415 PolarHBondContact O-N 2.87Å; Y411-Q415 PolarHBondContact OH-NE2 3Å; Y411-Q415 VanDerWaalsContact OH-NE2 3.1Å; K412-Q415 PolarHBondContact O-N 3.21Å; Q415-I417 VanDerWaalsContact C-N 3.33Å; Q415-I417 PolarHBondContact O-N 3Å; Q415-I418 PolarHBondContact O-N 2.81Å; Q415-A419 WeakPolarHBondContact O-CB 3.36Å; Q415-A419 PolarHBondContact O-N 3.24Å
416	D	90.5	Very high	93.1	Very high	117 Å²	117	72.2 Å²	72.2	63%	0.626	38%	0.383	S	S	*	.	H	α-helix	trans	-64.8	-39.3	177.8	-69.8	-23	0	0	0	111.4	L414 A419 I420	L414-D416 VanDerWaalsContact C-N 3.33Å; L414-D416 PolarHBondContact O-N 2.87Å; D416-A419 PolarHBondContact O-N 2.98Å; D416-I420 WeakPolarHBondContact O-CG1 3.4Å; D416-I420 PolarHBondContact O-N 2.8Å
417	I	90.9	Very high	92.9	Very high	72 Å²	72	68.3 Å²	68.3	37%	0.369	37%	0.373	S	S	.	.	H	α-helix	trans	-65.6	-47.1	176	-64	169.1	0	0	0	110.1	L414 Q415 A419 I420 L421 L426	L414-I417 HydrophobicContact CD2-CD1 4.21Å; L414-I417 WeakPolarHBondContact O-CB 3.4Å; L414-I417 PolarHBondContact O-N 2.92Å; L414-I417 VanDerWaalsContact O-N 3.16Å; Q415-I417 VanDerWaalsContact C-N 3.33Å; Q415-I417 PolarHBondContact O-N 3Å; I417-A419 VanDerWaalsContact C-N 3.28Å; I417-A419 PolarHBondContact O-N 3.35Å; I417-I420 PolarHBondContact O-N 2.92Å; I417-L421 HydrophobicContact CG2-CD1 4.08Å; I417-L421 PolarHBondContact O-N 3.25Å; I417-L426 HydrophobicContact CG2-CD2 3.88Å
418	I	92.2	Very high	92.7	Very high	32 Å²	32	73.7 Å²	73.7	16%	0.164	40%	0.398	C	S	.	.	H	α-helix	trans	-58.4	-41.3	177.4	-71.7	160.1	0	0	0	111.2	Y411 L414 Q415 I420 G422 M423 L426 V434	Y411-I418 HydrophobicContact CE2-CD1 4.34Å; L414-I418 HydrophobicContact CB-CD1 4.21Å; L414-I418 WeakPolarHBondContact O-CB 3.47Å; L414-I418 WeakPolarHBondContact O-CD1 3.35Å; L414-I418 VanDerWaalsContact O-CG1 3.25Å; L414-I418 WeakPolarHBondContact O-CG1 3.17Å; L414-I418 PolarHBondContact O-N 3.27Å; Q415-I418 PolarHBondContact O-N 2.81Å; I418-I420 VanDerWaalsContact C-N 3.29Å; I418-I420 PolarHBondContact O-N 2.84Å; I418-G422 WeakPolarHBondContact O-CA 3.41Å; I418-G422 PolarHBondContact O-N 2.76Å; I418-M423 HydrophobicContact CB-CE 4.07Å; I418-M423 HydrophobicContact CD1-CE 3.6Å; I418-M423 HydrophobicContact CD1-SD 4.1Å; I418-M423 HydrophobicContact CG1-CE 3.56Å; I418-M423 HydrophobicContact CG1-SD 4.15Å; I418-M423 HydrophobicContact CG2-CE 3.33Å; I418-L426 HydrophobicContact CD1-CD1 4Å; I418-L426 HydrophobicContact CG1-CD1 3.74Å; I418-L426 HydrophobicContact CG1-CG 4.43Å; I418-V434 HydrophobicContact CD1-CG1 4.31Å; I418-V434 HydrophobicContact CD1-CG2 3.78Å
419	A	92.6	Very high	92.5	Very high	85 Å²	85	79.2 Å²	79.2	70%	0.702	43%	0.427	S	S	*	.	H	α-helix	trans	-67	-29.8	-179.4	0	0	0	0	0	112.8	Q415 D416 I417	Q415-A419 WeakPolarHBondContact O-CB 3.36Å; Q415-A419 PolarHBondContact O-N 3.24Å; D416-A419 PolarHBondContact O-N 2.98Å; I417-A419 VanDerWaalsContact C-N 3.28Å; I417-A419 PolarHBondContact O-N 3.35Å
420	I	93.7	Very high	92.4	Very high	141 Å²	141	77.6 Å²	77.6	72%	0.723	42%	0.422	S	S	*	.	H	α-helix	trans	-93.5	-51.3	-177.7	-63.4	169.3	0	0	0	112.1	D416 I417 I418	D416-I420 WeakPolarHBondContact O-CG1 3.4Å; D416-I420 PolarHBondContact O-N 2.8Å; I417-I420 PolarHBondContact O-N 2.92Å; I418-I420 VanDerWaalsContact C-N 3.29Å; I418-I420 PolarHBondContact O-N 2.84Å
421	L	90.4	Very high	92.3	Very high	112 Å²	112	77.7 Å²	77.7	59%	0.586	42%	0.419	S	S	*	.	H	α-helix	trans	-98.4	-22	-171.6	-62.3	-178.3	0	0	0	113.2	I417 E425	I417-L421 HydrophobicContact CG2-CD1 4.08Å; I417-L421 PolarHBondContact O-N 3.25Å; L421-E425 HydrophobicContact CB-CB 4.05Å; L421-E425 HydrophobicContact CB-CG 4.09Å
422	G	90.9	Very high	92.2	Very high	27 Å²	27	79.8 Å²	79.8	28%	0.278	43%	0.432	S	S	.	.			trans	90.8	174	-172.6	0	0	0	0	0	113.5	I418	I418-G422 WeakPolarHBondContact O-CA 3.41Å; I418-G422 PolarHBondContact O-N 2.76Å
423	M	89.4	Confident	92.2	Very high	54 Å²	54	77.2 Å²	77.2	27%	0.266	42%	0.422	S	S	.	.	S	Bend	trans	-74	-28.7	-176.3	-160.1	63.3	40.9	0	0	113.2	I418 E425 L426 K431 V434	I418-M423 HydrophobicContact CB-CE 4.07Å; I418-M423 HydrophobicContact CD1-CE 3.6Å; I418-M423 HydrophobicContact CD1-SD 4.1Å; I418-M423 HydrophobicContact CG1-CE 3.56Å; I418-M423 HydrophobicContact CG1-SD 4.15Å; I418-M423 HydrophobicContact CG2-CE 3.33Å; M423-E425 VanDerWaalsContact C-N 3.28Å; M423-E425 PolarHBondContact O-N 3.17Å; M423-L426 WeakPolarHBondContact O-CB 3.45Å; M423-L426 PolarHBondContact O-N 3.2Å; M423-L426 HydrophobicContact SD-CD1 3.77Å; M423-K431 VanDerWaalsContact O-CE 3.31Å; M423-K431 WeakPolarHBondContact O-CE 3.22Å; M423-V434 HydrophobicContact CE-CG1 4.41Å; M423-V434 HydrophobicContact SD-CB 4.49Å; M423-V434 HydrophobicContact SD-CG1 3.95Å
424	D	91.8	Very high	92.3	Very high	137 Å²	137	73.9 Å²	73.9	73%	0.733	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-25.4	-170.7	-63	-46.1	0	0	0	112.6	L426	D424-L426 VanDerWaalsContact C-N 3.28Å; D424-L426 PolarHBondContact O-N 2.95Å
425	E	90	Very high	92.2	Very high	142 Å²	142	74.9 Å²	74.9	66%	0.664	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-5.6	179.7	-62.5	-59	141.8	0	0	113.7	L421 M423	L421-E425 HydrophobicContact CB-CB 4.05Å; L421-E425 HydrophobicContact CB-CG 4.09Å; M423-E425 VanDerWaalsContact C-N 3.28Å; M423-E425 PolarHBondContact O-N 3.17Å
426	L	91	Very high	92.4	Very high	13 Å²	13	73.7 Å²	73.7	7%	0.068	40%	0.399	C	S	.	.	S	Bend	trans	-76	149.1	175.8	-67.8	-175.4	0	0	0	111.6	L414 I417 I418 M423 D424 D430 K431 V434	L414-L426 HydrophobicContact CD2-CD2 4.03Å; I417-L426 HydrophobicContact CG2-CD2 3.88Å; I418-L426 HydrophobicContact CD1-CD1 4Å; I418-L426 HydrophobicContact CG1-CD1 3.74Å; I418-L426 HydrophobicContact CG1-CG 4.43Å; M423-L426 WeakPolarHBondContact O-CB 3.45Å; M423-L426 PolarHBondContact O-N 3.2Å; M423-L426 HydrophobicContact SD-CD1 3.77Å; D424-L426 VanDerWaalsContact C-N 3.28Å; D424-L426 PolarHBondContact O-N 2.95Å; L426-D430 HydrophobicContact CB-CB 4.01Å; L426-D430 HydrophobicContact CD1-CB 4.37Å; L426-D430 HydrophobicContact CD2-CB 4.28Å; L426-D430 HydrophobicContact CG-CB 4.47Å; L426-K431 HydrophobicContact CB-CG 3.85Å; L426-K431 VanDerWaalsContact O-CE 3.24Å; L426-K431 WeakPolarHBondContact O-CE 3.48Å; L426-V434 HydrophobicContact CD1-CG2 3.91Å
427	S	93.3	Very high	92.6	Very high	56 Å²	56	68.1 Å²	68.1	39%	0.392	37%	0.369	S	S	.	.			trans	-63.1	158.1	168.2	74.6	0	0	0	0	110.7	D429 D430 K431	S427-D429 PolarHBondContact O-N 2.72Å; S427-D430 PolarHBondContact O-N 3.32Å; S427-D430 VanDerWaalsContact O-N 3.14Å; S427-D430 WeakPolarHBondContact OG-CB 3.17Å; S427-D430 PolarHBondContact OG-N 3.06Å; S427-D430 VanDerWaalsContact OG-N 3.13Å; S427-D430 PolarHBondContact OG-OD2 2.91Å; S427-K431 WeakPolarHBondContact O-CG 3.46Å; S427-K431 PolarHBondContact O-N 3.24Å
428	E	92.4	Very high	92.8	Very high	135 Å²	135	68.4 Å²	68.4	63%	0.631	37%	0.366	S	S	*	.	H	α-helix	trans	-61.5	-32.9	177.9	-65.5	-58.8	121.9	0	0	112.2	K431 L432	E428-K431 IonicContact OE1-NZ 2.83Å; E428-K431 PolarHBondContact OE1-NZ 3.05Å; E428-L432 WeakPolarHBondContact O-CB 3.2Å; E428-L432 PolarHBondContact O-N 3.17Å
429	D	92.5	Very high	93	Very high	121 Å²	121	67 Å²	67	65%	0.647	36%	0.359	S	S	*	.	H	α-helix	trans	-66.9	-42.2	174.3	-69	-26.3	0	0	0	111.4	S427 L432 I433	S427-D429 PolarHBondContact O-N 2.72Å; D429-L432 WeakPolarHBondContact O-CB 3.25Å; D429-L432 PolarHBondContact O-N 2.88Å; D429-I433 WeakPolarHBondContact O-CG1 3.37Å; D429-I433 PolarHBondContact O-N 3.37Å
430	D	94.1	Very high	93.2	Very high	50 Å²	50	63 Å²	63	27%	0.267	33%	0.325	S	S	.	.	H	α-helix	trans	-67.3	-40.3	176.5	-66.3	-39.9	0	0	0	111.7	L414 L426 S427 L432 I433 V434	L414-D430 HydrophobicContact CD1-CB 3.88Å; L414-D430 HydrophobicContact CD2-CB 4.17Å; L426-D430 HydrophobicContact CB-CB 4.01Å; L426-D430 HydrophobicContact CD1-CB 4.37Å; L426-D430 HydrophobicContact CD2-CB 4.28Å; L426-D430 HydrophobicContact CG-CB 4.47Å; S427-D430 PolarHBondContact O-N 3.32Å; S427-D430 VanDerWaalsContact O-N 3.14Å; S427-D430 WeakPolarHBondContact OG-CB 3.17Å; S427-D430 PolarHBondContact OG-N 3.06Å; S427-D430 VanDerWaalsContact OG-N 3.13Å; S427-D430 PolarHBondContact OG-OD2 2.91Å; D430-L432 PolarHBondContact O-N 2.75Å; D430-I433 WeakPolarHBondContact O-CB 3.13Å; D430-I433 PolarHBondContact O-N 3.32Å; D430-V434 VanDerWaalsContact O-CG2 3.25Å; D430-V434 WeakPolarHBondContact O-CG2 3.2Å; D430-V434 PolarHBondContact O-N 2.88Å
431	K	93.2	Very high	93.2	Very high	58 Å²	58	58.1 Å²	58.1	25%	0.252	30%	0.299	S	S	.	.	H	α-helix	trans	-58.6	-40	173	-71.9	177	-172.1	163.1	0	111	M423 L426 S427 E428 V434 S435	M423-K431 VanDerWaalsContact O-CE 3.31Å; M423-K431 WeakPolarHBondContact O-CE 3.22Å; L426-K431 HydrophobicContact CB-CG 3.85Å; L426-K431 VanDerWaalsContact O-CE 3.24Å; L426-K431 WeakPolarHBondContact O-CE 3.48Å; S427-K431 WeakPolarHBondContact O-CG 3.46Å; S427-K431 PolarHBondContact O-N 3.24Å; E428-K431 IonicContact OE1-NZ 2.83Å; E428-K431 PolarHBondContact OE1-NZ 3.05Å; K431-V434 PolarHBondContact O-N 2.8Å; K431-S435 WeakPolarHBondContact O-CB 3.31Å; K431-S435 PolarHBondContact O-N 2.81Å
432	L	93.3	Very high	93.4	Very high	65 Å²	65	55.9 Å²	55.9	34%	0.34	28%	0.283	S	S	.	.	H	α-helix	trans	-66.1	-43.5	175.9	-176	62	0	0	0	111.8	E428 D429 D430 V434 S435 R436	E428-L432 WeakPolarHBondContact O-CB 3.2Å; E428-L432 PolarHBondContact O-N 3.17Å; D429-L432 WeakPolarHBondContact O-CB 3.25Å; D429-L432 PolarHBondContact O-N 2.88Å; D430-L432 PolarHBondContact O-N 2.75Å; L432-V434 VanDerWaalsContact C-N 3.34Å; L432-V434 PolarHBondContact O-N 3.18Å; L432-S435 PolarHBondContact O-N 2.8Å; L432-R436 HydrophobicContact CD1-CG 4.4Å; L432-R436 WeakPolarHBondContact O-CG 3.4Å; L432-R436 PolarHBondContact O-N 3.13Å
433	I	94	Very high	93.7	Very high	42 Å²	42	54.7 Å²	54.7	22%	0.215	27%	0.27	C	S	.	.	H	α-helix	trans	-57.5	-48.2	174.3	-70	168.3	0	0	0	110.3	I407 D410 L414 D429 D430 S435 R436 A437	I407-I433 HydrophobicContact CG2-CG2 4.47Å; D410-I433 HydrophobicContact CB-CG2 3.83Å; L414-I433 HydrophobicContact CD1-CB 4.39Å; L414-I433 HydrophobicContact CD1-CG2 4.13Å; D429-I433 WeakPolarHBondContact O-CG1 3.37Å; D429-I433 PolarHBondContact O-N 3.37Å; D430-I433 WeakPolarHBondContact O-CB 3.13Å; D430-I433 PolarHBondContact O-N 3.32Å; I433-S435 PolarHBondContact O-N 3.38Å; I433-R436 PolarHBondContact O-N 3.33Å; I433-A437 VanDerWaalsContact O-CB 3.24Å; I433-A437 WeakPolarHBondContact O-CB 3.41Å; I433-A437 PolarHBondContact O-N 3.33Å
434	V	94.7	Very high	94	Very high	3 Å²	3	52.5 Å²	52.5	2%	0.018	26%	0.26	C	S	.	.	H	α-helix	trans	-59.7	-46.4	178.2	173	0	0	0	0	111	Y411 L414 I418 M423 L426 D430 K431 L432 A437 R438	Y411-V434 HydrophobicContact CD2-CB 4.27Å; Y411-V434 HydrophobicContact CD2-CG1 4.12Å; Y411-V434 HydrophobicContact CD2-CG2 3.98Å; Y411-V434 HydrophobicContact CE2-CB 4.49Å; Y411-V434 HydrophobicContact CE2-CG1 3.85Å; Y411-V434 HydrophobicContact CE2-CG2 4.35Å; L414-V434 HydrophobicContact CB-CG2 4.32Å; L414-V434 HydrophobicContact CD1-CG2 3.84Å; I418-V434 HydrophobicContact CD1-CG1 4.31Å; I418-V434 HydrophobicContact CD1-CG2 3.78Å; M423-V434 HydrophobicContact CE-CG1 4.41Å; M423-V434 HydrophobicContact SD-CB 4.49Å; M423-V434 HydrophobicContact SD-CG1 3.95Å; L426-V434 HydrophobicContact CD1-CG2 3.91Å; D430-V434 VanDerWaalsContact O-CG2 3.25Å; D430-V434 WeakPolarHBondContact O-CG2 3.2Å; D430-V434 PolarHBondContact O-N 2.88Å; K431-V434 PolarHBondContact O-N 2.8Å; L432-V434 VanDerWaalsContact C-N 3.34Å; L432-V434 PolarHBondContact O-N 3.18Å; V434-A437 PolarHBondContact O-N 2.86Å; V434-R438 WeakPolarHBondContact O-CB 3.22Å; V434-R438 WeakPolarHBondContact O-CG 3.42Å; V434-R438 PolarHBondContact O-N 3.45Å
435	S	93.9	Very high	94.1	Very high	36 Å²	36	46 Å²	46	25%	0.252	23%	0.225	S	C	.	.	H	α-helix	trans	-61.5	-47	178.7	-173.5	0	0	0	0	111.7	K431 L432 I433 R438 K439	K431-S435 WeakPolarHBondContact O-CB 3.31Å; K431-S435 PolarHBondContact O-N 2.81Å; L432-S435 PolarHBondContact O-N 2.8Å; I433-S435 PolarHBondContact O-N 3.38Å; S435-R438 PolarHBondContact O-N 3.4Å; S435-K439 WeakPolarHBondContact O-CG 3.47Å; S435-K439 PolarHBondContact O-N 3.28Å; S435-K439 VanDerWaalsContact O-N 3.09Å
436	R	95.5	Very high	94.3	Very high	49 Å²	49	39.4 Å²	39.4	19%	0.185	19%	0.194	C	C	.	.	H	α-helix	trans	-65.3	-42	177.4	-73.2	-175	-178.6	169.4	6.6	112	I407 L432 I433 R438 K439 I440 L475 D480	I407-R436 HydrophobicContact CG2-CB 4.37Å; L432-R436 HydrophobicContact CD1-CG 4.4Å; L432-R436 WeakPolarHBondContact O-CG 3.4Å; L432-R436 PolarHBondContact O-N 3.13Å; I433-R436 PolarHBondContact O-N 3.33Å; R436-R438 VanDerWaalsContact C-N 3.35Å; R436-R438 PolarHBondContact O-N 2.9Å; R436-K439 WeakPolarHBondContact O-CB 3.14Å; R436-K439 PolarHBondContact O-N 3.29Å; R436-K439 VanDerWaalsContact O-N 3.16Å; R436-I440 VanDerWaalsContact O-CG1 3.3Å; R436-I440 WeakPolarHBondContact O-CG1 3.28Å; R436-I440 PolarHBondContact O-N 2.74Å; R436-L475 PolarHBondContact NH1-O 2.68Å; R436-D480 WeakPolarHBondContact CG-OD1 3.3Å; R436-D480 IonicContact CZ-OD1 3.59Å; R436-D480 IonicContact CZ-OD2 3.92Å; R436-D480 VanDerWaalsContact CZ-OD2 3.28Å; R436-D480 IonicContact NE-OD1 3.14Å; R436-D480 PolarHBondContact NE-OD1 3.02Å; R436-D480 IonicContact NE-OD2 3.54Å; R436-D480 PolarHBondContact NE-OD2 3.34Å; R436-D480 IonicContact NH2-OD2 2.69Å; R436-D480 PolarHBondContact NH2-OD2 3.01Å
437	A	95.5	Very high	94.3	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-59.8	-44.8	176.8	0	0	0	0	0	111.8	I407 L408 Y411 I433 V434 K439 I440 Q441	I407-A437 HydrophobicContact CG2-CB 3.77Å; L408-A437 HydrophobicContact CD2-CB 4.4Å; Y411-A437 HydrophobicContact CD1-CB 3.78Å; Y411-A437 HydrophobicContact CD2-CB 4.23Å; Y411-A437 HydrophobicContact CG-CB 3.51Å; I433-A437 VanDerWaalsContact O-CB 3.24Å; I433-A437 WeakPolarHBondContact O-CB 3.41Å; I433-A437 PolarHBondContact O-N 3.33Å; V434-A437 PolarHBondContact O-N 2.86Å; A437-K439 VanDerWaalsContact C-N 3.3Å; A437-K439 PolarHBondContact O-N 3.4Å; A437-I440 PolarHBondContact O-N 3.36Å; A437-Q441 WeakPolarHBondContact O-CB 3.49Å; A437-Q441 WeakPolarHBondContact O-CG 3.1Å; A437-Q441 PolarHBondContact O-N 3.45Å
438	R	94.9	Very high	94.2	Very high	78 Å²	78	36.7 Å²	36.7	29%	0.294	18%	0.175	S	C	.	.	H	α-helix	trans	-62.9	-33.8	175.6	-77.6	179.1	176.6	-177.5	1.5	113.3	V434 S435 R436 R442 E484	V434-R438 WeakPolarHBondContact O-CB 3.22Å; V434-R438 WeakPolarHBondContact O-CG 3.42Å; V434-R438 PolarHBondContact O-N 3.45Å; S435-R438 PolarHBondContact O-N 3.4Å; R436-R438 VanDerWaalsContact C-N 3.35Å; R436-R438 PolarHBondContact O-N 2.9Å; R438-R442 WeakPolarHBondContact O-CG 3.15Å; R438-R442 PolarHBondContact O-N 2.87Å; R438-R442 PolarHBondContact O-NH1 2.97Å; R438-R442 VanDerWaalsContact O-NH1 3.14Å; R438-E484 VanDerWaalsContact CD-OE1 3.3Å; R438-E484 WeakPolarHBondContact CD-OE1 3.39Å; R438-E484 IonicContact NH1-OE1 2.91Å
439	K	95.7	Very high	93.9	Very high	4 Å²	4	33.5 Å²	33.5	2%	0.017	16%	0.16	C	C	.	.	H	α-helix	trans	-70.4	-45.4	172.8	-70.8	173.1	179.3	-174.2	0	111.6	S435 R436 A437 R442 F443 L479 D480 L482 E484 F487	S435-K439 WeakPolarHBondContact O-CG 3.47Å; S435-K439 PolarHBondContact O-N 3.28Å; S435-K439 VanDerWaalsContact O-N 3.09Å; R436-K439 WeakPolarHBondContact O-CB 3.14Å; R436-K439 PolarHBondContact O-N 3.29Å; R436-K439 VanDerWaalsContact O-N 3.16Å; A437-K439 VanDerWaalsContact C-N 3.3Å; A437-K439 PolarHBondContact O-N 3.4Å; K439-R442 PolarHBondContact O-N 3.35Å; K439-F443 VanDerWaalsContact O-CB 3.31Å; K439-F443 WeakPolarHBondContact O-CB 3.31Å; K439-F443 PolarHBondContact O-N 2.97Å; K439-L479 PolarHBondContact NZ-O 2.82Å; K439-D480 VanDerWaalsContact NZ-CA 3.26Å; K439-D480 PolarHBondContact NZ-O 2.88Å; K439-L482 WeakPolarHBondContact CE-O 3.39Å; K439-L482 PolarHBondContact NZ-O 2.91Å; K439-E484 HydrophobicContact CG-CB 4.44Å; K439-E484 HydrophobicContact CG-CG 4.13Å; K439-F487 HydrophobicContact CB-CD1 4.37Å; K439-F487 HydrophobicContact CB-CD2 4.06Å; K439-F487 HydrophobicContact CB-CE1 4.42Å; K439-F487 HydrophobicContact CB-CE2 4.13Å; K439-F487 HydrophobicContact CB-CG 4.17Å; K439-F487 HydrophobicContact CB-CZ 4.3Å; K439-F487 HydrophobicContact CD-CD2 4.29Å; K439-F487 HydrophobicContact CD-CE2 3.68Å; K439-F487 HydrophobicContact CD-CZ 3.96Å; K439-F487 HydrophobicContact CG-CD2 3.83Å; K439-F487 HydrophobicContact CG-CE2 3.74Å; K439-F487 HydrophobicContact CG-CG 4.44Å; K439-F487 HydrophobicContact CG-CZ 4.27Å
440	I	96.4	Very high	93.3	Very high	0 Å²	0	28 Å²	28	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-57.9	-50.3	175.2	-71.8	172.1	0	0	0	110.2	V404 I407 L408 R436 A437 R442 F443 L444 F471 I474 L475	V404-I440 HydrophobicContact CG1-CG2 3.69Å; V404-I440 HydrophobicContact CG2-CD1 4.47Å; I407-I440 HydrophobicContact CB-CD1 4.12Å; I407-I440 HydrophobicContact CD1-CD1 4.11Å; I407-I440 HydrophobicContact CG2-CD1 3.87Å; L408-I440 HydrophobicContact CD1-CG2 3.9Å; L408-I440 HydrophobicContact CD2-CB 4.36Å; L408-I440 HydrophobicContact CD2-CG2 3.85Å; L408-I440 HydrophobicContact CG-CG2 4Å; R436-I440 VanDerWaalsContact O-CG1 3.3Å; R436-I440 WeakPolarHBondContact O-CG1 3.28Å; R436-I440 PolarHBondContact O-N 2.74Å; A437-I440 PolarHBondContact O-N 3.36Å; I440-R442 VanDerWaalsContact C-N 3.3Å; I440-R442 PolarHBondContact O-N 3.37Å; I440-F443 CarbonylContact O-C 3.57Å; I440-F443 PolarHBondContact O-N 3.1Å; I440-L444 HydrophobicContact CG2-CD1 4.1Å; I440-L444 HydrophobicContact CG2-CG 4.44Å; I440-L444 WeakPolarHBondContact O-CG 3.47Å; I440-L444 PolarHBondContact O-N 2.85Å; I440-F471 HydrophobicContact CG2-CD1 4.46Å; I440-F471 HydrophobicContact CG2-CE1 4.03Å; I440-I474 HydrophobicContact CD1-CG2 4.21Å; I440-I474 HydrophobicContact CG1-CG2 3.65Å; I440-L475 HydrophobicContact CD1-CD2 4.27Å
441	Q	94.6	Very high	92.8	Very high	38 Å²	38	26.1 Å²	26.1	18%	0.178	12%	0.122	C	C	.	.	H	α-helix	trans	-55.6	-44.5	178.6	-78.6	-174.2	-31.3	0	0	112.2	I374 L408 A437	I374-Q441 HydrophobicContact CD1-CB 3.94Å; L408-Q441 HydrophobicContact CD2-CG 3.62Å; A437-Q441 WeakPolarHBondContact O-CB 3.49Å; A437-Q441 WeakPolarHBondContact O-CG 3.1Å; A437-Q441 PolarHBondContact O-N 3.45Å
442	R	94.8	Very high	92.2	Very high	66 Å²	66	27 Å²	27	25%	0.249	13%	0.127	C	C	.	.	H	α-helix	trans	-70.1	-38.8	175.4	-72.2	-177.2	-175.1	95.9	-18.4	111.9	R438 K439 I440 L444 S445 E484 F487	R438-R442 WeakPolarHBondContact O-CG 3.15Å; R438-R442 PolarHBondContact O-N 2.87Å; R438-R442 PolarHBondContact O-NH1 2.97Å; R438-R442 VanDerWaalsContact O-NH1 3.14Å; K439-R442 PolarHBondContact O-N 3.35Å; I440-R442 VanDerWaalsContact C-N 3.3Å; I440-R442 PolarHBondContact O-N 3.37Å; R442-L444 VanDerWaalsContact C-N 3.25Å; R442-L444 PolarHBondContact O-N 3.32Å; R442-S445 VanDerWaalsContact O-CB 3.28Å; R442-S445 WeakPolarHBondContact O-CB 3.32Å; R442-S445 PolarHBondContact O-N 3.49Å; R442-S445 PolarHBondContact O-OG 3.44Å; R442-E484 VanDerWaalsContact CD-O 3.22Å; R442-E484 WeakPolarHBondContact CD-O 3.05Å; R442-E484 IonicContact CZ-OE2 3.63Å; R442-E484 VanDerWaalsContact CZ-OE2 3.24Å; R442-E484 IonicContact NH1-OE2 3.88Å; R442-E484 PolarHBondContact NH1-OE2 2.8Å; R442-E484 IonicContact NH2-OE2 2.72Å; R442-E484 PolarHBondContact NH2-OE2 2.97Å; R442-F487 CarbonylContact C-O 3.38Å; R442-F487 HydrophobicContact CB-CB 3.94Å
443	F	96.3	Very high	91.1	Very high	1 Å²	1	29.4 Å²	29.4	0%	0.004	14%	0.144	C	C	.	.	H	α-helix	trans	-69.1	-23.1	178.7	-166.4	-122.8	0	0	0	113.5	K168 K439 I440 S445 F471 I474 F487 V490 I493 V496	K168-F443 HydrophobicContact CD-CE1 4.35Å; K168-F443 HydrophobicContact CD-CZ 4.25Å; K168-F443 WeakPolarHBondContact CE-O 3.31Å; K168-F443 PolarHBondContact NZ-O 3.07Å; K439-F443 VanDerWaalsContact O-CB 3.31Å; K439-F443 WeakPolarHBondContact O-CB 3.31Å; K439-F443 PolarHBondContact O-N 2.97Å; I440-F443 CarbonylContact O-C 3.57Å; I440-F443 PolarHBondContact O-N 3.1Å; F443-S445 PolarHBondContact O-N 3.22Å; F443-F471 HydrophobicContact CB-CE1 4.45Å; F443-F471 HydrophobicContact CD1-CD1 4.06Å; F443-F471 HydrophobicContact CD1-CD2 4.16Å; F443-F471 AromaticContact CD1-CE1 3.64Å; F443-F471 HydrophobicContact CD1-CE1 3.64Å; F443-F471 AromaticContact CD1-CE2 3.74Å; F443-F471 HydrophobicContact CD1-CE2 3.74Å; F443-F471 HydrophobicContact CD1-CG 4.31Å; F443-F471 AromaticContact CD1-CZ 3.45Å; F443-F471 HydrophobicContact CD1-CZ 3.45Å; F443-F471 VanDerWaalsContact CD1-CZ 3.45Å; F443-F471 HydrophobicContact CE1-CD2 4.02Å; F443-F471 HydrophobicContact CE1-CE1 4.44Å; F443-F471 AromaticContact CE1-CE2 3.82Å; F443-F471 HydrophobicContact CE1-CE2 3.82Å; F443-F471 HydrophobicContact CE1-CG 4.42Å; F443-F471 HydrophobicContact CE1-CZ 4.04Å; F443-F471 HydrophobicContact CG-CZ 4.36Å; F443-I474 HydrophobicContact CB-CD1 4.06Å; F443-I474 HydrophobicContact CD1-CD1 3.51Å; F443-I474 HydrophobicContact CE1-CD1 4.16Å; F443-I474 HydrophobicContact CG-CD1 3.86Å; F443-F487 WeakPolarHBondContact CA-O 3.49Å; F443-F487 HydrophobicContact CB-CB 4.12Å; F443-F487 HydrophobicContact CB-CD1 3.92Å; F443-F487 HydrophobicContact CB-CG 4.5Å; F443-F487 HydrophobicContact CD2-CD1 4.07Å; F443-F487 HydrophobicContact CG-CD1 4.13Å; F443-F487 PolarHBondContact N-O 2.97Å; F443-V490 HydrophobicContact CD2-CG2 3.85Å; F443-V490 HydrophobicContact CE2-CG2 3.94Å; F443-I493 HydrophobicContact CE1-CD1 4.24Å; F443-I493 HydrophobicContact CE2-CD1 4.05Å; F443-I493 HydrophobicContact CZ-CD1 3.83Å; F443-V496 HydrophobicContact CD2-CG2 3.92Å; F443-V496 HydrophobicContact CE2-CG2 3.78Å
444	L	95.2	Very high	90	Very high	9 Å²	9	34.7 Å²	34.7	5%	0.047	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-21.9	170	-72.3	167	0	0	0	112.3	V169 L173 P380 L408 I440 R442 F471	V169-L444 HydrophobicContact CB-CB 4.5Å; V169-L444 HydrophobicContact CB-CD2 3.82Å; V169-L444 HydrophobicContact CG2-CD2 3.94Å; L173-L444 HydrophobicContact CD1-CD2 4.29Å; P380-L444 HydrophobicContact CB-CD1 4.21Å; P380-L444 HydrophobicContact CG-CD1 4.33Å; L408-L444 HydrophobicContact CD1-CD1 4.23Å; I440-L444 HydrophobicContact CG2-CD1 4.1Å; I440-L444 HydrophobicContact CG2-CG 4.44Å; I440-L444 WeakPolarHBondContact O-CG 3.47Å; I440-L444 PolarHBondContact O-N 2.85Å; R442-L444 VanDerWaalsContact C-N 3.25Å; R442-L444 PolarHBondContact O-N 3.32Å; L444-F471 HydrophobicContact CD2-CE1 3.92Å; L444-F471 HydrophobicContact CD2-CE2 4.3Å; L444-F471 HydrophobicContact CD2-CZ 3.42Å; L444-F471 VanDerWaalsContact CD2-CZ 3.42Å; L444-F471 HydrophobicContact CG-CE1 4.06Å; L444-F471 HydrophobicContact CG-CZ 3.86Å
445	S	94.3	Very high	89.2	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	18%	0.183	C	C	.	.			trans	-67.4	147	171.3	72.9	0	0	0	0	111.5	K168 Y375 R442 F443 M489	K168-S445 PolarHBondContact NZ-O 3.02Å; Y375-S445 CarbonylContact O-C 3.54Å; Y375-S445 WeakPolarHBondContact O-CA 3.35Å; Y375-S445 VanDerWaalsContact O-CB 3.26Å; Y375-S445 WeakPolarHBondContact O-CB 3.31Å; R442-S445 VanDerWaalsContact O-CB 3.28Å; R442-S445 WeakPolarHBondContact O-CB 3.32Å; R442-S445 PolarHBondContact O-N 3.49Å; R442-S445 PolarHBondContact O-OG 3.44Å; F443-S445 PolarHBondContact O-N 3.22Å; S445-M489 PolarHBondContact OG-N 2.83Å
446	Q	94.2	Very high	88.4	Confident	3 Å²	3	39 Å²	39	1%	0.014	21%	0.205	C	C	.	.			trans	-149.1	129.9	-176.8	-177.3	173.9	-36.4	0	0	109.9	G166 Y375 F448 K460	G166-Q446 PolarHBondContact O-NE2 3.18Å; G166-Q446 PolarHBondContact O-OE1 3.14Å; Y375-Q446 PolarHBondContact O-N 3.26Å; Q446-F448 HydrophobicContact CB-CE1 4.25Å; Q446-F448 HydrophobicContact CG-CD1 4.41Å; Q446-F448 HydrophobicContact CG-CE1 4.4Å; Q446-F448 WeakPolarHBondContact O-CD1 3.22Å; Q446-F448 PolarHBondContact O-N 2.71Å; Q446-K460 PolarHBondContact NE2-O 3.41Å
447	P	92	Very high	87.7	Confident	3 Å²	3	38.9 Å²	38.9	2%	0.019	21%	0.211	C	C	.	.			trans	-70.3	123.3	174.6	29.7	-33.5	0	0	0	109.5	G459 K460 M489	P447-G459 WeakPolarHBondContact O-CA 3.38Å; P447-K460 HydrophobicContact CG-CB 4.13Å; P447-K460 HydrophobicContact CG-CD 4.12Å; P447-K460 HydrophobicContact CG-CG 3.9Å; P447-K460 PolarHBondContact O-N 3.35Å; P447-M489 HydrophobicContact CB-SD 4.47Å
448	F	91.1	Very high	87.2	Confident	10 Å²	10	41.7 Å²	41.7	4%	0.044	23%	0.234	C	C	.	.			trans	-90.5	144.3	177.7	-71.7	-4.4	0	0	0	111	I167 V194 L195 E198 P376 Q446 V450 A451 E452	I167-F448 HydrophobicContact CD1-CE1 4.2Å; I167-F448 HydrophobicContact CD1-CZ 3.92Å; I167-F448 HydrophobicContact CG1-CE1 4.19Å; I167-F448 HydrophobicContact CG1-CZ 4.39Å; I167-F448 HydrophobicContact CG2-CE1 4.14Å; I167-F448 HydrophobicContact CG2-CZ 4.16Å; V194-F448 HydrophobicContact CG1-CD2 3.81Å; V194-F448 HydrophobicContact CG1-CE2 4.42Å; L195-F448 HydrophobicContact CD1-CE2 3.95Å; L195-F448 HydrophobicContact CD1-CZ 3.85Å; E198-F448 HydrophobicContact CB-CB 4.37Å; E198-F448 HydrophobicContact CB-CD2 3.69Å; E198-F448 HydrophobicContact CB-CE2 4.01Å; E198-F448 HydrophobicContact CB-CG 3.99Å; E198-F448 HydrophobicContact CG-CB 4.01Å; E198-F448 HydrophobicContact CG-CD1 3.78Å; E198-F448 HydrophobicContact CG-CD2 3.86Å; E198-F448 HydrophobicContact CG-CE1 4.12Å; E198-F448 HydrophobicContact CG-CE2 4.21Å; E198-F448 HydrophobicContact CG-CG 3.63Å; E198-F448 HydrophobicContact CG-CZ 4.31Å; P376-F448 HydrophobicContact CB-CE1 4.5Å; P376-F448 HydrophobicContact CB-CE2 3.95Å; P376-F448 HydrophobicContact CB-CZ 3.57Å; P376-F448 HydrophobicContact CG-CE1 4.12Å; P376-F448 HydrophobicContact CG-CE2 4.44Å; P376-F448 HydrophobicContact CG-CZ 3.57Å; Q446-F448 HydrophobicContact CB-CE1 4.25Å; Q446-F448 HydrophobicContact CG-CD1 4.41Å; Q446-F448 HydrophobicContact CG-CE1 4.4Å; Q446-F448 WeakPolarHBondContact O-CD1 3.22Å; Q446-F448 PolarHBondContact O-N 2.71Å; F448-V450 VanDerWaalsContact C-N 3.32Å; F448-V450 HydrophobicContact CB-CG2 4.16Å; F448-V450 PolarHBondContact O-N 3.18Å; F448-A451 HydrophobicContact CB-CB 3.9Å; F448-A451 CarbonylContact O-C 2.91Å; F448-A451 PolarHBondContact O-N 2.78Å; F448-A451 VanDerWaalsContact O-N 3.15Å; F448-E452 PolarHBondContact O-N 3.04Å
449	Q	85.6	Confident	86.8	Confident	68 Å²	68	38.8 Å²	38.8	32%	0.318	23%	0.229	S	C	.	.	S	Bend	trans	-64.9	-40.9	178.7	-174.7	64.1	59.9	0	0	111.5	E198 A451 E452	E198-Q449 PolarHBondContact OE1-N 2.72Å; E198-Q449 PolarHBondContact OE2-N 3.04Å; Q449-A451 PolarHBondContact O-N 2.9Å; Q449-E452 PolarHBondContact NE2-OE2 3.38Å; Q449-E452 WeakPolarHBondContact O-CB 3.46Å; Q449-E452 PolarHBondContact O-N 3.48Å
450	V	80.4	Confident	86.5	Confident	6 Å²	6	41.7 Å²	41.7	4%	0.036	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-27.6	177.2	-57.6	0	0	0	0	111.4	V194 M197 E198 N201 E229 T233 F448	V194-V450 HydrophobicContact CG1-CG2 4.13Å; M197-V450 HydrophobicContact CB-CB 4.26Å; M197-V450 HydrophobicContact CB-CG1 4.03Å; M197-V450 HydrophobicContact CB-CG2 4.12Å; E198-V450 HydrophobicContact CB-CG2 3.99Å; E198-V450 PolarHBondContact OE2-N 2.8Å; N201-V450 HydrophobicContact CB-CG1 4.14Å; E229-V450 WeakPolarHBondContact OE1-CB 3.4Å; T233-V450 HydrophobicContact CG2-CG1 4.34Å; F448-V450 VanDerWaalsContact C-N 3.32Å; F448-V450 HydrophobicContact CB-CG2 4.16Å; F448-V450 PolarHBondContact O-N 3.18Å
451	A	82.3	Confident	86.2	Confident	10 Å²	10	46.1 Å²	46.1	8%	0.083	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	4	179.3	0	0	0	0	0	114.4	V194 F448 Q449 V453 F454 T455	V194-A451 HydrophobicContact CG1-CB 4.25Å; F448-A451 HydrophobicContact CB-CB 3.9Å; F448-A451 CarbonylContact O-C 2.91Å; F448-A451 PolarHBondContact O-N 2.78Å; F448-A451 VanDerWaalsContact O-N 3.15Å; Q449-A451 PolarHBondContact O-N 2.9Å; A451-V453 PolarHBondContact O-N 2.95Å; A451-F454 PolarHBondContact O-N 3.45Å; A451-T455 HydrophobicContact CB-CG2 4.14Å; A451-T455 WeakPolarHBondContact O-CB 3.37Å; A451-T455 WeakPolarHBondContact O-CG2 3.3Å; A451-T455 PolarHBondContact O-N 2.96Å; A451-T455 PolarHBondContact O-OG1 3.1Å
452	E	81	Confident	86.1	Confident	75 Å²	75	44.4 Å²	44.4	35%	0.35	25%	0.253	S	S	.	.	H	α-helix	trans	-58.9	-36.8	-178.4	-177.8	169	170	0	0	111.4	F448 Q449 F454 G456	F448-E452 PolarHBondContact O-N 3.04Å; Q449-E452 PolarHBondContact NE2-OE2 3.38Å; Q449-E452 WeakPolarHBondContact O-CB 3.46Å; Q449-E452 PolarHBondContact O-N 3.48Å; E452-F454 VanDerWaalsContact C-N 3.27Å; E452-F454 PolarHBondContact O-N 2.9Å; E452-G456 VanDerWaalsContact O-CA 3.3Å; E452-G456 WeakPolarHBondContact O-CA 3.38Å; E452-G456 PolarHBondContact O-N 3.14Å
453	V	70.3	Confident	86	Confident	116 Å²	116	43.7 Å²	43.7	70%	0.703	26%	0.257	S	S	*	.	H	α-helix	trans	-62.2	-34.5	177.4	-174.9	0	0	0	0	112	A451	A451-V453 PolarHBondContact O-N 2.95Å
454	F	71.4	Confident	85.8	Confident	154 Å²	154	45 Å²	45	68%	0.675	26%	0.264	S	S	*	.	H	α-helix	trans	-90.6	-34.5	-177.6	-54.6	-70.4	0	0	0	112.9	A451 E452	A451-F454 PolarHBondContact O-N 3.45Å; E452-F454 VanDerWaalsContact C-N 3.27Å; E452-F454 PolarHBondContact O-N 2.9Å
455	T	77.4	Confident	85.8	Confident	60 Å²	60	50 Å²	50	37%	0.368	29%	0.287	S	S	.	.	H	α-helix	trans	-97	-18.8	-173.1	62	0	0	0	0	113.3	A451 S457	A451-T455 HydrophobicContact CB-CG2 4.14Å; A451-T455 WeakPolarHBondContact O-CB 3.37Å; A451-T455 WeakPolarHBondContact O-CG2 3.3Å; A451-T455 PolarHBondContact O-N 2.96Å; A451-T455 PolarHBondContact O-OG1 3.1Å; T455-S457 PolarHBondContact O-N 2.96Å; T455-S457 VanDerWaalsContact O-N 3.15Å; T455-S457 PolarHBondContact OG1-N 3.13Å
456	G	77.3	Confident	85.8	Confident	69 Å²	69	53.4 Å²	53.4	71%	0.711	30%	0.303	S	S	*	.			trans	64	8.8	-171	0	0	0	0	0	114.1	E452	E452-G456 VanDerWaalsContact O-CA 3.3Å; E452-G456 WeakPolarHBondContact O-CA 3.38Å; E452-G456 PolarHBondContact O-N 3.14Å
457	S	81.1	Confident	85.8	Confident	47 Å²	47	53.2 Å²	53.2	33%	0.329	30%	0.302	S	S	.	.	S	Bend	trans	-108	129.4	-177.7	-62	0	0	0	0	109.7	T455 G459	T455-S457 PolarHBondContact O-N 2.96Å; T455-S457 VanDerWaalsContact O-N 3.15Å; T455-S457 PolarHBondContact OG1-N 3.13Å; S457-G459 PolarHBondContact O-N 3.19Å
458	A	85.2	Confident	86.1	Confident	58 Å²	58	53.3 Å²	53.3	48%	0.479	30%	0.302	S	S	.	.			trans	-59.3	130.8	178.8	0	0	0	0	0	111
459	G	87	Confident	86.3	Confident	17 Å²	17	57 Å²	57	18%	0.175	32%	0.318	C	S	.	.			trans	-60.6	145.6	178.8	0	0	0	0	0	113.1	P447 S457	P447-G459 WeakPolarHBondContact O-CA 3.38Å; S457-G459 PolarHBondContact O-N 3.19Å
460	K	88.8	Confident	86.6	Confident	66 Å²	66	53.7 Å²	53.7	29%	0.287	30%	0.303	S	S	.	.			trans	-131.6	131.5	-179.3	-63.4	-168.6	-179.1	-165.3	0	111.8	Q446 P447 E495	Q446-K460 PolarHBondContact NE2-O 3.41Å; P447-K460 HydrophobicContact CG-CB 4.13Å; P447-K460 HydrophobicContact CG-CD 4.12Å; P447-K460 HydrophobicContact CG-CG 3.9Å; P447-K460 PolarHBondContact O-N 3.35Å; K460-E495 WeakPolarHBondContact CD-OE1 3.48Å; K460-E495 IonicContact NZ-OE1 2.75Å; K460-E495 PolarHBondContact NZ-OE1 2.92Å; K460-E495 IonicContact NZ-OE2 3.72Å; K460-E495 PolarHBondContact NZ-OE2 3.33Å
461	F	90.4	Very high	87.4	Confident	92 Å²	92	53.4 Å²	53.4	40%	0.404	30%	0.301	S	S	.	.			trans	-97.5	121.4	167	-177.6	-82.6	0	0	0	108.1	G166 N202 A206	G166-F461 VanDerWaalsContact CA-CE2 3.46Å; N202-F461 HydrophobicContact CB-CD2 4Å; N202-F461 HydrophobicContact CB-CE2 4.07Å; A206-F461 HydrophobicContact CB-CE2 4.44Å; A206-F461 HydrophobicContact CB-CZ 4.46Å
462	V	92.4	Very high	88.1	Confident	3 Å²	3	54.8 Å²	54.8	2%	0.018	31%	0.306	C	S	.	.			trans	-109.6	117.7	-177.7	-172.2	0	0	0	0	109.4	G166 K168 E466 T467	G166-V462 WeakPolarHBondContact CA-O 3.49Å; G166-V462 PolarHBondContact O-N 2.92Å; G166-V462 VanDerWaalsContact O-N 3.08Å; K168-V462 HydrophobicContact CD-CB 4.48Å; K168-V462 HydrophobicContact CD-CG1 4.24Å; K168-V462 HydrophobicContact CD-CG2 4.28Å; K168-V462 HydrophobicContact CG-CB 3.92Å; K168-V462 HydrophobicContact CG-CG1 3.97Å; K168-V462 HydrophobicContact CG-CG2 4.1Å; V462-E466 HydrophobicContact CG1-CB 4.09Å; V462-T467 WeakPolarHBondContact CG1-OG1 3.42Å
463	P	92.6	Very high	88.8	Confident	50 Å²	50	53.2 Å²	53.2	33%	0.325	30%	0.299	S	S	.	.			trans	-59.4	150.3	174.8	-24	34.3	0	0	0	112.6	E465 E466 T467	P463-E465 VanDerWaalsContact C-N 3.32Å; P463-E465 PolarHBondContact O-N 2.83Å; P463-E466 HydrophobicContact CB-CG 4.45Å; P463-E466 HydrophobicContact CG-CG 4.46Å; P463-E466 PolarHBondContact O-N 3.23Å; P463-T467 PolarHBondContact O-N 3.09Å; P463-T467 PolarHBondContact O-OG1 3.11Å; P463-T467 VanDerWaalsContact O-OG1 3.05Å
464	L	92.8	Very high	89.9	Confident	30 Å²	30	47.7 Å²	47.7	16%	0.157	27%	0.266	C	S	.	.	H	α-helix	trans	-55.9	-44.1	179.9	176.1	61.4	0	0	0	112.5	T164 D171 E466 T467 I468	T164-L464 HydrophobicContact CG2-CB 4.23Å; D171-L464 HydrophobicContact CB-CD1 4.04Å; L464-E466 VanDerWaalsContact C-N 3.35Å; L464-E466 PolarHBondContact O-N 3.29Å; L464-T467 VanDerWaalsContact O-CB 3.28Å; L464-T467 WeakPolarHBondContact O-CB 3.49Å; L464-T467 PolarHBondContact O-N 3.35Å; L464-T467 VanDerWaalsContact O-N 3.16Å; L464-I468 HydrophobicContact CD1-CD1 3.92Å; L464-I468 HydrophobicContact CD1-CG1 4.07Å; L464-I468 HydrophobicContact CG-CD1 3.88Å; L464-I468 HydrophobicContact CG-CG1 4.43Å; L464-I468 WeakPolarHBondContact O-CG1 3.43Å; L464-I468 PolarHBondContact O-N 3.2Å
465	E	94.4	Very high	91	Very high	113 Å²	113	42 Å²	42	53%	0.528	24%	0.242	S	C	.	.	H	α-helix	trans	-63.3	-37.9	179.8	-76.7	-59.1	139.5	0	0	113.3	R396 P463 T467 K469	R396-E465 IonicContact CZ-OE2 3.28Å; R396-E465 IonicContact NH1-OE2 3.95Å; R396-E465 PolarHBondContact NH1-OE2 3.13Å; P463-E465 VanDerWaalsContact C-N 3.32Å; P463-E465 PolarHBondContact O-N 2.83Å; E465-T467 VanDerWaalsContact C-N 3.34Å; E465-K469 VanDerWaalsContact O-CB 3.27Å; E465-K469 WeakPolarHBondContact O-CB 3.09Å; E465-K469 PolarHBondContact O-N 3.13Å
466	E	94.1	Very high	91.8	Very high	71 Å²	71	45 Å²	45	33%	0.332	25%	0.25	S	S	.	.	H	α-helix	trans	-68.3	-37.8	175	-69.3	-173.6	-153.3	0	0	111.2	V462 P463 L464 G470 N492	V462-E466 HydrophobicContact CG1-CB 4.09Å; P463-E466 HydrophobicContact CB-CG 4.45Å; P463-E466 HydrophobicContact CG-CG 4.46Å; P463-E466 PolarHBondContact O-N 3.23Å; L464-E466 VanDerWaalsContact C-N 3.35Å; L464-E466 PolarHBondContact O-N 3.29Å; E466-G470 PolarHBondContact O-N 3.4Å; E466-N492 HydrophobicContact CB-CB 4.46Å; E466-N492 WeakPolarHBondContact OE2-CB 3.47Å; E466-N492 PolarHBondContact OE2-ND2 2.85Å; E466-N492 VanDerWaalsContact OE2-ND2 3.07Å
467	T	95	Very high	92.4	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-59.1	-55.7	173.3	-56.4	0	0	0	0	110.4	K168 L172 V462 P463 L464 E465 K469 G470 F471	K168-T467 HydrophobicContact CB-CG2 3.89Å; K168-T467 HydrophobicContact CG-CG2 3.89Å; L172-T467 HydrophobicContact CB-CG2 4Å; V462-T467 WeakPolarHBondContact CG1-OG1 3.42Å; P463-T467 PolarHBondContact O-N 3.09Å; P463-T467 PolarHBondContact O-OG1 3.11Å; P463-T467 VanDerWaalsContact O-OG1 3.05Å; L464-T467 VanDerWaalsContact O-CB 3.28Å; L464-T467 WeakPolarHBondContact O-CB 3.49Å; L464-T467 PolarHBondContact O-N 3.35Å; L464-T467 VanDerWaalsContact O-N 3.16Å; E465-T467 VanDerWaalsContact C-N 3.34Å; T467-K469 PolarHBondContact O-N 3.17Å; T467-G470 PolarHBondContact O-N 3.31Å; T467-G470 VanDerWaalsContact O-N 3.17Å; T467-F471 HydrophobicContact CG2-CD2 3.91Å; T467-F471 HydrophobicContact CG2-CE2 3.81Å; T467-F471 VanDerWaalsContact O-CD2 3.23Å; T467-F471 WeakPolarHBondContact O-CD2 3.37Å; T467-F471 PolarHBondContact O-N 2.99Å; T467-F471 VanDerWaalsContact O-N 3.09Å
468	I	96.5	Very high	92.9	Very high	5 Å²	5	44.8 Å²	44.8	3%	0.026	23%	0.229	C	C	.	.	H	α-helix	trans	-58.3	-47.9	-179.2	-66	169.5	0	0	0	110.5	L172 R396 H397 I400 L464 G470 F471 E472	L172-I468 HydrophobicContact CD1-CG1 4.34Å; R396-I468 HydrophobicContact CG-CG2 4.02Å; H397-I468 HydrophobicContact CB-CD1 3.77Å; I400-I468 HydrophobicContact CG1-CG2 4.23Å; L464-I468 HydrophobicContact CD1-CD1 3.92Å; L464-I468 HydrophobicContact CD1-CG1 4.07Å; L464-I468 HydrophobicContact CG-CD1 3.88Å; L464-I468 HydrophobicContact CG-CG1 4.43Å; L464-I468 WeakPolarHBondContact O-CG1 3.43Å; L464-I468 PolarHBondContact O-N 3.2Å; I468-G470 VanDerWaalsContact C-N 3.33Å; I468-G470 PolarHBondContact O-N 3.19Å; I468-F471 PolarHBondContact O-N 3.48Å; I468-E472 VanDerWaalsContact O-CB 3.23Å; I468-E472 WeakPolarHBondContact O-CB 3.37Å; I468-E472 PolarHBondContact O-N 3Å
469	K	95.4	Very high	93.2	Very high	86 Å²	86	42.9 Å²	42.9	37%	0.374	21%	0.211	S	C	.	.	H	α-helix	trans	-57.5	-45.4	177.4	-178.4	-168.9	172.8	-162.2	0	111.5	E465 T467 E472 M473 E494	E465-K469 VanDerWaalsContact O-CB 3.27Å; E465-K469 WeakPolarHBondContact O-CB 3.09Å; E465-K469 PolarHBondContact O-N 3.13Å; T467-K469 PolarHBondContact O-N 3.17Å; K469-E472 PolarHBondContact O-N 2.83Å; K469-M473 HydrophobicContact CG-SD 4.37Å; K469-M473 WeakPolarHBondContact O-CG 3.46Å; K469-M473 PolarHBondContact O-N 2.92Å; K469-E494 IonicContact NZ-OE1 3.91Å; K469-E494 PolarHBondContact NZ-OE1 2.87Å
470	G	93.6	Very high	93.4	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-60.8	-47.7	-179.4	0	0	0	0	0	112.6	E466 T467 I468 M473 I474	E466-G470 PolarHBondContact O-N 3.4Å; T467-G470 PolarHBondContact O-N 3.31Å; T467-G470 VanDerWaalsContact O-N 3.17Å; I468-G470 VanDerWaalsContact C-N 3.33Å; I468-G470 PolarHBondContact O-N 3.19Å; G470-M473 PolarHBondContact O-N 2.77Å; G470-I474 WeakPolarHBondContact O-CG1 3.36Å; G470-I474 PolarHBondContact O-N 3.49Å
471	F	96.3	Very high	93.5	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-69.5	-35.1	176.6	-73.9	-78	0	0	0	112.6	K168 L172 I400 V404 I440 F443 L444 T467 I468 M473 I474 L475	K168-F471 HydrophobicContact CB-CE2 4.43Å; L172-F471 HydrophobicContact CD1-CD2 4.42Å; L172-F471 HydrophobicContact CD2-CB 4.25Å; L172-F471 HydrophobicContact CD2-CD1 4.08Å; L172-F471 HydrophobicContact CD2-CD2 3.42Å; L172-F471 VanDerWaalsContact CD2-CD2 3.42Å; L172-F471 HydrophobicContact CD2-CE1 4.31Å; L172-F471 HydrophobicContact CD2-CE2 3.7Å; L172-F471 HydrophobicContact CD2-CG 3.64Å; L172-F471 HydrophobicContact CD2-CZ 4.15Å; L172-F471 HydrophobicContact CG-CD2 4.42Å; I400-F471 HydrophobicContact CG2-CB 3.64Å; V404-F471 HydrophobicContact CG2-CB 3.95Å; V404-F471 HydrophobicContact CG2-CD1 3.62Å; V404-F471 HydrophobicContact CG2-CE1 4.48Å; V404-F471 HydrophobicContact CG2-CG 4.03Å; I440-F471 HydrophobicContact CG2-CD1 4.46Å; I440-F471 HydrophobicContact CG2-CE1 4.03Å; F443-F471 HydrophobicContact CB-CE1 4.45Å; F443-F471 HydrophobicContact CD1-CD1 4.06Å; F443-F471 HydrophobicContact CD1-CD2 4.16Å; F443-F471 AromaticContact CD1-CE1 3.64Å; F443-F471 HydrophobicContact CD1-CE1 3.64Å; F443-F471 AromaticContact CD1-CE2 3.74Å; F443-F471 HydrophobicContact CD1-CE2 3.74Å; F443-F471 HydrophobicContact CD1-CG 4.31Å; F443-F471 AromaticContact CD1-CZ 3.45Å; F443-F471 HydrophobicContact CD1-CZ 3.45Å; F443-F471 VanDerWaalsContact CD1-CZ 3.45Å; F443-F471 HydrophobicContact CE1-CD2 4.02Å; F443-F471 HydrophobicContact CE1-CE1 4.44Å; F443-F471 AromaticContact CE1-CE2 3.82Å; F443-F471 HydrophobicContact CE1-CE2 3.82Å; F443-F471 HydrophobicContact CE1-CG 4.42Å; F443-F471 HydrophobicContact CE1-CZ 4.04Å; F443-F471 HydrophobicContact CG-CZ 4.36Å; L444-F471 HydrophobicContact CD2-CE1 3.92Å; L444-F471 HydrophobicContact CD2-CE2 4.3Å; L444-F471 HydrophobicContact CD2-CZ 3.42Å; L444-F471 VanDerWaalsContact CD2-CZ 3.42Å; L444-F471 HydrophobicContact CG-CE1 4.06Å; L444-F471 HydrophobicContact CG-CZ 3.86Å; T467-F471 HydrophobicContact CG2-CD2 3.91Å; T467-F471 HydrophobicContact CG2-CE2 3.81Å; T467-F471 VanDerWaalsContact O-CD2 3.23Å; T467-F471 WeakPolarHBondContact O-CD2 3.37Å; T467-F471 PolarHBondContact O-N 2.99Å; T467-F471 VanDerWaalsContact O-N 3.09Å; I468-F471 PolarHBondContact O-N 3.48Å; F471-M473 VanDerWaalsContact C-N 3.35Å; F471-M473 PolarHBondContact O-N 2.98Å; F471-I474 HydrophobicContact CD1-CD1 4.46Å; F471-I474 PolarHBondContact O-N 2.86Å; F471-L475 VanDerWaalsContact O-CG 3.31Å; F471-L475 WeakPolarHBondContact O-CG 3.42Å; F471-L475 PolarHBondContact O-N 3.39Å
472	E	96.8	Very high	93.6	Very high	39 Å²	39	45 Å²	45	18%	0.182	22%	0.22	C	C	.	.	H	α-helix	trans	-58.5	-44.4	174.7	-179.6	174.1	-170.2	0	0	112.3	R396 I400 I468 K469 I474 L475 K476	R396-E472 IonicContact CZ-OE2 2.68Å; R396-E472 IonicContact NE-OE2 3.04Å; R396-E472 PolarHBondContact NE-OE2 3.28Å; R396-E472 IonicContact NH2-OE2 3.06Å; R396-E472 PolarHBondContact NH2-OE2 2.93Å; I400-E472 HydrophobicContact CD1-CB 3.71Å; I400-E472 HydrophobicContact CD1-CG 3.78Å; I400-E472 HydrophobicContact CG1-CB 4.12Å; I468-E472 VanDerWaalsContact O-CB 3.23Å; I468-E472 WeakPolarHBondContact O-CB 3.37Å; I468-E472 PolarHBondContact O-N 3Å; K469-E472 PolarHBondContact O-N 2.83Å; E472-I474 VanDerWaalsContact C-N 3.34Å; E472-I474 PolarHBondContact O-N 3.37Å; E472-L475 PolarHBondContact O-N 3.05Å; E472-K476 HydrophobicContact CG-CD 4.21Å; E472-K476 WeakPolarHBondContact O-CG 3.36Å; E472-K476 PolarHBondContact O-N 3.12Å; E472-K476 WeakPolarHBondContact OE1-CE 3.35Å; E472-K476 IonicContact OE1-NZ 2.71Å; E472-K476 PolarHBondContact OE1-NZ 3.01Å
473	M	95.5	Very high	93.6	Very high	41 Å²	41	47.6 Å²	47.6	20%	0.202	24%	0.237	C	C	.	.	H	α-helix	trans	-64.5	-37.9	176.4	-68.5	176.9	71.6	0	0	112.4	K469 G470 F471 G477 E478 L479 I493	K469-M473 HydrophobicContact CG-SD 4.37Å; K469-M473 WeakPolarHBondContact O-CG 3.46Å; K469-M473 PolarHBondContact O-N 2.92Å; G470-M473 PolarHBondContact O-N 2.77Å; F471-M473 VanDerWaalsContact C-N 3.35Å; F471-M473 PolarHBondContact O-N 2.98Å; M473-G477 PolarHBondContact O-N 3.2Å; M473-E478 HydrophobicContact CB-CB 4.49Å; M473-E478 PolarHBondContact O-N 2.87Å; M473-E478 VanDerWaalsContact O-N 3.11Å; M473-L479 HydrophobicContact CB-CD1 4.04Å; M473-L479 HydrophobicContact CB-CG 4.39Å; M473-L479 HydrophobicContact CE-CD2 4.19Å; M473-I493 HydrophobicContact SD-CG1 4.09Å; M473-I493 HydrophobicContact SD-CG2 3.89Å
474	I	94.1	Very high	93.5	Very high	1 Å²	1	47.2 Å²	47.2	1%	0.005	23%	0.231	C	C	.	.	H	α-helix	trans	-66.5	-44.5	176.2	-62.9	166.7	0	0	0	110.5	I440 F443 G470 F471 E472 K476 G477 L479 F487 I493	I440-I474 HydrophobicContact CD1-CG2 4.21Å; I440-I474 HydrophobicContact CG1-CG2 3.65Å; F443-I474 HydrophobicContact CB-CD1 4.06Å; F443-I474 HydrophobicContact CD1-CD1 3.51Å; F443-I474 HydrophobicContact CE1-CD1 4.16Å; F443-I474 HydrophobicContact CG-CD1 3.86Å; G470-I474 WeakPolarHBondContact O-CG1 3.36Å; G470-I474 PolarHBondContact O-N 3.49Å; F471-I474 HydrophobicContact CD1-CD1 4.46Å; F471-I474 PolarHBondContact O-N 2.86Å; E472-I474 VanDerWaalsContact C-N 3.34Å; E472-I474 PolarHBondContact O-N 3.37Å; I474-K476 VanDerWaalsContact C-N 3.32Å; I474-K476 PolarHBondContact O-N 2.75Å; I474-G477 PolarHBondContact O-N 2.72Å; I474-G477 VanDerWaalsContact O-N 3.12Å; I474-L479 HydrophobicContact CG1-CD1 4.05Å; I474-F487 HydrophobicContact CD1-CD1 4.02Å; I474-F487 HydrophobicContact CD1-CE1 3.75Å; I474-F487 HydrophobicContact CG1-CE1 3.85Å; I474-I493 HydrophobicContact CD1-CD1 4.34Å; I474-I493 HydrophobicContact CG1-CD1 4.39Å
475	L	94.4	Very high	93.4	Very high	34 Å²	34	50 Å²	50	18%	0.178	25%	0.245	C	C	.	.	H	α-helix	trans	-63.5	-37.4	178.7	-69.6	-177.2	0	0	0	112.4	I400 V404 I407 R436 I440 F471 E472 G477	I400-L475 HydrophobicContact CB-CD1 4.39Å; I400-L475 HydrophobicContact CD1-CD1 3.94Å; I400-L475 HydrophobicContact CG2-CD1 3.98Å; V404-L475 HydrophobicContact CG2-CD1 4.24Å; V404-L475 HydrophobicContact CG2-CD2 4.18Å; V404-L475 HydrophobicContact CG2-CG 4.32Å; I407-L475 HydrophobicContact CD1-CD2 3.39Å; I407-L475 HydrophobicContact CG1-CD2 4.28Å; R436-L475 PolarHBondContact NH1-O 2.68Å; I440-L475 HydrophobicContact CD1-CD2 4.27Å; F471-L475 VanDerWaalsContact O-CG 3.31Å; F471-L475 WeakPolarHBondContact O-CG 3.42Å; F471-L475 PolarHBondContact O-N 3.39Å; E472-L475 PolarHBondContact O-N 3.05Å; L475-G477 PolarHBondContact O-N 2.93Å
476	K	93.8	Very high	93.3	Very high	124 Å²	124	44.6 Å²	44.6	54%	0.539	22%	0.22	S	C	.	.	H	α-helix	trans	-72.7	-12.2	176	-72.2	175.6	-174.5	171	0	113.7	E472 I474 E478	E472-K476 HydrophobicContact CG-CD 4.21Å; E472-K476 WeakPolarHBondContact O-CG 3.36Å; E472-K476 PolarHBondContact O-N 3.12Å; E472-K476 WeakPolarHBondContact OE1-CE 3.35Å; E472-K476 IonicContact OE1-NZ 2.71Å; E472-K476 PolarHBondContact OE1-NZ 3.01Å; I474-K476 VanDerWaalsContact C-N 3.32Å; I474-K476 PolarHBondContact O-N 2.75Å; K476-E478 HydrophobicContact CB-CG 4.07Å; K476-E478 WeakPolarHBondContact CD-OE1 3.48Å
477	G	90.6	Very high	93.4	Very high	15 Å²	15	41.2 Å²	41.2	16%	0.155	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.6	10.7	-179.6	0	0	0	0	0	115	M473 I474 L475 L479 D480	M473-G477 PolarHBondContact O-N 3.2Å; I474-G477 PolarHBondContact O-N 2.72Å; I474-G477 VanDerWaalsContact O-N 3.12Å; L475-G477 PolarHBondContact O-N 2.93Å; G477-L479 PolarHBondContact O-N 2.93Å; G477-L479 VanDerWaalsContact O-N 3.1Å; G477-D480 VanDerWaalsContact CA-OD2 3.28Å; G477-D480 WeakPolarHBondContact CA-OD2 3.32Å; G477-D480 PolarHBondContact O-N 2.65Å
478	E	92.1	Very high	93.3	Very high	96 Å²	96	44.6 Å²	44.6	45%	0.449	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-22.5	-177	-64.4	177.6	-153.5	0	0	112.2	M473 K476 H481	M473-E478 HydrophobicContact CB-CB 4.49Å; M473-E478 PolarHBondContact O-N 2.87Å; M473-E478 VanDerWaalsContact O-N 3.11Å; K476-E478 HydrophobicContact CB-CG 4.07Å; K476-E478 WeakPolarHBondContact CD-OE1 3.48Å; E478-H481 PolarHBondContact O-CE1 2.84Å; E478-H481 PolarHBondContact O-ND1 2.84Å
479	L	90.6	Very high	93	Very high	17 Å²	17	45.7 Å²	45.7	9%	0.089	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.4	17.2	-174.7	-53.2	173.7	0	0	0	113	K439 M473 I474 G477 H481 L482 F487 I493	K439-L479 PolarHBondContact NZ-O 2.82Å; M473-L479 HydrophobicContact CB-CD1 4.04Å; M473-L479 HydrophobicContact CB-CG 4.39Å; M473-L479 HydrophobicContact CE-CD2 4.19Å; I474-L479 HydrophobicContact CG1-CD1 4.05Å; G477-L479 PolarHBondContact O-N 2.93Å; G477-L479 VanDerWaalsContact O-N 3.1Å; L479-H481 PolarHBondContact O-N 3.25Å; L479-L482 HydrophobicContact CB-CD1 4.22Å; L479-L482 HydrophobicContact CD2-CD1 3.86Å; L479-L482 PolarHBondContact O-N 3.04Å; L479-L482 VanDerWaalsContact O-N 3.13Å; L479-F487 HydrophobicContact CB-CE1 4.49Å; L479-F487 HydrophobicContact CB-CZ 3.92Å; L479-F487 HydrophobicContact CD1-CE1 4.2Å; L479-F487 HydrophobicContact CD1-CZ 4.38Å; L479-I493 HydrophobicContact CD1-CD1 3.34Å; L479-I493 HydrophobicContact CD1-CG1 3.51Å
480	D	91.4	Very high	92.7	Very high	48 Å²	48	41.8 Å²	41.8	26%	0.257	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-27	-177.8	-75	-17	0	0	0	113	R436 K439 G477 L482	R436-D480 WeakPolarHBondContact CG-OD1 3.3Å; R436-D480 IonicContact CZ-OD1 3.59Å; R436-D480 IonicContact CZ-OD2 3.92Å; R436-D480 VanDerWaalsContact CZ-OD2 3.28Å; R436-D480 IonicContact NE-OD1 3.14Å; R436-D480 PolarHBondContact NE-OD1 3.02Å; R436-D480 IonicContact NE-OD2 3.54Å; R436-D480 PolarHBondContact NE-OD2 3.34Å; R436-D480 IonicContact NH2-OD2 2.69Å; R436-D480 PolarHBondContact NH2-OD2 3.01Å; K439-D480 VanDerWaalsContact NZ-CA 3.26Å; K439-D480 PolarHBondContact NZ-O 2.88Å; G477-D480 VanDerWaalsContact CA-OD2 3.28Å; G477-D480 WeakPolarHBondContact CA-OD2 3.32Å; G477-D480 PolarHBondContact O-N 2.65Å; D480-L482 VanDerWaalsContact C-N 3.3Å; D480-L482 PolarHBondContact O-N 2.89Å
481	H	90.7	Very high	92.5	Very high	149 Å²	149	41.8 Å²	41.8	69%	0.69	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-15.8	177.2	64.2	-79.6	0	0	0	114.1	E478 L479	E478-H481 PolarHBondContact O-CE1 2.84Å; E478-H481 PolarHBondContact O-ND1 2.84Å; L479-H481 PolarHBondContact O-N 3.25Å
482	L	91.8	Very high	92.2	Very high	23 Å²	23	43.4 Å²	43.4	12%	0.12	22%	0.215	C	C	.	.	S	Bend	trans	-82.6	145.4	-178	-59.2	-174.6	0	0	0	111.9	K439 L479 D480 F487 V496 A500	K439-L482 WeakPolarHBondContact CE-O 3.39Å; K439-L482 PolarHBondContact NZ-O 2.91Å; L479-L482 HydrophobicContact CB-CD1 4.22Å; L479-L482 HydrophobicContact CD2-CD1 3.86Å; L479-L482 PolarHBondContact O-N 3.04Å; L479-L482 VanDerWaalsContact O-N 3.13Å; D480-L482 VanDerWaalsContact C-N 3.3Å; D480-L482 PolarHBondContact O-N 2.89Å; L482-F487 HydrophobicContact CB-CE2 4.02Å; L482-F487 HydrophobicContact CB-CZ 4.38Å; L482-V496 HydrophobicContact CD1-CG1 3.91Å; L482-A500 HydrophobicContact CB-CB 4.42Å; L482-A500 HydrophobicContact CD1-CB 4.39Å; L482-A500 HydrophobicContact CD2-CB 3.73Å; L482-A500 HydrophobicContact CG-CB 4.41Å
483	P	92.2	Very high	91.8	Very high	58 Å²	58	41.9 Å²	41.9	38%	0.377	21%	0.208	S	C	.	.			trans	-70.7	145.3	-179.9	29.7	-35	0	0	0	111.8	I485 A486 A500 L503	P483-I485 HydrophobicContact CB-CG2 4.33Å; P483-I485 PolarHBondContact O-N 2.86Å; P483-I485 VanDerWaalsContact O-N 3.17Å; P483-A486 HydrophobicContact CG-CB 4.16Å; P483-A486 WeakPolarHBondContact O-CB 3.4Å; P483-A486 PolarHBondContact O-N 3.22Å; P483-A500 HydrophobicContact CG-CB 4.39Å; P483-L503 HydrophobicContact CG-CD1 4.48Å
484	E	91.1	Very high	91.6	Very high	42 Å²	42	43.6 Å²	43.6	20%	0.196	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-57	-36.3	-176.1	-57.9	-179.4	179.9	0	0	113.4	R438 K439 R442 A486 F487	R438-E484 VanDerWaalsContact CD-OE1 3.3Å; R438-E484 WeakPolarHBondContact CD-OE1 3.39Å; R438-E484 IonicContact NH1-OE1 2.91Å; K439-E484 HydrophobicContact CG-CB 4.44Å; K439-E484 HydrophobicContact CG-CG 4.13Å; R442-E484 VanDerWaalsContact CD-O 3.22Å; R442-E484 WeakPolarHBondContact CD-O 3.05Å; R442-E484 IonicContact CZ-OE2 3.63Å; R442-E484 VanDerWaalsContact CZ-OE2 3.24Å; R442-E484 IonicContact NH1-OE2 3.88Å; R442-E484 PolarHBondContact NH1-OE2 2.8Å; R442-E484 IonicContact NH2-OE2 2.72Å; R442-E484 PolarHBondContact NH2-OE2 2.97Å; E484-A486 PolarHBondContact O-N 2.61Å; E484-F487 PolarHBondContact O-N 3.29Å; E484-F487 VanDerWaalsContact O-N 3.13Å
485	I	91.5	Very high	91.4	Very high	87 Å²	87	45.3 Å²	45.3	45%	0.446	22%	0.224	S	C	.	.	G	3₁₀ helix	trans	-65.9	-20.8	-178.6	-167.2	63.1	0	0	0	113	P483 F487 Y488 L503	P483-I485 HydrophobicContact CB-CG2 4.33Å; P483-I485 PolarHBondContact O-N 2.86Å; P483-I485 VanDerWaalsContact O-N 3.17Å; I485-F487 PolarHBondContact O-N 2.89Å; I485-Y488 PolarHBondContact O-N 3.45Å; I485-L503 HydrophobicContact CG2-CD1 3.53Å
486	A	92.6	Very high	91.2	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-69.1	-21.5	175.9	0	0	0	0	0	112.6	P483 E484 V496 K499 A500 L503	P483-A486 HydrophobicContact CG-CB 4.16Å; P483-A486 WeakPolarHBondContact O-CB 3.4Å; P483-A486 PolarHBondContact O-N 3.22Å; E484-A486 PolarHBondContact O-N 2.61Å; A486-V496 HydrophobicContact CB-CG1 4.05Å; A486-K499 HydrophobicContact CB-CB 4.47Å; A486-A500 HydrophobicContact CB-CB 3.79Å; A486-L503 HydrophobicContact CB-CD1 4.33Å
487	F	94.6	Very high	91	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-85.3	-10.4	179.1	-66.4	-96.1	0	0	0	113.3	K439 R442 F443 I474 L479 L482 E484 I485 V490 I493 V496	K439-F487 HydrophobicContact CB-CD1 4.37Å; K439-F487 HydrophobicContact CB-CD2 4.06Å; K439-F487 HydrophobicContact CB-CE1 4.42Å; K439-F487 HydrophobicContact CB-CE2 4.13Å; K439-F487 HydrophobicContact CB-CG 4.17Å; K439-F487 HydrophobicContact CB-CZ 4.3Å; K439-F487 HydrophobicContact CD-CD2 4.29Å; K439-F487 HydrophobicContact CD-CE2 3.68Å; K439-F487 HydrophobicContact CD-CZ 3.96Å; K439-F487 HydrophobicContact CG-CD2 3.83Å; K439-F487 HydrophobicContact CG-CE2 3.74Å; K439-F487 HydrophobicContact CG-CG 4.44Å; K439-F487 HydrophobicContact CG-CZ 4.27Å; R442-F487 CarbonylContact C-O 3.38Å; R442-F487 HydrophobicContact CB-CB 3.94Å; F443-F487 WeakPolarHBondContact CA-O 3.49Å; F443-F487 HydrophobicContact CB-CB 4.12Å; F443-F487 HydrophobicContact CB-CD1 3.92Å; F443-F487 HydrophobicContact CB-CG 4.5Å; F443-F487 HydrophobicContact CD2-CD1 4.07Å; F443-F487 HydrophobicContact CG-CD1 4.13Å; F443-F487 PolarHBondContact N-O 2.97Å; I474-F487 HydrophobicContact CD1-CD1 4.02Å; I474-F487 HydrophobicContact CD1-CE1 3.75Å; I474-F487 HydrophobicContact CG1-CE1 3.85Å; L479-F487 HydrophobicContact CB-CE1 4.49Å; L479-F487 HydrophobicContact CB-CZ 3.92Å; L479-F487 HydrophobicContact CD1-CE1 4.2Å; L479-F487 HydrophobicContact CD1-CZ 4.38Å; L482-F487 HydrophobicContact CB-CE2 4.02Å; L482-F487 HydrophobicContact CB-CZ 4.38Å; E484-F487 PolarHBondContact O-N 3.29Å; E484-F487 VanDerWaalsContact O-N 3.13Å; I485-F487 PolarHBondContact O-N 2.89Å; F487-V490 WeakPolarHBondContact O-CG2 3.48Å; F487-I493 HydrophobicContact CE1-CD1 4.5Å; F487-V496 HydrophobicContact CD1-CG1 3.76Å; F487-V496 HydrophobicContact CD1-CG2 3.94Å; F487-V496 HydrophobicContact CD2-CG1 3.94Å; F487-V496 HydrophobicContact CE1-CG1 3.68Å; F487-V496 HydrophobicContact CE1-CG2 4.32Å; F487-V496 HydrophobicContact CE2-CG1 3.83Å; F487-V496 HydrophobicContact CG-CG1 3.91Å; F487-V496 HydrophobicContact CG-CG2 4.44Å; F487-V496 HydrophobicContact CZ-CG1 3.72Å
488	Y	93.3	Very high	90.9	Very high	72 Å²	72	46 Å²	46	28%	0.282	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	132.6	-175.6	180	-109.2	0	0	0	112.1	G373 I485 V490 K499	G373-Y488 WeakPolarHBondContact O-CE2 3.4Å; G373-Y488 PolarHBondContact O-OH 2.93Å; I485-Y488 PolarHBondContact O-N 3.45Å; Y488-V490 PolarHBondContact O-N 2.84Å; Y488-K499 PolarHBondContact O-NZ 3.39Å
489	M	89.9	Confident	90.8	Very high	27 Å²	27	43.6 Å²	43.6	13%	0.133	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.1	54.1	176.1	-69.2	-69.9	-163.7	0	0	113.3	Y375 S445 P447	Y375-M489 HydrophobicContact CD2-CE 4.39Å; S445-M489 PolarHBondContact OG-N 2.83Å; P447-M489 HydrophobicContact CB-SD 4.47Å
490	V	90.6	Very high	90.7	Very high	4 Å²	4	43.1 Å²	43.1	2%	0.024	22%	0.219	C	C	.	.			trans	-126.7	154.5	177.1	-63.9	0	0	0	0	110.1	K168 F443 F487 Y488 E495 V496 K499	K168-V490 PolarHBondContact NZ-O 3.45Å; F443-V490 HydrophobicContact CD2-CG2 3.85Å; F443-V490 HydrophobicContact CE2-CG2 3.94Å; F487-V490 WeakPolarHBondContact O-CG2 3.48Å; Y488-V490 PolarHBondContact O-N 2.84Å; V490-E495 HydrophobicContact CB-CB 4.11Å; V490-E495 HydrophobicContact CG1-CB 4.37Å; V490-V496 HydrophobicContact CG2-CG2 3.72Å; V490-K499 HydrophobicContact CG1-CD 3.83Å
491	G	88.2	Confident	90.6	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.01	23%	0.227	C	C	.	.	S	Bend	trans	-77.8	-89.3	176	0	0	0	0	0	110.9	K168 E495	K168-G491 WeakPolarHBondContact CD-O 3.34Å; K168-G491 WeakPolarHBondContact CE-O 3.5Å; K168-G491 PolarHBondContact NZ-O 2.81Å; G491-E495 PolarHBondContact N-OE2 3.45Å
492	N	90.6	Very high	90.4	Very high	33 Å²	33	42.3 Å²	42.3	18%	0.176	22%	0.217	C	C	.	.	S	Bend	trans	-95.2	-178.9	-177	65.9	13	0	0	0	113.3	E466 E494 E495	E466-N492 HydrophobicContact CB-CB 4.46Å; E466-N492 WeakPolarHBondContact OE2-CB 3.47Å; E466-N492 PolarHBondContact OE2-ND2 2.85Å; E466-N492 VanDerWaalsContact OE2-ND2 3.07Å; N492-E494 PolarHBondContact ND2-OE2 2.87Å; N492-E495 WeakPolarHBondContact OD1-CG 3.46Å; N492-E495 PolarHBondContact OD1-N 3.11Å
493	I	88.7	Confident	90.2	Very high	8 Å²	8	42.8 Å²	42.8	4%	0.041	22%	0.22	C	C	.	.	H	α-helix	trans	-75.2	-28.8	-173.7	-154.8	63.3	0	0	0	112.2	F443 M473 I474 L479 F487 E495 V496 A497	F443-I493 HydrophobicContact CE1-CD1 4.24Å; F443-I493 HydrophobicContact CE2-CD1 4.05Å; F443-I493 HydrophobicContact CZ-CD1 3.83Å; M473-I493 HydrophobicContact SD-CG1 4.09Å; M473-I493 HydrophobicContact SD-CG2 3.89Å; I474-I493 HydrophobicContact CD1-CD1 4.34Å; I474-I493 HydrophobicContact CG1-CD1 4.39Å; L479-I493 HydrophobicContact CD1-CD1 3.34Å; L479-I493 HydrophobicContact CD1-CG1 3.51Å; F487-I493 HydrophobicContact CE1-CD1 4.5Å; I493-E495 VanDerWaalsContact C-N 3.27Å; I493-E495 PolarHBondContact O-N 3.45Å; I493-V496 HydrophobicContact CD1-CG2 4.1Å; I493-V496 WeakPolarHBondContact O-CB 3.46Å; I493-V496 PolarHBondContact O-N 3.11Å; I493-V496 VanDerWaalsContact O-N 3.14Å; I493-A497 PolarHBondContact O-N 3.2Å
494	E	90.1	Very high	89.8	Confident	76 Å²	76	42.4 Å²	42.4	36%	0.355	22%	0.221	S	C	.	.	H	α-helix	trans	-62.8	-36	176.7	-67.1	76.4	-167	0	0	111.3	K469 N492 V496 A497 Q498	K469-E494 IonicContact NZ-OE1 3.91Å; K469-E494 PolarHBondContact NZ-OE1 2.87Å; N492-E494 PolarHBondContact ND2-OE2 2.87Å; E494-V496 VanDerWaalsContact C-N 3.32Å; E494-V496 PolarHBondContact O-N 2.75Å; E494-A497 PolarHBondContact O-N 3.01Å; E494-Q498 WeakPolarHBondContact O-CG 3.07Å; E494-Q498 PolarHBondContact O-N 2.88Å; E494-Q498 VanDerWaalsContact O-N 3.1Å
495	E	89.9	Confident	89.4	Confident	38 Å²	38	47.1 Å²	47.1	18%	0.178	24%	0.244	C	C	.	.	H	α-helix	trans	-66.4	-31.5	174.4	-73	175.5	-159.4	0	0	113.8	K460 V490 G491 N492 I493 A497 Q498 K499	K460-E495 WeakPolarHBondContact CD-OE1 3.48Å; K460-E495 IonicContact NZ-OE1 2.75Å; K460-E495 PolarHBondContact NZ-OE1 2.92Å; K460-E495 IonicContact NZ-OE2 3.72Å; K460-E495 PolarHBondContact NZ-OE2 3.33Å; V490-E495 HydrophobicContact CB-CB 4.11Å; V490-E495 HydrophobicContact CG1-CB 4.37Å; G491-E495 PolarHBondContact N-OE2 3.45Å; N492-E495 WeakPolarHBondContact OD1-CG 3.46Å; N492-E495 PolarHBondContact OD1-N 3.11Å; I493-E495 VanDerWaalsContact C-N 3.27Å; I493-E495 PolarHBondContact O-N 3.45Å; E495-A497 VanDerWaalsContact C-N 3.31Å; E495-Q498 PolarHBondContact O-N 3.18Å; E495-K499 VanDerWaalsContact O-CB 3.25Å; E495-K499 WeakPolarHBondContact O-CB 3.14Å; E495-K499 PolarHBondContact O-N 2.85Å
496	V	90.3	Very high	88.7	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-60.7	-46.5	174.1	-179.6	0	0	0	0	109.4	F443 L482 A486 F487 V490 I493 E494 K499 A500	F443-V496 HydrophobicContact CD2-CG2 3.92Å; F443-V496 HydrophobicContact CE2-CG2 3.78Å; L482-V496 HydrophobicContact CD1-CG1 3.91Å; A486-V496 HydrophobicContact CB-CG1 4.05Å; F487-V496 HydrophobicContact CD1-CG1 3.76Å; F487-V496 HydrophobicContact CD1-CG2 3.94Å; F487-V496 HydrophobicContact CD2-CG1 3.94Å; F487-V496 HydrophobicContact CE1-CG1 3.68Å; F487-V496 HydrophobicContact CE1-CG2 4.32Å; F487-V496 HydrophobicContact CE2-CG1 3.83Å; F487-V496 HydrophobicContact CG-CG1 3.91Å; F487-V496 HydrophobicContact CG-CG2 4.44Å; F487-V496 HydrophobicContact CZ-CG1 3.72Å; V490-V496 HydrophobicContact CG2-CG2 3.72Å; I493-V496 HydrophobicContact CD1-CG2 4.1Å; I493-V496 WeakPolarHBondContact O-CB 3.46Å; I493-V496 PolarHBondContact O-N 3.11Å; I493-V496 VanDerWaalsContact O-N 3.14Å; E494-V496 VanDerWaalsContact C-N 3.32Å; E494-V496 PolarHBondContact O-N 2.75Å; V496-K499 PolarHBondContact O-N 2.88Å; V496-A500 VanDerWaalsContact O-CB 3.29Å; V496-A500 WeakPolarHBondContact O-CB 3.18Å; V496-A500 PolarHBondContact O-N 2.7Å
497	A	89.4	Confident	87.7	Confident	50 Å²	50	56.8 Å²	56.8	41%	0.413	29%	0.287	S	S	.	.	H	α-helix	trans	-63.7	-42.9	178.9	0	0	0	0	0	111.8	I493 E494 E495 A500 A501	I493-A497 PolarHBondContact O-N 3.2Å; E494-A497 PolarHBondContact O-N 3.01Å; E495-A497 VanDerWaalsContact C-N 3.31Å; A497-A500 PolarHBondContact O-N 3.22Å; A497-A501 WeakPolarHBondContact O-CB 3.39Å; A497-A501 PolarHBondContact O-N 3.08Å
498	Q	89.8	Confident	86	Confident	138 Å²	138	68.2 Å²	68.2	65%	0.645	34%	0.336	S	S	*	.	H	α-helix	trans	-63.2	-44.8	176.5	-68.8	174.5	8	0	0	112.2	E494 E495 A500 A501 R502	E494-Q498 WeakPolarHBondContact O-CG 3.07Å; E494-Q498 PolarHBondContact O-N 2.88Å; E494-Q498 VanDerWaalsContact O-N 3.1Å; E495-Q498 PolarHBondContact O-N 3.18Å; Q498-A500 VanDerWaalsContact C-N 3.35Å; Q498-A501 PolarHBondContact O-N 2.92Å; Q498-R502 PolarHBondContact O-N 2.93Å
499	K	89.5	Confident	85.7	Confident	45 Å²	45	68 Å²	68	20%	0.196	34%	0.339	C	S	.	.	H	α-helix	trans	-66.1	-39	178.6	-171.8	168.3	176.8	172.4	0	111.3	A486 Y488 V490 E495 V496 R502 L503	A486-K499 HydrophobicContact CB-CB 4.47Å; Y488-K499 PolarHBondContact O-NZ 3.39Å; V490-K499 HydrophobicContact CG1-CD 3.83Å; E495-K499 VanDerWaalsContact O-CB 3.25Å; E495-K499 WeakPolarHBondContact O-CB 3.14Å; E495-K499 PolarHBondContact O-N 2.85Å; V496-K499 PolarHBondContact O-N 2.88Å; K499-R502 PolarHBondContact O-N 3.18Å; K499-L503 HydrophobicContact CG-CD1 4.21Å; K499-L503 WeakPolarHBondContact O-CD1 3.08Å; K499-L503 VanDerWaalsContact O-CG 3.24Å; K499-L503 WeakPolarHBondContact O-CG 3.35Å; K499-L503 PolarHBondContact O-N 2.86Å
500	A	88.9	Confident	85.5	Confident	7 Å²	7	70.2 Å²	70.2	6%	0.058	35%	0.35	C	S	.	.	H	α-helix	trans	-64.4	-42.3	174.8	0	0	0	0	0	112.4	L482 P483 A486 V496 A497 Q498 L503 A504	L482-A500 HydrophobicContact CB-CB 4.42Å; L482-A500 HydrophobicContact CD1-CB 4.39Å; L482-A500 HydrophobicContact CD2-CB 3.73Å; L482-A500 HydrophobicContact CG-CB 4.41Å; P483-A500 HydrophobicContact CG-CB 4.39Å; A486-A500 HydrophobicContact CB-CB 3.79Å; V496-A500 VanDerWaalsContact O-CB 3.29Å; V496-A500 WeakPolarHBondContact O-CB 3.18Å; V496-A500 PolarHBondContact O-N 2.7Å; A497-A500 PolarHBondContact O-N 3.22Å; Q498-A500 VanDerWaalsContact C-N 3.35Å; A500-L503 PolarHBondContact O-N 3.34Å; A500-A504 PolarHBondContact O-N 3.32Å
501	A	89.1	Confident	85.2	Confident	52 Å²	52	73.8 Å²	73.8	43%	0.43	37%	0.368	S	S	.	.	H	α-helix	trans	-60.5	-46.2	175.5	0	0	0	0	0	111.4	A497 Q498 L503 A504 E505	A497-A501 WeakPolarHBondContact O-CB 3.39Å; A497-A501 PolarHBondContact O-N 3.08Å; Q498-A501 PolarHBondContact O-N 2.92Å; A501-L503 VanDerWaalsContact C-N 3.35Å; A501-L503 PolarHBondContact O-N 2.74Å; A501-A504 PolarHBondContact O-N 2.83Å; A501-E505 PolarHBondContact O-N 3.33Å
502	R	87.4	Confident	85	Confident	127 Å²	127	78.1 Å²	78.1	48%	0.479	39%	0.389	S	S	.	.	H	α-helix	trans	-59.7	-43.1	176.2	-174.8	172	65.2	95.1	-8.7	112.5	Q498 K499 A504 E505 E506	Q498-R502 PolarHBondContact O-N 2.93Å; K499-R502 PolarHBondContact O-N 3.18Å; R502-A504 VanDerWaalsContact C-N 3.32Å; R502-A504 PolarHBondContact O-N 3.38Å; R502-E505 PolarHBondContact O-N 3.22Å; R502-E506 IonicContact CZ-OE1 2.81Å; R502-E506 IonicContact NH1-OE1 3.9Å; R502-E506 PolarHBondContact NH1-OE1 2.83Å; R502-E506 WeakPolarHBondContact O-CG 2.98Å; R502-E506 PolarHBondContact O-N 3.48Å
503	L	86.3	Confident	84.6	Confident	33 Å²	33	80.9 Å²	80.9	17%	0.173	40%	0.402	C	S	.	.	H	α-helix	trans	-66.3	-33.9	177.6	-71.6	164.7	0	0	0	112.7	P483 I485 A486 K499 A500 A501 E505 Q507	P483-L503 HydrophobicContact CG-CD1 4.48Å; I485-L503 HydrophobicContact CG2-CD1 3.53Å; A486-L503 HydrophobicContact CB-CD1 4.33Å; K499-L503 HydrophobicContact CG-CD1 4.21Å; K499-L503 WeakPolarHBondContact O-CD1 3.08Å; K499-L503 VanDerWaalsContact O-CG 3.24Å; K499-L503 WeakPolarHBondContact O-CG 3.35Å; K499-L503 PolarHBondContact O-N 2.86Å; A500-L503 PolarHBondContact O-N 3.34Å; A501-L503 VanDerWaalsContact C-N 3.35Å; A501-L503 PolarHBondContact O-N 2.74Å; L503-E505 VanDerWaalsContact C-N 3.34Å; L503-Q507 WeakPolarHBondContact O-CG 3.35Å; L503-Q507 PolarHBondContact O-N 2.79Å
504	A	84.2	Confident	84.4	Confident	50 Å²	50	85.8 Å²	85.8	41%	0.413	43%	0.426	S	S	.	.	H	α-helix	trans	-71.3	-30.5	175.6	0	0	0	0	0	112.4	A500 A501 R502	A500-A504 PolarHBondContact O-N 3.32Å; A501-A504 PolarHBondContact O-N 2.83Å; R502-A504 VanDerWaalsContact C-N 3.32Å; R502-A504 PolarHBondContact O-N 3.38Å
505	E	82.7	Confident	84	Confident	142 Å²	142	86.5 Å²	86.5	66%	0.664	43%	0.432	S	S	*	.	H	α-helix	trans	-72	-41.7	171.8	-72.1	177.4	176.8	0	0	111.9	A501 R502 L503 Q507 K508	A501-E505 PolarHBondContact O-N 3.33Å; R502-E505 PolarHBondContact O-N 3.22Å; L503-E505 VanDerWaalsContact C-N 3.34Å; E505-Q507 PolarHBondContact O-N 2.68Å; E505-K508 PolarHBondContact O-N 3.42Å
506	E	77	Confident	83.5	Confident	119 Å²	119	90.2 Å²	90.2	56%	0.556	45%	0.451	S	S	*	.	H	α-helix	trans	-66	-22.1	177.1	-72.6	171.7	-169.7	0	0	113.2	R502	R502-E506 IonicContact CZ-OE1 2.81Å; R502-E506 IonicContact NH1-OE1 3.9Å; R502-E506 PolarHBondContact NH1-OE1 2.83Å; R502-E506 WeakPolarHBondContact O-CG 2.98Å; R502-E506 PolarHBondContact O-N 3.48Å
507	Q	70.3	Confident	82.9	Confident	171 Å²	171	97.8 Å²	97.8	80%	0.799	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-16.9	176.6	-76.3	-177.7	1.1	0	0	114.4	L503 E505	L503-Q507 WeakPolarHBondContact O-CG 3.35Å; L503-Q507 PolarHBondContact O-N 2.79Å; E505-Q507 PolarHBondContact O-N 2.68Å
508	K	60.8	Low	82.4	Confident	239 Å²	239	102.1 Å²	102.1	100%	1.039	50%	0.496	S	S	*	.			trans	-86.4	0	175.6	-80.6	-178.9	179.3	176.1	0	110.6	E505	E505-K508 PolarHBondContact O-N 3.42Å

Retrieved 508 of 508 residues in 619 ms (Link to these results)

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