A0A5K4FGP4_SCHMA Loading...

Egg protein

AlphaFold DB , UniProt , Accession A0A5K4FGP4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 440 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	42	Very low	36.8	Very low	233 Å²	233	160 Å²	160	100%	1.148	83%	0.825	S	S	*	*				0	122.2	0	-91.6	172	174.1	0	0	108
2	F	41.5	Very low	36.5	Very low	192 Å²	192	156.2 Å²	156.2	84%	0.842	81%	0.806	S	S	*	*			trans	52.6	93.6	171.2	-67.3	-85.2	0	0	0	118.2
3	R	35.5	Very low	36	Very low	233 Å²	233	156.3 Å²	156.3	88%	0.879	80%	0.797	S	S	*	*				60.2	99.9	88	-83.6	-175.6	165.4	175.1	-4.5	112.3
4	S	33.9	Very low	35.6	Very low	106 Å²	106	159.9 Å²	159.9	74%	0.741	81%	0.805	S	S	*	*				62	113.1	68.5	-163.1	0	0	0	0	113.1
5	Q	41.2	Very low	35.2	Very low	186 Å²	186	161.1 Å²	161.1	87%	0.869	80%	0.803	S	S	*	*				-173.1	119.5	118	-78	-121	2.9	0	0	110.6
6	V	33.6	Very low	35.1	Very low	131 Å²	131	160.1 Å²	160.1	79%	0.794	80%	0.801	S	S	*	*			trans	-80.2	131.2	163	169.1	0	0	0	0	107.1	V8	V6-V8 HydrophobicContact CG1-CG2 4.26Å
7	A	39.4	Very low	34.8	Very low	96 Å²	96	157.6 Å²	157.6	79%	0.793	80%	0.795	S	S	*	*			trans	-125.9	107.9	167.1	0	0	0	0	0	109.3
8	V	34	Very low	34.5	Very low	117 Å²	117	161.9 Å²	161.9	71%	0.709	80%	0.801	S	S	*	*			trans	-75	125.4	166.7	170.7	0	0	0	0	107.8	V6	V6-V8 HydrophobicContact CG1-CG2 4.26Å
9	V	35.5	Very low	34.2	Very low	120 Å²	120	160.3 Å²	160.3	73%	0.727	80%	0.795	S	S	*	*			trans	-139.8	101.8	153.4	-177.3	0	0	0	0	108.9	F11	V9-F11 HydrophobicContact CG1-CB 4.08Å; V9-F11 HydrophobicContact CG1-CD2 3.6Å; V9-F11 HydrophobicContact CG1-CE2 4.48Å; V9-F11 HydrophobicContact CG1-CG 4.13Å
10	Q	34.3	Very low	34.2	Very low	181 Å²	181	156.8 Å²	156.8	85%	0.846	79%	0.793	S	S	*	*			trans	-85.5	102	164.2	-172.3	169.4	-15.4	0	0	106.1
11	F	34.4	Very low	34.3	Very low	165 Å²	165	157.7 Å²	157.7	72%	0.724	79%	0.794	S	S	*	*			trans	-132.6	106.7	172	-107.3	-112.5	0	0	0	106.3	V9	V9-F11 HydrophobicContact CG1-CB 4.08Å; V9-F11 HydrophobicContact CG1-CD2 3.6Å; V9-F11 HydrophobicContact CG1-CE2 4.48Å; V9-F11 HydrophobicContact CG1-CG 4.13Å
12	L	33.3	Very low	33.9	Very low	114 Å²	114	154.2 Å²	154.2	60%	0.597	78%	0.78	S	S	*	*				79.3	95.6	108.7	-83.3	135.6	0	0	0	112.4
13	F	29.5	Very low	33.8	Very low	158 Å²	158	153.4 Å²	153.4	69%	0.693	78%	0.779	S	S	*	*				98.3	106.6	88	-108.3	-109.3	0	0	0	108.9	F15	F13-F15 PolarHBondContact O-N 3.11Å
14	F	30.8	Very low	33.9	Very low	206 Å²	206	151 Å²	151	90%	0.904	78%	0.778	S	S	*	*				29.4	64.7	122.4	-108.1	-88.7	0	0	0	116.2
15	F	28.6	Very low	34.3	Very low	179 Å²	179	150 Å²	150	79%	0.785	77%	0.767	S	S	*	*			trans	-154.5	140.4	165.7	-87.9	-77	0	0	0	108.8	F13	F13-F15 PolarHBondContact O-N 3.11Å
16	L	34.2	Very low	34.2	Very low	145 Å²	145	146.7 Å²	146.7	76%	0.759	76%	0.76	S	S	*	*			trans	84.3	75	178.3	-44.7	174.5	0	0	0	113.8
17	V	29.6	Very low	34.6	Very low	117 Å²	117	143.1 Å²	143.1	71%	0.709	74%	0.744	S	S	*	*			cis	40.1	104	49.2	-176.3	0	0	0	0	111
18	W	30.5	Very low	34.8	Very low	236 Å²	236	145.9 Å²	145.9	89%	0.894	74%	0.74	S	S	*	*			trans	61	75.1	143.8	-132.9	-54.5	0	0	0	116.3
19	N	27.9	Very low	35.3	Very low	131 Å²	131	143.5 Å²	143.5	70%	0.701	73%	0.729	S	S	*	*			trans	-138.6	74.3	156.7	-81.5	-81.2	0	0	0	107.7	E21	N19-E21 PolarHBondContact O-N 3.3Å
20	A	35	Very low	35.7	Very low	90 Å²	90	143.2 Å²	143.2	74%	0.744	72%	0.723	S	S	*	*			trans	-83.1	101.2	154.2	0	0	0	0	0	104.9	D22	A20-D22 PolarHBondContact O-N 3.48Å; A20-D22 VanDerWaalsContact O-N 3.08Å
21	E	36.8	Very low	36	Very low	176 Å²	176	142.8 Å²	142.8	82%	0.822	72%	0.721	S	S	*	*			trans	-48.9	111.7	172.9	-88.4	154.5	126.4	0	0	110.4	N19 Q23	N19-E21 PolarHBondContact O-N 3.3Å; E21-Q23 PolarHBondContact O-N 3.48Å
22	D	33.4	Very low	36.4	Very low	159 Å²	159	136.3 Å²	136.3	85%	0.85	70%	0.696	S	S	*	*			trans	-53.1	93.9	150.7	-82.6	-42.4	0	0	0	107.4	A20 E24	A20-D22 PolarHBondContact O-N 3.48Å; A20-D22 VanDerWaalsContact O-N 3.08Å; D22-E24 PolarHBondContact O-N 3.12Å
23	Q	39.7	Very low	37	Very low	176 Å²	176	136.6 Å²	136.6	82%	0.822	70%	0.702	S	S	*	*			trans	-60.2	110.2	163.1	-88.6	-169.6	-44.7	0	0	107.4	E21 V25	E21-Q23 PolarHBondContact O-N 3.48Å; Q23-V25 PolarHBondContact O-N 3.41Å
24	E	36.6	Very low	38.1	Very low	182 Å²	182	134.3 Å²	134.3	85%	0.85	69%	0.694	S	S	*	*			trans	-47.8	95.9	167.9	-76.5	-178.5	135.4	0	0	110.5	D22 T26	D22-E24 PolarHBondContact O-N 3.12Å; E24-T26 PolarHBondContact O-N 2.73Å; E24-T26 VanDerWaalsContact O-N 3.12Å
25	V	41.8	Very low	39.5	Very low	84 Å²	84	132.6 Å²	132.6	51%	0.509	69%	0.686	S	S	.	*			trans	-73	102.6	164.6	179.5	0	0	0	0	106.4	Q23 A27	Q23-V25 PolarHBondContact O-N 3.41Å; V25-A27 PolarHBondContact O-N 2.79Å
26	T	39.6	Very low	42.1	Very low	117 Å²	117	126.6 Å²	126.6	72%	0.718	66%	0.662	S	S	*	*			trans	-67.8	93.3	178.3	28.4	0	0	0	0	110.5	E24 Q28	E24-T26 PolarHBondContact O-N 2.73Å; E24-T26 VanDerWaalsContact O-N 3.12Å; T26-Q28 PolarHBondContact O-N 3.29Å; T26-Q28 VanDerWaalsContact O-N 3.11Å
27	A	42.5	Very low	44.7	Very low	56 Å²	56	120.1 Å²	120.1	46%	0.463	63%	0.628	S	S	.	*			trans	-71.5	95.8	163.6	0	0	0	0	0	108.8	V25 S29	V25-A27 PolarHBondContact O-N 2.79Å; A27-S29 PolarHBondContact O-N 3.48Å
28	Q	43	Very low	47.7	Very low	155 Å²	155	115.2 Å²	115.2	72%	0.724	60%	0.598	S	S	*	*			trans	-72.7	113.3	171.9	-72.4	-176.3	-14.4	0	0	109.3	T26 L30	T26-Q28 PolarHBondContact O-N 3.29Å; T26-Q28 VanDerWaalsContact O-N 3.11Å; Q28-L30 PolarHBondContact O-N 3.47Å
29	S	44.1	Very low	50.6	Low	66 Å²	66	104.8 Å²	104.8	46%	0.462	56%	0.561	S	S	.	*			trans	-76.4	113.5	171.3	58.6	0	0	0	0	110	A27	A27-S29 PolarHBondContact O-N 3.48Å
30	L	44.3	Very low	53.7	Low	115 Å²	115	98.6 Å²	98.6	60%	0.602	53%	0.527	S	S	*	.	P	Polyproline II helix	trans	-70.5	123	158	-88	130	0	0	0	107.8	Q28 S32	Q28-L30 PolarHBondContact O-N 3.47Å; L30-S32 PolarHBondContact O-N 3.47Å
31	Q	40.7	Very low	56.5	Low	172 Å²	172	95.9 Å²	95.9	80%	0.804	50%	0.502	S	S	*	.	B	Isolated β-bridge	trans	-55.7	122.1	179	-80.6	179.7	-29.8	0	0	110.8
32	S	43.1	Very low	59.3	Low	28 Å²	28	87.5 Å²	87.5	20%	0.196	46%	0.462	C	S	.	.	P	Polyproline II helix	trans	-77.2	132.4	179.1	178.8	0	0	0	0	114.5	L30 H34 D155 E157	L30-S32 PolarHBondContact O-N 3.47Å; S32-H34 VanDerWaalsContact C-N 3.31Å; S32-H34 WeakPolarHBondContact OG-CA 3.1Å; S32-H34 PolarHBondContact OG-N 3.13Å; S32-H34 PolarHBondContact OG-O 2.77Å; S32-D155 VanDerWaalsContact CB-C 3.48Å; S32-D155 WeakPolarHBondContact CB-O 3.33Å; S32-D155 PolarHBondContact N-O 2.75Å; S32-D155 VanDerWaalsContact N-O 3.08Å; S32-E157 WeakPolarHBondContact CA-OE1 3.47Å
33	T	45.4	Very low	62.1	Low	120 Å²	120	81 Å²	81	74%	0.736	43%	0.428	S	S	*	.	S	Bend	trans	-82.6	-5.6	164.7	47.6	0	0	0	0	113.7	E157	T33-E157 PolarHBondContact N-OE1 2.63Å; T33-E157 VanDerWaalsContact N-OE1 3.09Å; T33-E157 PolarHBondContact OG1-OE1 3.13Å
34	H	52.4	Low	64.6	Low	111 Å²	111	72.7 Å²	72.7	51%	0.514	39%	0.389	S	S	.	.			trans	-105	101.6	178.1	-67.8	-79	0	0	0	110.8	S32 D36	S32-H34 VanDerWaalsContact C-N 3.31Å; S32-H34 WeakPolarHBondContact OG-CA 3.1Å; S32-H34 PolarHBondContact OG-N 3.13Å; S32-H34 PolarHBondContact OG-O 2.77Å; H34-D36 IonicContact ND1-OD2 3.81Å; H34-D36 PolarHBondContact O-N 3.35Å
35	K	61.6	Low	67.1	Low	170 Å²	170	65 Å²	65	74%	0.739	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	24.5	174.6	-69.7	-176.5	178.3	178.7	0	113	S110	K35-S110 PolarHBondContact O-OG 3.05Å
36	D	82.9	Confident	69.1	Low	52 Å²	52	61.5 Å²	61.5	28%	0.278	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-24.2	-167.3	-59.3	-24.1	0	0	0	111.9	H34 L109 S110	H34-D36 IonicContact ND1-OD2 3.81Å; H34-D36 PolarHBondContact O-N 3.35Å; D36-L109 HydrophobicContact CB-CD2 4.32Å; D36-L109 CarbonylContact O-C 3.57Å; D36-L109 WeakPolarHBondContact O-CA 3.26Å; D36-S110 WeakPolarHBondContact CA-OG 3.43Å; D36-S110 PolarHBondContact O-N 2.85Å; D36-S110 PolarHBondContact O-OG 3.13Å; D36-S110 VanDerWaalsContact O-OG 3.09Å
37	I	88.3	Confident	71	Confident	10 Å²	10	60 Å²	60	5%	0.051	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	125.1	179.9	-53.5	174.3	0	0	0	109.5	A107 L108 L109 L154 Y211 L212 M215	I37-A107 HydrophobicContact CG2-CB 4.4Å; I37-L108 WeakPolarHBondContact CA-O 3.24Å; I37-L109 HydrophobicContact CG1-CD2 3.96Å; I37-L154 HydrophobicContact CB-CB 4.36Å; I37-L154 HydrophobicContact CG2-CB 4.25Å; I37-L154 PolarHBondContact O-N 3.29Å; I37-Y211 HydrophobicContact CD1-CD1 3.63Å; I37-Y211 HydrophobicContact CD1-CE1 4.07Å; I37-Y211 HydrophobicContact CG2-CE1 4.37Å; I37-L212 HydrophobicContact CD1-CB 4.11Å; I37-L212 HydrophobicContact CD1-CD1 3.98Å; I37-L212 HydrophobicContact CG1-CD1 4.12Å; I37-M215 HydrophobicContact CD1-CE 4.36Å; I37-M215 HydrophobicContact CG1-CE 4.16Å
38	V	91.3	Very high	72.3	Confident	14 Å²	14	62.2 Å²	62.2	9%	0.085	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	140.1	171.6	-64.4	0	0	0	0	110	A107 L108 W122 P151 K152	V38-A107 WeakPolarHBondContact O-CA 3.38Å; V38-L108 HydrophobicContact CG2-CB 4.01Å; V38-L108 PolarHBondContact N-O 3.26Å; V38-L108 PolarHBondContact O-N 3.43Å; V38-W122 HydrophobicContact CG2-CH2 3.9Å; V38-W122 HydrophobicContact CG2-CZ2 4.06Å; V38-P151 HydrophobicContact CB-CB 4.04Å; V38-P151 HydrophobicContact CG2-CB 4.28Å; V38-K152 WeakPolarHBondContact CA-O 3.42Å
39	V	92.5	Very high	73.7	Confident	17 Å²	17	56.1 Å²	56.1	10%	0.103	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	129	178.5	-176.6	0	0	0	0	108.9	E105 L106 A107 P151 K152 L154	V39-E105 HydrophobicContact CG1-CB 4.04Å; V39-L106 WeakPolarHBondContact CA-O 3.36Å; V39-A107 HydrophobicContact CG2-CB 4.19Å; V39-P151 WeakPolarHBondContact O-CA 3.26Å; V39-K152 PolarHBondContact N-O 2.94Å; V39-K152 PolarHBondContact O-N 3.17Å; V39-L154 HydrophobicContact CG2-CB 4.42Å
40	T	93.2	Very high	74.8	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	148.6	169.4	178.7	0	0	0	0	109.4	L42 L106 L108 V148 S149	T40-L42 HydrophobicContact CG2-CD2 4.3Å; T40-L106 HydrophobicContact CG2-CB 3.92Å; T40-L106 HydrophobicContact CG2-CD2 4.15Å; T40-L106 HydrophobicContact CG2-CG 4.39Å; T40-L106 PolarHBondContact N-O 2.75Å; T40-L106 PolarHBondContact O-N 3.39Å; T40-L108 HydrophobicContact CG2-CD1 3.97Å; T40-V148 HydrophobicContact CG2-CG1 4.36Å; T40-V148 VanDerWaalsContact OG1-CG1 3.28Å; T40-V148 WeakPolarHBondContact OG1-CG1 3.43Å; T40-S149 PolarHBondContact OG1-O 3.06Å
41	T	94.5	Very high	75.7	Confident	33 Å²	33	54.8 Å²	54.8	20%	0.202	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	121.5	173.7	-54.3	0	0	0	0	108.9	N103 V104 S149	T41-N103 HydrophobicContact CG2-CB 3.74Å; T41-V104 CarbonylContact C-O 3.49Å; T41-V104 WeakPolarHBondContact CA-O 3.3Å; T41-S149 PolarHBondContact N-OG 3.45Å; T41-S149 PolarHBondContact O-N 3.42Å
42	L	94	Very high	76.6	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	126.4	170.1	-47.3	179.2	0	0	0	108.4	T40 V44 V72 V76 N103 V104 L106 L130 V148	T40-L42 HydrophobicContact CG2-CD2 4.3Å; L42-V44 HydrophobicContact CB-CG2 3.85Å; L42-V72 HydrophobicContact CD1-CG1 3.86Å; L42-V76 HydrophobicContact CD1-CG2 4.01Å; L42-N103 WeakPolarHBondContact O-CA 3.42Å; L42-V104 HydrophobicContact CB-CB 4.3Å; L42-V104 PolarHBondContact N-O 2.75Å; L42-V104 PolarHBondContact O-N 3.4Å; L42-L106 HydrophobicContact CD1-CB 4.19Å; L42-L106 HydrophobicContact CD1-CD2 4.22Å; L42-L106 HydrophobicContact CG-CB 4.23Å; L42-L130 HydrophobicContact CD2-CD1 4.16Å; L42-V148 HydrophobicContact CD2-CB 4.27Å; L42-V148 HydrophobicContact CD2-CG1 3.86Å; L42-V148 HydrophobicContact CD2-CG2 3.7Å
43	N	92.7	Very high	77.6	Confident	24 Å²	24	49.7 Å²	49.7	13%	0.128	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	110	166.9	-165.8	-83	0	0	0	108	T101 N103 I146 S147	N43-T101 PolarHBondContact ND2-OG1 3.08Å; N43-T101 WeakPolarHBondContact OD1-CB 3.38Å; N43-T101 WeakPolarHBondContact OD1-CG2 3.43Å; N43-T101 PolarHBondContact OD1-OG1 3.31Å; N43-N103 PolarHBondContact ND2-OD1 3.23Å; N43-I146 HydrophobicContact CB-CB 4.46Å; N43-I146 PolarHBondContact O-N 3.16Å; N43-S147 WeakPolarHBondContact CB-OG 3.38Å; N43-S147 PolarHBondContact N-O 2.95Å
44	V	91.4	Very high	78.2	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	127.6	-170.7	-176.9	0	0	0	0	109.1	L42 T46 T101 I102 V104 I142	L42-V44 HydrophobicContact CB-CG2 3.85Å; V44-T46 HydrophobicContact CG1-CG2 4.32Å; V44-T101 CarbonylContact O-C 3.58Å; V44-T101 VanDerWaalsContact O-CA 3.25Å; V44-T101 WeakPolarHBondContact O-CA 3.46Å; V44-I102 HydrophobicContact CB-CG1 4Å; V44-I102 PolarHBondContact N-O 3.15Å; V44-I102 PolarHBondContact O-N 3.1Å; V44-V104 HydrophobicContact CB-CG2 4.27Å; V44-V104 HydrophobicContact CG2-CB 4.34Å; V44-V104 HydrophobicContact CG2-CG2 3.73Å; V44-I142 HydrophobicContact CG1-CB 4.22Å; V44-I142 HydrophobicContact CG1-CD1 4.23Å; V44-I142 HydrophobicContact CG1-CG1 3.88Å; V44-I142 HydrophobicContact CG1-CG2 3.47Å; V44-I142 VanDerWaalsContact CG1-CG2 3.47Å
45	S	89.1	Confident	78.4	Confident	20 Å²	20	53.1 Å²	53.1	14%	0.14	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	135.5	172.8	-174.5	0	0	0	0	109.9	T143 D144	S45-T143 WeakPolarHBondContact CB-OG1 3.46Å; S45-T143 PolarHBondContact O-N 3.28Å; S45-T143 VanDerWaalsContact O-N 3.07Å; S45-T143 PolarHBondContact O-OG1 2.89Å; S45-T143 PolarHBondContact OG-OG1 3.14Å; S45-D144 PolarHBondContact N-O 3.11Å
46	T	84.9	Confident	78	Confident	12 Å²	12	48.5 Å²	48.5	7%	0.074	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	147.4	-174.5	64	0	0	0	0	112.9	V44 W49 E100 I102 W141	V44-T46 HydrophobicContact CG1-CG2 4.32Å; T46-W49 HydrophobicContact CG2-CE3 4.31Å; T46-E100 PolarHBondContact N-O 3.45Å; T46-E100 PolarHBondContact OG1-O 3.24Å; T46-I102 HydrophobicContact CG2-CD1 3.75Å; T46-I102 HydrophobicContact CG2-CG1 3.82Å; T46-I102 HydrophobicContact CG2-CG2 4.41Å; T46-W141 CarbonylContact C-O 3.58Å; T46-W141 WeakPolarHBondContact CA-O 3.28Å; T46-W141 HydrophobicContact CG2-CE3 3.62Å; T46-W141 HydrophobicContact CG2-CZ3 3.62Å
47	I	78.9	Confident	76.6	Confident	85 Å²	85	53.8 Å²	53.8	44%	0.436	27%	0.268	S	S	.	.	S	Bend	trans	-96	135	167.1	-64	161.8	0	0	0	108.1	W49 W141 T143	I47-W49 VanDerWaalsContact C-N 3.29Å; I47-W49 PolarHBondContact O-N 3.04Å; I47-W49 VanDerWaalsContact O-N 3.14Å; I47-W141 PolarHBondContact N-O 2.89Å; I47-T143 HydrophobicContact CD1-CG2 3.3Å; I47-T143 HydrophobicContact CG1-CG2 3.48Å; I47-T143 VanDerWaalsContact CG1-CG2 3.48Å
48	D	70.8	Confident	74.9	Confident	102 Å²	102	54.4 Å²	54.4	55%	0.545	27%	0.272	S	S	.	.	S	Bend	trans	55.4	32.2	168.2	-55.8	-29.3	0	0	0	116.2	D50 E51 I52	D48-D50 PolarHBondContact O-N 3.38Å; D48-E51 HydrophobicContact CB-CB 4.26Å; D48-E51 PolarHBondContact O-N 3.41Å; D48-I52 PolarHBondContact O-N 3.39Å
49	W	72.3	Confident	73	Confident	27 Å²	27	61.6 Å²	61.6	10%	0.102	31%	0.305	C	S	.	.	H	α-helix	trans	-51.3	-43.2	175.5	-177.1	-95.4	0	0	0	112.5	T46 I47 E51 I52 I53 L65 Y68 I92 I102 W141	T46-W49 HydrophobicContact CG2-CE3 4.31Å; I47-W49 VanDerWaalsContact C-N 3.29Å; I47-W49 PolarHBondContact O-N 3.04Å; I47-W49 VanDerWaalsContact O-N 3.14Å; W49-E51 PolarHBondContact O-N 2.63Å; W49-I52 PolarHBondContact O-N 2.81Å; W49-I53 HydrophobicContact CD2-CG1 4.23Å; W49-I53 HydrophobicContact CG-CG1 4.43Å; W49-I53 HydrophobicContact CZ2-CD1 4.1Å; W49-I53 HydrophobicContact CZ2-CG1 4Å; W49-I53 WeakPolarHBondContact O-CG1 3.49Å; W49-I53 PolarHBondContact O-N 2.94Å; W49-L65 HydrophobicContact CH2-CD2 4.14Å; W49-L65 HydrophobicContact CZ2-CD2 4Å; W49-Y68 HydrophobicContact CE3-CD1 4.03Å; W49-Y68 HydrophobicContact CE3-CD2 4.23Å; W49-Y68 AromaticContact CE3-CE1 3.67Å; W49-Y68 HydrophobicContact CE3-CE1 3.67Å; W49-Y68 AromaticContact CE3-CE2 3.91Å; W49-Y68 HydrophobicContact CE3-CE2 3.91Å; W49-Y68 HydrophobicContact CE3-CG 4.27Å; W49-Y68 AromaticContact CE3-CZ 3.57Å; W49-Y68 HydrophobicContact CH2-CD1 4.3Å; W49-Y68 AromaticContact CH2-CD2 3.57Å; W49-Y68 HydrophobicContact CH2-CD2 3.57Å; W49-Y68 AromaticContact CH2-CE2 3.95Å; W49-Y68 HydrophobicContact CH2-CE2 3.95Å; W49-Y68 AromaticContact CH2-CG 3.76Å; W49-Y68 HydrophobicContact CH2-CG 3.76Å; W49-Y68 HydrophobicContact CZ2-CD2 4.49Å; W49-Y68 AromaticContact CZ3-CD1 3.4Å; W49-Y68 HydrophobicContact CZ3-CD1 3.4Å; W49-Y68 AromaticContact CZ3-CD2 3.42Å; W49-Y68 HydrophobicContact CZ3-CD2 3.42Å; W49-Y68 VanDerWaalsContact CZ3-CD2 3.42Å; W49-Y68 AromaticContact CZ3-CE1 3.53Å; W49-Y68 HydrophobicContact CZ3-CE1 3.53Å; W49-Y68 AromaticContact CZ3-CE2 3.58Å; W49-Y68 HydrophobicContact CZ3-CE2 3.58Å; W49-Y68 AromaticContact CZ3-CG 3.32Å; W49-Y68 HydrophobicContact CZ3-CG 3.32Å; W49-Y68 AromaticContact CZ3-CZ 3.59Å; W49-I92 HydrophobicContact CH2-CD1 3.96Å; W49-I92 HydrophobicContact CH2-CG2 4.1Å; W49-I92 HydrophobicContact CZ2-CG2 4.26Å; W49-I92 HydrophobicContact CZ3-CD1 4.5Å; W49-I102 HydrophobicContact CD2-CG2 3.83Å; W49-I102 HydrophobicContact CE3-CD1 3.86Å; W49-I102 HydrophobicContact CE3-CG2 4.07Å; W49-I102 HydrophobicContact CG-CG2 4.21Å; W49-I102 HydrophobicContact CH2-CD1 3.81Å; W49-I102 HydrophobicContact CZ2-CG2 4.36Å; W49-I102 HydrophobicContact CZ3-CD1 3.39Å; W49-I102 HydrophobicContact CZ3-CG2 4.43Å; W49-W141 HydrophobicContact CZ3-CZ3 4.29Å
50	D	67.6	Low	71.2	Confident	57 Å²	57	66 Å²	66	31%	0.305	32%	0.324	S	S	.	.	H	α-helix	trans	-65.3	-39.6	-177.9	-68.2	-30.2	0	0	0	112.6	D48 I52 I53 E54 R97	D48-D50 PolarHBondContact O-N 3.38Å; D50-I52 PolarHBondContact O-N 3.25Å; D50-I53 PolarHBondContact O-N 3.2Å; D50-E54 WeakPolarHBondContact O-CB 3.31Å; D50-E54 WeakPolarHBondContact O-CG 3.38Å; D50-E54 PolarHBondContact O-N 3.09Å; D50-R97 IonicContact OD1-CZ 3.72Å; D50-R97 IonicContact OD1-NH1 2.64Å; D50-R97 PolarHBondContact OD1-NH1 2.89Å; D50-R97 IonicContact OD1-NH2 2.77Å; D50-R97 IonicContact OD2-CZ 2.58Å; D50-R97 IonicContact OD2-NH1 3.91Å; D50-R97 PolarHBondContact OD2-NH1 3.44Å; D50-R97 IonicContact OD2-NH2 2.79Å; D50-R97 PolarHBondContact OD2-NH2 3.29Å
51	E	62.2	Low	69.8	Low	96 Å²	96	67.6 Å²	67.6	45%	0.449	34%	0.335	S	S	.	.	H	α-helix	trans	-65	-29.7	-178.3	-167.7	177.1	180	0	0	111.8	D48 W49 K55	D48-E51 HydrophobicContact CB-CB 4.26Å; D48-E51 PolarHBondContact O-N 3.41Å; W49-E51 PolarHBondContact O-N 2.63Å; E51-K55 HydrophobicContact CG-CD 4.18Å; E51-K55 VanDerWaalsContact CG-CE 3.47Å; E51-K55 VanDerWaalsContact O-CB 3.3Å; E51-K55 WeakPolarHBondContact O-CB 2.88Å; E51-K55 VanDerWaalsContact O-CD 3.25Å; E51-K55 WeakPolarHBondContact O-CD 3.5Å; E51-K55 WeakPolarHBondContact O-CG 3.12Å; E51-K55 WeakPolarHBondContact OE1-CE 3.39Å; E51-K55 IonicContact OE1-NZ 2.73Å; E51-K55 PolarHBondContact OE1-NZ 3.37Å
52	I	60.4	Low	69.2	Low	65 Å²	65	66 Å²	66	33%	0.333	33%	0.326	S	S	.	.	H	α-helix	trans	-90.5	-35.1	-175.9	-64.1	166.8	0	0	0	111.3	D48 W49 D50 N56 Y68	D48-I52 PolarHBondContact O-N 3.39Å; W49-I52 PolarHBondContact O-N 2.81Å; D50-I52 PolarHBondContact O-N 3.25Å; I52-N56 PolarHBondContact O-ND2 3.16Å; I52-Y68 HydrophobicContact CB-CE2 4.33Å; I52-Y68 WeakPolarHBondContact CB-OH 3.33Å; I52-Y68 WeakPolarHBondContact CD1-OH 3.49Å; I52-Y68 HydrophobicContact CG2-CE2 3.65Å; I52-Y68 VanDerWaalsContact CG2-OH 3.24Å; I52-Y68 WeakPolarHBondContact CG2-OH 3.16Å
53	I	64.4	Low	68.6	Low	29 Å²	29	70.1 Å²	70.1	15%	0.149	35%	0.348	C	S	.	.	H	α-helix	trans	-73.8	-55.7	174	-65.8	-53.7	0	0	0	109	W49 D50 K55 N56 V58 P64 L65 Y68	W49-I53 HydrophobicContact CD2-CG1 4.23Å; W49-I53 HydrophobicContact CG-CG1 4.43Å; W49-I53 HydrophobicContact CZ2-CD1 4.1Å; W49-I53 HydrophobicContact CZ2-CG1 4Å; W49-I53 WeakPolarHBondContact O-CG1 3.49Å; W49-I53 PolarHBondContact O-N 2.94Å; D50-I53 PolarHBondContact O-N 3.2Å; I53-K55 VanDerWaalsContact C-N 3.27Å; I53-K55 PolarHBondContact O-N 3.14Å; I53-K55 VanDerWaalsContact O-N 3.13Å; I53-N56 PolarHBondContact O-N 3.31Å; I53-V58 HydrophobicContact CB-CG2 4.15Å; I53-V58 HydrophobicContact CD1-CG2 4.48Å; I53-V58 HydrophobicContact CG2-CB 4.3Å; I53-V58 HydrophobicContact CG2-CG1 4.36Å; I53-V58 HydrophobicContact CG2-CG2 3.45Å; I53-V58 VanDerWaalsContact CG2-CG2 3.45Å; I53-V58 WeakPolarHBondContact O-CG2 3.34Å; I53-P64 HydrophobicContact CD1-CB 4.02Å; I53-L65 HydrophobicContact CD1-CD2 4.28Å; I53-Y68 HydrophobicContact CD1-CD2 4.5Å; I53-Y68 HydrophobicContact CD1-CE2 4.04Å
54	E	56.7	Low	68	Low	156 Å²	156	69.5 Å²	69.5	73%	0.729	35%	0.345	S	S	*	.	H	α-helix	trans	-62.1	-28.2	-174.8	-66.3	-176.3	168.5	0	0	114.6	D50 N56	D50-E54 WeakPolarHBondContact O-CB 3.31Å; D50-E54 WeakPolarHBondContact O-CG 3.38Å; D50-E54 PolarHBondContact O-N 3.09Å; E54-N56 VanDerWaalsContact C-N 3.33Å
55	K	56.7	Low	67.7	Low	147 Å²	147	69.7 Å²	69.7	64%	0.639	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-22.8	177.1	-77.9	-178.4	-172.3	172.8	0	114.1	E51 I53	E51-K55 HydrophobicContact CG-CD 4.18Å; E51-K55 VanDerWaalsContact CG-CE 3.47Å; E51-K55 VanDerWaalsContact O-CB 3.3Å; E51-K55 WeakPolarHBondContact O-CB 2.88Å; E51-K55 VanDerWaalsContact O-CD 3.25Å; E51-K55 WeakPolarHBondContact O-CD 3.5Å; E51-K55 WeakPolarHBondContact O-CG 3.12Å; E51-K55 WeakPolarHBondContact OE1-CE 3.39Å; E51-K55 IonicContact OE1-NZ 2.73Å; E51-K55 PolarHBondContact OE1-NZ 3.37Å; I53-K55 VanDerWaalsContact C-N 3.27Å; I53-K55 PolarHBondContact O-N 3.14Å; I53-K55 VanDerWaalsContact O-N 3.13Å
56	N	54	Low	67.6	Low	73 Å²	73	71 Å²	71	39%	0.39	35%	0.351	S	S	.	.	S	Bend	trans	-98.5	128.6	175.1	-65.5	-54.1	0	0	0	105.7	I52 I53 E54 V58 P64	I52-N56 PolarHBondContact O-ND2 3.16Å; I53-N56 PolarHBondContact O-N 3.31Å; E54-N56 VanDerWaalsContact C-N 3.33Å; N56-V58 HydrophobicContact CB-CG2 4.38Å; N56-V58 WeakPolarHBondContact O-CG2 3.36Å; N56-V58 PolarHBondContact O-N 2.91Å; N56-P64 HydrophobicContact CB-CG 4.11Å
57	E	52.7	Low	67.6	Low	163 Å²	163	78.7 Å²	78.7	76%	0.762	38%	0.379	S	S	*	.			trans	-62.4	85.5	171.7	-69	178	166.1	0	0	108.7	E59 Q60	E57-E59 PolarHBondContact O-N 3.2Å; E57-Q60 PolarHBondContact O-N 3.07Å; E57-Q60 VanDerWaalsContact O-N 3.13Å
58	V	52.5	Low	67.9	Low	23 Å²	23	75.1 Å²	75.1	14%	0.139	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-20.8	-162.3	179.5	0	0	0	0	111.4	I53 N56 Q60 S61 E94 R228	I53-V58 HydrophobicContact CB-CG2 4.15Å; I53-V58 HydrophobicContact CD1-CG2 4.48Å; I53-V58 HydrophobicContact CG2-CB 4.3Å; I53-V58 HydrophobicContact CG2-CG1 4.36Å; I53-V58 HydrophobicContact CG2-CG2 3.45Å; I53-V58 VanDerWaalsContact CG2-CG2 3.45Å; I53-V58 WeakPolarHBondContact O-CG2 3.34Å; N56-V58 HydrophobicContact CB-CG2 4.38Å; N56-V58 WeakPolarHBondContact O-CG2 3.36Å; N56-V58 PolarHBondContact O-N 2.91Å; V58-Q60 PolarHBondContact O-N 2.85Å; V58-S61 PolarHBondContact O-N 3.42Å; V58-E94 WeakPolarHBondContact CG1-OE1 3.31Å; V58-R228 PolarHBondContact O-NH2 2.84Å
59	E	51.2	Low	68.8	Low	165 Å²	165	70.7 Å²	70.7	77%	0.771	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53	-32.2	175.4	-89.1	-171.2	139.7	0	0	112.7	E57 R228 W232	E57-E59 PolarHBondContact O-N 3.2Å; E59-R228 VanDerWaalsContact C-NH2 3.29Å; E59-R228 PolarHBondContact O-NH2 2.91Å; E59-W232 VanDerWaalsContact O-CZ2 3.23Å; E59-W232 WeakPolarHBondContact O-CZ2 3.14Å; E59-W232 PolarHBondContact O-NE1 2.9Å
60	Q	55.5	Low	69.6	Low	108 Å²	108	75.7 Å²	75.7	51%	0.505	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.7	-20.8	-175.7	-60.4	-170	23.1	0	0	115.5	E57 V58 W232	E57-Q60 PolarHBondContact O-N 3.07Å; E57-Q60 VanDerWaalsContact O-N 3.13Å; V58-Q60 PolarHBondContact O-N 2.85Å; Q60-W232 HydrophobicContact CB-CZ2 4.45Å; Q60-W232 HydrophobicContact CG-CH2 3.83Å; Q60-W232 HydrophobicContact CG-CZ2 3.94Å; Q60-W232 HydrophobicContact CG-CZ3 4.35Å
61	S	63	Low	70.7	Confident	35 Å²	35	75 Å²	75	25%	0.245	36%	0.356	C	S	.	.			trans	-122	113	-171.4	-160.5	0	0	0	0	112.9	V58 N63 P64	V58-S61 PolarHBondContact O-N 3.42Å; S61-N63 PolarHBondContact O-N 3.04Å; S61-N63 WeakPolarHBondContact OG-CB 3.24Å; S61-N63 PolarHBondContact OG-N 3.5Å; S61-N63 PolarHBondContact OG-ND2 3.48Å; S61-P64 WeakPolarHBondContact O-CD 3.39Å
62	L	82.7	Confident	72.1	Confident	0 Å²	0	70.5 Å²	70.5	0%	0	34%	0.335	C	S	.	.			trans	-76.8	-7.6	167.8	-69.8	166.4	0	0	0	112.4	P64 L65 D66 Y186 N225 R228 R229	L62-P64 VanDerWaalsContact C-CD 3.48Å; L62-L65 HydrophobicContact CD2-CD1 3.95Å; L62-L65 WeakPolarHBondContact O-CB 3.12Å; L62-L65 PolarHBondContact O-N 3.03Å; L62-D66 PolarHBondContact O-N 2.96Å; L62-Y186 HydrophobicContact CB-CE1 4.47Å; L62-Y186 HydrophobicContact CD1-CE1 4.46Å; L62-N225 HydrophobicContact CD2-CB 4.16Å; L62-R228 HydrophobicContact CD1-CB 3.88Å; L62-R228 HydrophobicContact CD2-CB 4.48Å; L62-R228 VanDerWaalsContact CD2-NH1 3.32Å; L62-R228 HydrophobicContact CG-CB 4.46Å; L62-R229 HydrophobicContact CD1-CB 4.27Å; L62-R229 HydrophobicContact CD1-CG 3.22Å
63	N	80.5	Confident	73.6	Confident	86 Å²	86	68.2 Å²	68.2	46%	0.46	32%	0.323	S	S	.	.	H	α-helix	trans	-58.5	-38	-176.2	-62.8	-13.6	0	0	0	113.8	S61 R67	S61-N63 PolarHBondContact O-N 3.04Å; S61-N63 WeakPolarHBondContact OG-CB 3.24Å; S61-N63 PolarHBondContact OG-N 3.5Å; S61-N63 PolarHBondContact OG-ND2 3.48Å; N63-R67 WeakPolarHBondContact O-CB 3.16Å; N63-R67 PolarHBondContact O-N 3.17Å
64	P	80.7	Confident	74.9	Confident	11 Å²	11	70.6 Å²	70.6	7%	0.071	34%	0.336	C	S	.	.	H	α-helix	trans	-60.7	-47.8	172.7	-23.4	35.8	0	0	0	111.5	I53 N56 S61 L62 D66 R67 Y68	I53-P64 HydrophobicContact CD1-CB 4.02Å; N56-P64 HydrophobicContact CB-CG 4.11Å; S61-P64 WeakPolarHBondContact O-CD 3.39Å; L62-P64 VanDerWaalsContact C-CD 3.48Å; P64-D66 VanDerWaalsContact C-N 3.34Å; P64-D66 PolarHBondContact O-N 2.91Å; P64-R67 WeakPolarHBondContact O-CB 3.4Å; P64-R67 PolarHBondContact O-N 3.38Å; P64-R67 VanDerWaalsContact O-N 3.16Å; P64-Y68 WeakPolarHBondContact O-CD2 3.46Å; P64-Y68 PolarHBondContact O-N 2.83Å
65	L	85	Confident	76.6	Confident	3 Å²	3	64.1 Å²	64.1	2%	0.016	31%	0.308	C	S	.	.	H	α-helix	trans	-60.8	-42.3	178.6	-59.4	-179.3	0	0	0	111.7	W49 I53 L62 R67 Y68 C69 I92 E94	W49-L65 HydrophobicContact CH2-CD2 4.14Å; W49-L65 HydrophobicContact CZ2-CD2 4Å; I53-L65 HydrophobicContact CD1-CD2 4.28Å; L62-L65 HydrophobicContact CD2-CD1 3.95Å; L62-L65 WeakPolarHBondContact O-CB 3.12Å; L62-L65 PolarHBondContact O-N 3.03Å; L65-R67 VanDerWaalsContact C-N 3.33Å; L65-R67 PolarHBondContact O-N 2.95Å; L65-Y68 PolarHBondContact O-N 3.37Å; L65-C69 WeakPolarHBondContact O-CB 3.13Å; L65-C69 PolarHBondContact O-N 3.34Å; L65-I92 HydrophobicContact CD2-CB 4.35Å; L65-I92 HydrophobicContact CD2-CG2 4.39Å; L65-E94 HydrophobicContact CD1-CG 4.24Å
66	D	86.5	Confident	78.3	Confident	48 Å²	48	57.1 Å²	57.1	26%	0.257	28%	0.277	S	S	.	.	H	α-helix	trans	-61.5	-41.3	176.1	-69.6	-23.7	0	0	0	111.8	L62 P64 K70 R229	L62-D66 PolarHBondContact O-N 2.96Å; P64-D66 VanDerWaalsContact C-N 3.34Å; P64-D66 PolarHBondContact O-N 2.91Å; D66-K70 WeakPolarHBondContact O-CB 3.34Å; D66-K70 PolarHBondContact O-N 3.21Å; D66-R229 IonicContact OD1-CZ 3.09Å; D66-R229 IonicContact OD1-NH2 2.63Å; D66-R229 PolarHBondContact OD1-NH2 3.35Å; D66-R229 IonicContact OD2-NH2 3.64Å
67	R	84.6	Confident	80.2	Confident	174 Å²	174	57.5 Å²	57.5	66%	0.657	27%	0.273	S	S	*	.	H	α-helix	trans	-66.2	-43.2	176.6	-173.4	-174.5	-60.7	179.2	1.3	111.6	N63 P64 L65 K70 N71	N63-R67 WeakPolarHBondContact O-CB 3.16Å; N63-R67 PolarHBondContact O-N 3.17Å; P64-R67 WeakPolarHBondContact O-CB 3.4Å; P64-R67 PolarHBondContact O-N 3.38Å; P64-R67 VanDerWaalsContact O-N 3.16Å; L65-R67 VanDerWaalsContact C-N 3.33Å; L65-R67 PolarHBondContact O-N 2.95Å; R67-K70 PolarHBondContact O-N 3.18Å; R67-N71 PolarHBondContact O-N 3.45Å; R67-N71 PolarHBondContact O-ND2 3.38Å
68	Y	85.9	Confident	82.1	Confident	9 Å²	9	52.5 Å²	52.5	4%	0.035	27%	0.265	C	S	.	.	H	α-helix	trans	-61.4	-51.2	175.7	-82.1	-64.8	0	0	0	111	W49 I52 I53 P64 L65 K70 N71 V72 W141	W49-Y68 HydrophobicContact CE3-CD1 4.03Å; W49-Y68 HydrophobicContact CE3-CD2 4.23Å; W49-Y68 AromaticContact CE3-CE1 3.67Å; W49-Y68 HydrophobicContact CE3-CE1 3.67Å; W49-Y68 AromaticContact CE3-CE2 3.91Å; W49-Y68 HydrophobicContact CE3-CE2 3.91Å; W49-Y68 HydrophobicContact CE3-CG 4.27Å; W49-Y68 AromaticContact CE3-CZ 3.57Å; W49-Y68 HydrophobicContact CH2-CD1 4.3Å; W49-Y68 AromaticContact CH2-CD2 3.57Å; W49-Y68 HydrophobicContact CH2-CD2 3.57Å; W49-Y68 AromaticContact CH2-CE2 3.95Å; W49-Y68 HydrophobicContact CH2-CE2 3.95Å; W49-Y68 AromaticContact CH2-CG 3.76Å; W49-Y68 HydrophobicContact CH2-CG 3.76Å; W49-Y68 HydrophobicContact CZ2-CD2 4.49Å; W49-Y68 AromaticContact CZ3-CD1 3.4Å; W49-Y68 HydrophobicContact CZ3-CD1 3.4Å; W49-Y68 AromaticContact CZ3-CD2 3.42Å; W49-Y68 HydrophobicContact CZ3-CD2 3.42Å; W49-Y68 VanDerWaalsContact CZ3-CD2 3.42Å; W49-Y68 AromaticContact CZ3-CE1 3.53Å; W49-Y68 HydrophobicContact CZ3-CE1 3.53Å; W49-Y68 AromaticContact CZ3-CE2 3.58Å; W49-Y68 HydrophobicContact CZ3-CE2 3.58Å; W49-Y68 AromaticContact CZ3-CG 3.32Å; W49-Y68 HydrophobicContact CZ3-CG 3.32Å; W49-Y68 AromaticContact CZ3-CZ 3.59Å; I52-Y68 HydrophobicContact CB-CE2 4.33Å; I52-Y68 WeakPolarHBondContact CB-OH 3.33Å; I52-Y68 WeakPolarHBondContact CD1-OH 3.49Å; I52-Y68 HydrophobicContact CG2-CE2 3.65Å; I52-Y68 VanDerWaalsContact CG2-OH 3.24Å; I52-Y68 WeakPolarHBondContact CG2-OH 3.16Å; I53-Y68 HydrophobicContact CD1-CD2 4.5Å; I53-Y68 HydrophobicContact CD1-CE2 4.04Å; P64-Y68 WeakPolarHBondContact O-CD2 3.46Å; P64-Y68 PolarHBondContact O-N 2.83Å; L65-Y68 PolarHBondContact O-N 3.37Å; Y68-K70 VanDerWaalsContact C-N 3.29Å; Y68-K70 PolarHBondContact O-N 3.07Å; Y68-N71 WeakPolarHBondContact O-CB 3.2Å; Y68-N71 PolarHBondContact O-N 3.46Å; Y68-V72 WeakPolarHBondContact O-CG2 3.39Å; Y68-V72 PolarHBondContact O-N 2.91Å; Y68-W141 AromaticContact CD1-CD2 3.38Å; Y68-W141 HydrophobicContact CD1-CD2 3.38Å; Y68-W141 AromaticContact CD1-CE2 3.5Å; Y68-W141 VanDerWaalsContact CD1-CE2 3.5Å; Y68-W141 AromaticContact CD1-CE3 3.42Å; Y68-W141 HydrophobicContact CD1-CE3 3.42Å; Y68-W141 VanDerWaalsContact CD1-CE3 3.42Å; Y68-W141 HydrophobicContact CD1-CG 4.05Å; Y68-W141 AromaticContact CD1-CH2 3.59Å; Y68-W141 HydrophobicContact CD1-CH2 3.59Å; Y68-W141 AromaticContact CD1-CZ2 3.66Å; Y68-W141 HydrophobicContact CD1-CZ2 3.66Å; Y68-W141 AromaticContact CD1-CZ3 3.5Å; Y68-W141 HydrophobicContact CD1-CZ3 3.5Å; Y68-W141 HydrophobicContact CE1-CB 4.21Å; Y68-W141 AromaticContact CE1-CD2 3.42Å; Y68-W141 HydrophobicContact CE1-CD2 3.42Å; Y68-W141 VanDerWaalsContact CE1-CD2 3.42Å; Y68-W141 AromaticContact CE1-CE3 3.48Å; Y68-W141 HydrophobicContact CE1-CE3 3.48Å; Y68-W141 VanDerWaalsContact CE1-CE3 3.48Å; Y68-W141 AromaticContact CE1-CG 3.71Å; Y68-W141 HydrophobicContact CE1-CG 3.71Å; Y68-W141 HydrophobicContact CE1-CH2 4.47Å; Y68-W141 HydrophobicContact CE1-CZ3 4Å; Y68-W141 HydrophobicContact CG-CH2 4.34Å; Y68-W141 HydrophobicContact CG-CZ2 4.49Å; Y68-W141 HydrophobicContact CG-CZ3 4.46Å; Y68-W141 WeakPolarHBondContact O-CH2 3.26Å; Y68-W141 WeakPolarHBondContact O-CZ2 3.4Å
69	C	90.1	Very high	84	Confident	10 Å²	10	52.9 Å²	52.9	7%	0.068	27%	0.266	C	S	.	.	H	α-helix	trans	-56.1	-44.3	177.3	177.8	0	0	0	0	112.3	L65 N71 V72 L73 C90	L65-C69 WeakPolarHBondContact O-CB 3.13Å; L65-C69 PolarHBondContact O-N 3.34Å; C69-N71 VanDerWaalsContact C-N 3.32Å; C69-N71 PolarHBondContact O-N 3.41Å; C69-V72 WeakPolarHBondContact O-CB 3.35Å; C69-V72 PolarHBondContact O-N 3.07Å; C69-V72 VanDerWaalsContact O-N 3.14Å; C69-L73 WeakPolarHBondContact O-CG 3.47Å; C69-L73 PolarHBondContact O-N 3.32Å; C69-C90 WeakPolarHBondContact CA-SG 3.45Å; C69-C90 HydrophobicContact CB-CB 4.44Å; C69-C90 WeakPolarHBondContact CB-SG 3.4Å; C69-C90 WeakPolarHBondContact SG-CA 3.47Å; C69-C90 WeakPolarHBondContact SG-CB 3.44Å; C69-C90 PolarHBondContact SG-O 3.29Å; C69-C90 CovalentContact SG-SG 2.03Å; C69-C90 PolarHBondContact SG-SG 2.9Å
70	K	89.8	Confident	86	Confident	132 Å²	132	45.8 Å²	45.8	57%	0.574	23%	0.233	S	C	*	.	H	α-helix	trans	-56.3	-46.7	174.6	179.2	174.4	179.7	173	0	112.1	D66 R67 Y68 V72 L73 D74	D66-K70 WeakPolarHBondContact O-CB 3.34Å; D66-K70 PolarHBondContact O-N 3.21Å; R67-K70 PolarHBondContact O-N 3.18Å; Y68-K70 VanDerWaalsContact C-N 3.29Å; Y68-K70 PolarHBondContact O-N 3.07Å; K70-V72 VanDerWaalsContact C-N 3.33Å; K70-V72 PolarHBondContact O-N 3.47Å; K70-L73 WeakPolarHBondContact O-CB 3.34Å; K70-L73 PolarHBondContact O-N 3.03Å; K70-D74 PolarHBondContact O-N 2.97Å
71	N	88.9	Confident	87.8	Confident	43 Å²	43	44.7 Å²	44.7	23%	0.23	24%	0.235	C	C	.	.	H	α-helix	trans	-65.5	-33.8	178.5	-73.6	-14.9	0	0	0	112.1	R67 Y68 C69 D74 V75 W141	R67-N71 PolarHBondContact O-N 3.45Å; R67-N71 PolarHBondContact O-ND2 3.38Å; Y68-N71 WeakPolarHBondContact O-CB 3.2Å; Y68-N71 PolarHBondContact O-N 3.46Å; C69-N71 VanDerWaalsContact C-N 3.32Å; C69-N71 PolarHBondContact O-N 3.41Å; N71-D74 PolarHBondContact O-N 3.03Å; N71-V75 WeakPolarHBondContact O-CG2 3.49Å; N71-V75 PolarHBondContact O-N 3.27Å; N71-W141 VanDerWaalsContact CB-CE2 3.45Å; N71-W141 HydrophobicContact CB-CZ2 3.3Å; N71-W141 PolarHBondContact ND2-NE1 3.11Å
72	V	91.4	Very high	89.1	Confident	1 Å²	1	48.5 Å²	48.5	1%	0.006	25%	0.248	C	C	.	.	H	α-helix	trans	-61.7	-47.2	170.4	-177.4	0	0	0	0	110.5	L42 Y68 C69 K70 D74 V75 V76 V104 W141 I142	L42-V72 HydrophobicContact CD1-CG1 3.86Å; Y68-V72 WeakPolarHBondContact O-CG2 3.39Å; Y68-V72 PolarHBondContact O-N 2.91Å; C69-V72 WeakPolarHBondContact O-CB 3.35Å; C69-V72 PolarHBondContact O-N 3.07Å; C69-V72 VanDerWaalsContact O-N 3.14Å; K70-V72 VanDerWaalsContact C-N 3.33Å; K70-V72 PolarHBondContact O-N 3.47Å; V72-D74 VanDerWaalsContact C-N 3.25Å; V72-D74 PolarHBondContact O-N 3.08Å; V72-V75 PolarHBondContact O-N 2.91Å; V72-V76 HydrophobicContact CG1-CG2 4.11Å; V72-V76 WeakPolarHBondContact O-CB 3.2Å; V72-V76 WeakPolarHBondContact O-CG2 3.26Å; V72-V76 PolarHBondContact O-N 3.4Å; V72-V104 HydrophobicContact CG1-CG1 4.2Å; V72-V104 HydrophobicContact CG2-CG1 4.19Å; V72-V104 HydrophobicContact CG2-CG2 4.08Å; V72-W141 HydrophobicContact CG2-CH2 3.43Å; V72-W141 VanDerWaalsContact CG2-CH2 3.43Å; V72-W141 HydrophobicContact CG2-CZ2 3.98Å; V72-I142 HydrophobicContact CB-CD1 4.29Å; V72-I142 HydrophobicContact CG2-CD1 3.91Å
73	L	92.8	Very high	89.6	Confident	17 Å²	17	48.5 Å²	48.5	9%	0.089	25%	0.248	C	C	.	.	H	α-helix	trans	-60.8	-37.1	179.2	-68.4	176.5	0	0	0	111.7	C69 K70 R77 L88 C90 L106	C69-L73 WeakPolarHBondContact O-CG 3.47Å; C69-L73 PolarHBondContact O-N 3.32Å; K70-L73 WeakPolarHBondContact O-CB 3.34Å; K70-L73 PolarHBondContact O-N 3.03Å; L73-R77 WeakPolarHBondContact O-CB 3.42Å; L73-R77 VanDerWaalsContact O-CG 3.26Å; L73-R77 WeakPolarHBondContact O-CG 3.34Å; L73-R77 PolarHBondContact O-N 2.87Å; L73-L88 HydrophobicContact CD2-CB 3.75Å; L73-L88 HydrophobicContact CD2-CD1 4.2Å; L73-C90 HydrophobicContact CD2-CB 4.11Å; L73-C90 HydrophobicContact CG-CB 4.3Å; L73-L106 HydrophobicContact CD2-CD1 3.53Å
74	D	91.7	Very high	90.1	Very high	78 Å²	78	49 Å²	49	42%	0.417	26%	0.257	S	S	.	.	H	α-helix	trans	-67.1	-41.4	175.8	-67.8	-19	0	0	0	111.5	K70 N71 V72 R77 G78	K70-D74 PolarHBondContact O-N 2.97Å; N71-D74 PolarHBondContact O-N 3.03Å; V72-D74 VanDerWaalsContact C-N 3.25Å; V72-D74 PolarHBondContact O-N 3.08Å; D74-R77 PolarHBondContact O-N 3.09Å; D74-G78 PolarHBondContact O-N 3.49Å
75	V	92.1	Very high	90.5	Very high	21 Å²	21	52.8 Å²	52.8	13%	0.127	29%	0.285	C	S	.	.	H	α-helix	trans	-63.6	-47.6	173	170.4	0	0	0	0	111.5	N71 V72 R77 G78 L79 V135 I142 I145	N71-V75 WeakPolarHBondContact O-CG2 3.49Å; N71-V75 PolarHBondContact O-N 3.27Å; V72-V75 PolarHBondContact O-N 2.91Å; V75-R77 VanDerWaalsContact C-N 3.31Å; V75-R77 PolarHBondContact O-N 3.07Å; V75-G78 WeakPolarHBondContact O-CA 3.46Å; V75-G78 PolarHBondContact O-N 3.2Å; V75-G78 VanDerWaalsContact O-N 3.07Å; V75-L79 HydrophobicContact CG1-CD1 4.03Å; V75-L79 HydrophobicContact CG1-CG 4.3Å; V75-L79 WeakPolarHBondContact O-CG 3.27Å; V75-L79 PolarHBondContact O-N 2.94Å; V75-V135 HydrophobicContact CG1-CB 4.49Å; V75-V135 HydrophobicContact CG1-CG1 3.96Å; V75-V135 HydrophobicContact CG1-CG2 3.92Å; V75-V135 HydrophobicContact CG2-CG1 4.06Å; V75-I142 HydrophobicContact CB-CD1 4.2Å; V75-I142 HydrophobicContact CG2-CD1 3.82Å; V75-I145 HydrophobicContact CG1-CD1 4.31Å
76	V	93.6	Very high	90.8	Very high	0 Å²	0	53 Å²	53	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-57.6	-43.7	178.2	165.5	0	0	0	0	111.2	L42 V72 L79 E80 L83 L88 L106 L130 I145	L42-V76 HydrophobicContact CD1-CG2 4.01Å; V72-V76 HydrophobicContact CG1-CG2 4.11Å; V72-V76 WeakPolarHBondContact O-CB 3.2Å; V72-V76 WeakPolarHBondContact O-CG2 3.26Å; V72-V76 PolarHBondContact O-N 3.4Å; V76-L79 PolarHBondContact O-N 2.88Å; V76-E80 PolarHBondContact O-N 3.33Å; V76-L83 HydrophobicContact CG1-CD1 3.57Å; V76-L88 HydrophobicContact CG1-CD1 4.23Å; V76-L106 HydrophobicContact CG1-CD2 4.49Å; V76-L130 HydrophobicContact CB-CD2 4.39Å; V76-L130 HydrophobicContact CG1-CD2 4.2Å; V76-L130 HydrophobicContact CG2-CD2 4.15Å; V76-I145 HydrophobicContact CG2-CD1 4.31Å
77	R	93.5	Very high	91.1	Very high	81 Å²	81	52.4 Å²	52.4	31%	0.306	29%	0.285	S	S	.	.	H	α-helix	trans	-70.6	-30.3	176.1	-72.5	174.1	-179.7	130.3	1.3	113.2	L73 D74 V75 E80 P81 L83 L88	L73-R77 WeakPolarHBondContact O-CB 3.42Å; L73-R77 VanDerWaalsContact O-CG 3.26Å; L73-R77 WeakPolarHBondContact O-CG 3.34Å; L73-R77 PolarHBondContact O-N 2.87Å; D74-R77 PolarHBondContact O-N 3.09Å; V75-R77 VanDerWaalsContact C-N 3.31Å; V75-R77 PolarHBondContact O-N 3.07Å; R77-E80 CarbonylContact O-C 3.31Å; R77-E80 VanDerWaalsContact O-C 3.31Å; R77-P81 WeakPolarHBondContact O-CA 3.24Å; R77-L83 HydrophobicContact CG-CB 4.41Å; R77-L88 HydrophobicContact CG-CD1 4.28Å
78	G	91.8	Very high	91.6	Very high	58 Å²	58	44.7 Å²	44.7	60%	0.598	26%	0.256	S	S	*	.	H	α-helix	trans	-68.5	-40.3	173.3	0	0	0	0	0	112.5	D74 V75	D74-G78 PolarHBondContact O-N 3.49Å; V75-G78 WeakPolarHBondContact O-CA 3.46Å; V75-G78 PolarHBondContact O-N 3.2Å; V75-G78 VanDerWaalsContact O-N 3.07Å
79	L	92.7	Very high	91.9	Very high	31 Å²	31	44.2 Å²	44.2	16%	0.162	26%	0.255	C	S	.	.	H	α-helix	trans	-73	-40.2	177.5	-67.6	179.7	0	0	0	112.2	V75 V76 T129 L130 I145	V75-L79 HydrophobicContact CG1-CD1 4.03Å; V75-L79 HydrophobicContact CG1-CG 4.3Å; V75-L79 WeakPolarHBondContact O-CG 3.27Å; V75-L79 PolarHBondContact O-N 2.94Å; V76-L79 PolarHBondContact O-N 2.88Å; L79-T129 HydrophobicContact CB-CG2 4.46Å; L79-T129 WeakPolarHBondContact O-CG2 3.4Å; L79-L130 HydrophobicContact CB-CD2 4.18Å; L79-L130 HydrophobicContact CD1-CD2 4.08Å; L79-I145 HydrophobicContact CD1-CD1 3.9Å
80	E	93.5	Very high	92.1	Very high	16 Å²	16	44 Å²	44	8%	0.075	25%	0.253	C	S	.	.			trans	-124.4	88.9	176	-176.7	53.6	-99.7	0	0	111.2	V76 R77 K82 L83 F117 L126 T129	V76-E80 PolarHBondContact O-N 3.33Å; R77-E80 CarbonylContact O-C 3.31Å; R77-E80 VanDerWaalsContact O-C 3.31Å; E80-K82 HydrophobicContact CG-CB 4.29Å; E80-K82 PolarHBondContact O-N 3.07Å; E80-K82 VanDerWaalsContact O-N 3.08Å; E80-K82 VanDerWaalsContact OE1-CB 3.24Å; E80-K82 WeakPolarHBondContact OE1-CB 3.25Å; E80-K82 VanDerWaalsContact OE1-CD 3.31Å; E80-K82 WeakPolarHBondContact OE1-CD 3.3Å; E80-K82 WeakPolarHBondContact OE1-CG 3.11Å; E80-K82 PolarHBondContact OE1-N 3.06Å; E80-L83 HydrophobicContact CB-CD1 4.06Å; E80-L83 HydrophobicContact CB-CG 4.16Å; E80-L83 HydrophobicContact CG-CD1 4.18Å; E80-L83 HydrophobicContact CG-CG 3.84Å; E80-L83 WeakPolarHBondContact O-CB 3.49Å; E80-L83 PolarHBondContact O-N 2.9Å; E80-F117 HydrophobicContact CG-CE1 4.43Å; E80-F117 HydrophobicContact CG-CZ 3.89Å; E80-L126 HydrophobicContact CB-CD1 4.36Å; E80-L126 HydrophobicContact CG-CD1 4.34Å; E80-T129 HydrophobicContact CB-CG2 3.99Å; E80-T129 PolarHBondContact OE2-OG1 2.89Å
81	P	92.6	Very high	92.2	Very high	85 Å²	85	37.8 Å²	37.8	55%	0.552	23%	0.226	S	C	*	.	G	3₁₀ helix	trans	-59.1	-22.9	-178.6	-27.4	36	0	0	0	114.4	R77 L83 S84	R77-P81 WeakPolarHBondContact O-CA 3.24Å; P81-L83 PolarHBondContact O-N 2.59Å; P81-L83 VanDerWaalsContact O-N 3.14Å; P81-S84 WeakPolarHBondContact O-CB 3.02Å; P81-S84 PolarHBondContact O-N 3.23Å; P81-S84 VanDerWaalsContact O-N 3.09Å; P81-S84 PolarHBondContact O-OG 3.49Å
82	K	91.6	Very high	92.1	Very high	115 Å²	115	35.9 Å²	35.9	50%	0.5	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	-61.1	-21	175.8	-65.4	174.5	-170.6	168.6	0	113	E80 S84 I116	E80-K82 HydrophobicContact CG-CB 4.29Å; E80-K82 PolarHBondContact O-N 3.07Å; E80-K82 VanDerWaalsContact O-N 3.08Å; E80-K82 VanDerWaalsContact OE1-CB 3.24Å; E80-K82 WeakPolarHBondContact OE1-CB 3.25Å; E80-K82 VanDerWaalsContact OE1-CD 3.31Å; E80-K82 WeakPolarHBondContact OE1-CD 3.3Å; E80-K82 WeakPolarHBondContact OE1-CG 3.11Å; E80-K82 PolarHBondContact OE1-N 3.06Å; K82-S84 PolarHBondContact O-N 3.33Å; K82-I116 HydrophobicContact CB-CG2 3.67Å
83	L	93.1	Very high	91.5	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-79.3	-0.3	177.5	-60.4	-179.9	0	0	0	114	V76 R77 E80 P81 S85 A86 L88 M113 F117 L126	V76-L83 HydrophobicContact CG1-CD1 3.57Å; R77-L83 HydrophobicContact CG-CB 4.41Å; E80-L83 HydrophobicContact CB-CD1 4.06Å; E80-L83 HydrophobicContact CB-CG 4.16Å; E80-L83 HydrophobicContact CG-CD1 4.18Å; E80-L83 HydrophobicContact CG-CG 3.84Å; E80-L83 WeakPolarHBondContact O-CB 3.49Å; E80-L83 PolarHBondContact O-N 2.9Å; P81-L83 PolarHBondContact O-N 2.59Å; P81-L83 VanDerWaalsContact O-N 3.14Å; L83-S85 PolarHBondContact O-N 3.17Å; L83-A86 HydrophobicContact CB-CB 4.35Å; L83-A86 HydrophobicContact CD2-CB 4.05Å; L83-A86 PolarHBondContact O-N 3.21Å; L83-A86 VanDerWaalsContact O-N 3.07Å; L83-L88 HydrophobicContact CB-CD1 4.14Å; L83-L88 HydrophobicContact CD1-CD1 4.24Å; L83-M113 HydrophobicContact CD2-CE 3.7Å; L83-M113 HydrophobicContact CD2-SD 3.59Å; L83-M113 VanDerWaalsContact CD2-SD 3.59Å; L83-F117 HydrophobicContact CD2-CE2 3.93Å; L83-F117 HydrophobicContact CD2-CZ 4.29Å; L83-L126 HydrophobicContact CD1-CD1 3.77Å
84	S	90.6	Very high	90.3	Very high	95 Å²	95	40 Å²	40	66%	0.664	24%	0.237	S	C	*	.	G	3₁₀ helix	trans	-60.2	-28.5	178.3	66.4	0	0	0	0	113.1	P81 K82	P81-S84 WeakPolarHBondContact O-CB 3.02Å; P81-S84 PolarHBondContact O-N 3.23Å; P81-S84 VanDerWaalsContact O-N 3.09Å; P81-S84 PolarHBondContact O-OG 3.49Å; K82-S84 PolarHBondContact O-N 3.33Å
85	S	88.4	Confident	88.9	Confident	92 Å²	92	42.1 Å²	42.1	64%	0.643	25%	0.252	S	S	*	.	G	3₁₀ helix	trans	-98	-3.6	176.8	58.9	0	0	0	0	114	L83	L83-S85 PolarHBondContact O-N 3.17Å
86	A	91.6	Very high	87.3	Confident	8 Å²	8	44.3 Å²	44.3	7%	0.066	26%	0.262	C	S	.	.	S	Bend	trans	-83.7	143.1	-177.2	0	0	0	0	0	111.4	L83 L88 M113 I116	L83-A86 HydrophobicContact CB-CB 4.35Å; L83-A86 HydrophobicContact CD2-CB 4.05Å; L83-A86 PolarHBondContact O-N 3.21Å; L83-A86 VanDerWaalsContact O-N 3.07Å; A86-L88 HydrophobicContact CB-CD2 4.17Å; A86-L88 HydrophobicContact CB-CG 4.31Å; A86-L88 PolarHBondContact O-N 3Å; A86-M113 HydrophobicContact CB-SD 4.44Å; A86-I116 HydrophobicContact CB-CD1 3.66Å
87	T	93.5	Very high	85.9	Confident	34 Å²	34	49.7 Å²	49.7	21%	0.209	28%	0.282	C	S	.	.			trans	-73	106.1	167.3	-54.9	0	0	0	0	108.7	L109 E112 M215 K216	T87-L109 HydrophobicContact CG2-CD1 4.24Å; T87-E112 VanDerWaalsContact CB-OE2 3.26Å; T87-E112 WeakPolarHBondContact CB-OE2 3.45Å; T87-E112 PolarHBondContact N-OE2 3.14Å; T87-E112 PolarHBondContact OG1-OE1 2.86Å; T87-E112 VanDerWaalsContact OG1-OE1 3.08Å; T87-E112 PolarHBondContact OG1-OE2 3.39Å; T87-E112 VanDerWaalsContact OG1-OE2 3.1Å; T87-M215 HydrophobicContact CG2-CE 4.14Å; T87-M215 HydrophobicContact CG2-SD 3.73Å; T87-K216 HydrophobicContact CG2-CB 4.4Å; T87-K216 HydrophobicContact CG2-CG 4.07Å
88	L	93.6	Very high	84.3	Confident	12 Å²	12	50 Å²	50	6%	0.063	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	141.2	175.4	-56.3	-176.2	0	0	0	109.9	L73 V76 R77 L83 A86 L106 L108	L73-L88 HydrophobicContact CD2-CB 3.75Å; L73-L88 HydrophobicContact CD2-CD1 4.2Å; V76-L88 HydrophobicContact CG1-CD1 4.23Å; R77-L88 HydrophobicContact CG-CD1 4.28Å; L83-L88 HydrophobicContact CB-CD1 4.14Å; L83-L88 HydrophobicContact CD1-CD1 4.24Å; A86-L88 HydrophobicContact CB-CD2 4.17Å; A86-L88 HydrophobicContact CB-CG 4.31Å; A86-L88 PolarHBondContact O-N 3Å; L88-L106 HydrophobicContact CB-CD1 4.44Å; L88-L108 HydrophobicContact CD2-CD2 3.15Å; L88-L108 HydrophobicContact CD2-CG 3.89Å
89	S	93.8	Very high	83.4	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	148.8	171.1	-173.6	0	0	0	0	108.7	A107 M215 G218 Y219 C220	S89-A107 PolarHBondContact N-O 2.88Å; S89-A107 VanDerWaalsContact N-O 3.11Å; S89-A107 PolarHBondContact O-N 2.91Å; S89-M215 VanDerWaalsContact CB-O 3.26Å; S89-M215 WeakPolarHBondContact CB-O 3.08Å; S89-M215 PolarHBondContact OG-O 2.83Å; S89-G218 VanDerWaalsContact OG-CA 3.26Å; S89-G218 WeakPolarHBondContact OG-CA 3.38Å; S89-G218 PolarHBondContact OG-O 3.49Å; S89-Y219 PolarHBondContact OG-N 3.29Å; S89-C220 VanDerWaalsContact C-SG 3.6Å; S89-C220 VanDerWaalsContact OG-CB 3.28Å; S89-C220 WeakPolarHBondContact OG-CB 3.44Å; S89-C220 PolarHBondContact OG-N 2.82Å
90	C	93.3	Very high	82.8	Confident	4 Å²	4	55.3 Å²	55.3	3%	0.027	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	160.6	177.4	118.3	0	0	0	0	111.5	C69 L73 V104 E105 L106 C220	C69-C90 WeakPolarHBondContact CA-SG 3.45Å; C69-C90 HydrophobicContact CB-CB 4.44Å; C69-C90 WeakPolarHBondContact CB-SG 3.4Å; C69-C90 WeakPolarHBondContact SG-CA 3.47Å; C69-C90 WeakPolarHBondContact SG-CB 3.44Å; C69-C90 PolarHBondContact SG-O 3.29Å; C69-C90 CovalentContact SG-SG 2.03Å; C69-C90 PolarHBondContact SG-SG 2.9Å; L73-C90 HydrophobicContact CD2-CB 4.11Å; L73-C90 HydrophobicContact CG-CB 4.3Å; C90-V104 HydrophobicContact CB-CG1 4.14Å; C90-V104 WeakPolarHBondContact SG-CG1 3.07Å; C90-E105 CarbonylContact C-O 3.46Å; C90-E105 WeakPolarHBondContact CA-O 3.09Å; C90-E105 VanDerWaalsContact CB-O 3.24Å; C90-E105 WeakPolarHBondContact CB-O 3.45Å; C90-L106 HydrophobicContact CB-CD1 4.22Å; C90-C220 VanDerWaalsContact CA-SG 3.51Å
91	D	91.5	Very high	82.4	Confident	3 Å²	3	55.4 Å²	55.4	2%	0.016	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	158.7	172.5	-151.4	-1.5	0	0	0	110.5	E105 C220 C221 T222 N225	D91-E105 PolarHBondContact N-O 3.05Å; D91-E105 PolarHBondContact O-N 3.41Å; D91-C220 VanDerWaalsContact CB-O 3.24Å; D91-C220 WeakPolarHBondContact CB-O 3.38Å; D91-C221 HydrophobicContact CB-CB 3.91Å; D91-T222 WeakPolarHBondContact OD2-CB 3.43Å; D91-T222 PolarHBondContact OD2-N 2.93Å; D91-N225 VanDerWaalsContact CG-ND2 3.35Å; D91-N225 PolarHBondContact OD1-ND2 3.44Å; D91-N225 WeakPolarHBondContact OD2-CB 3.28Å; D91-N225 PolarHBondContact OD2-ND2 3.39Å
92	I	88.3	Confident	82.2	Confident	3 Å²	3	51.6 Å²	51.6	2%	0.015	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	119.3	-177.7	-54.1	176.9	0	0	0	108.2	W49 L65 I102 V104 N225	W49-I92 HydrophobicContact CH2-CD1 3.96Å; W49-I92 HydrophobicContact CH2-CG2 4.1Å; W49-I92 HydrophobicContact CZ2-CG2 4.26Å; W49-I92 HydrophobicContact CZ3-CD1 4.5Å; L65-I92 HydrophobicContact CD2-CB 4.35Å; L65-I92 HydrophobicContact CD2-CG2 4.39Å; I92-I102 HydrophobicContact CD1-CD1 4.24Å; I92-V104 HydrophobicContact CD1-CG2 4.25Å; I92-V104 HydrophobicContact CG1-CB 4.48Å; I92-V104 HydrophobicContact CG1-CG1 4.09Å; I92-V104 HydrophobicContact CG1-CG2 4.13Å; I92-N225 PolarHBondContact O-ND2 3.04Å
93	S	77.6	Confident	82.1	Confident	19 Å²	19	47.7 Å²	47.7	13%	0.133	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	125.4	175.3	-176.9	0	0	0	0	110.3	T95 Q96	S93-T95 PolarHBondContact O-N 3.29Å; S93-T95 VanDerWaalsContact O-N 3.09Å; S93-T95 PolarHBondContact OG-OG1 2.96Å; S93-Q96 PolarHBondContact O-N 2.85Å
94	E	67.3	Low	82.1	Confident	85 Å²	85	47.7 Å²	47.7	40%	0.397	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.8	-29.3	178.5	-67.7	178	169.8	0	0	113	V58 L65 Q96 R228	V58-E94 WeakPolarHBondContact CG1-OE1 3.31Å; L65-E94 HydrophobicContact CD1-CG 4.24Å; E94-Q96 PolarHBondContact O-N 3.39Å; E94-R228 IonicContact OE1-CZ 3.6Å; E94-R228 IonicContact OE1-NH1 2.64Å; E94-R228 PolarHBondContact OE1-NH1 2.95Å; E94-R228 IonicContact OE1-NH2 3.92Å; E94-R228 IonicContact OE2-NH1 3.89Å
95	T	62.4	Low	82.2	Confident	122 Å²	122	44.9 Å²	44.9	75%	0.748	25%	0.253	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.2	-10.4	-175.1	54.8	0	0	0	0	115	S93 R97	S93-T95 PolarHBondContact O-N 3.29Å; S93-T95 VanDerWaalsContact O-N 3.09Å; S93-T95 PolarHBondContact OG-OG1 2.96Å; T95-R97 PolarHBondContact O-N 3.14Å
96	Q	59.7	Low	82.5	Confident	68 Å²	68	40.5 Å²	40.5	32%	0.318	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	52.8	-168.2	-64.6	-166.1	21.2	0	0	113.8	S93 E94 N103	S93-Q96 PolarHBondContact O-N 2.85Å; E94-Q96 PolarHBondContact O-N 3.39Å; Q96-N103 HydrophobicContact CB-CB 3.84Å; Q96-N103 PolarHBondContact O-N 2.87Å; Q96-N103 VanDerWaalsContact OE1-CB 3.26Å; Q96-N103 PolarHBondContact OE1-ND2 3.15Å; Q96-N103 VanDerWaalsContact OE1-ND2 3.08Å
97	R	63.7	Low	82.6	Confident	112 Å²	112	40.1 Å²	40.1	42%	0.423	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	136.7	173.4	-174.4	177.8	176.6	-169.3	6	111.8	D50 T95 G99	D50-R97 IonicContact OD1-CZ 3.72Å; D50-R97 IonicContact OD1-NH1 2.64Å; D50-R97 PolarHBondContact OD1-NH1 2.89Å; D50-R97 IonicContact OD1-NH2 2.77Å; D50-R97 IonicContact OD2-CZ 2.58Å; D50-R97 IonicContact OD2-NH1 3.91Å; D50-R97 PolarHBondContact OD2-NH1 3.44Å; D50-R97 IonicContact OD2-NH2 2.79Å; D50-R97 PolarHBondContact OD2-NH2 3.29Å; T95-R97 PolarHBondContact O-N 3.14Å; R97-G99 PolarHBondContact NE-O 2.82Å; R97-G99 PolarHBondContact NH2-O 3.4Å
98	T	60.3	Low	82.6	Confident	89 Å²	89	38.5 Å²	38.5	55%	0.546	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	88.2	168.3	49.6	0	0	0	0	109.9	E100 T101	T98-E100 PolarHBondContact O-N 3.14Å; T98-T101 PolarHBondContact N-O 3.18Å; T98-T101 VanDerWaalsContact N-O 3.13Å; T98-T101 PolarHBondContact O-N 3.13Å; T98-T101 PolarHBondContact O-OG1 2.77Å; T98-T101 PolarHBondContact OG1-OG1 3.01Å
99	G	72	Confident	82.5	Confident	53 Å²	53	38.4 Å²	38.4	55%	0.546	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.6	-123.7	179.7	0	0	0	0	0	112.4	R97 T101	R97-G99 PolarHBondContact NE-O 2.82Å; R97-G99 PolarHBondContact NH2-O 3.4Å; G99-T101 PolarHBondContact O-N 3.1Å
100	E	79.5	Confident	82.3	Confident	146 Å²	146	39.1 Å²	39.1	68%	0.682	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.3	6.2	-179.1	-65	175.1	175.6	0	0	113.2	T46 T98	T46-E100 PolarHBondContact N-O 3.45Å; T46-E100 PolarHBondContact OG1-O 3.24Å; T98-E100 PolarHBondContact O-N 3.14Å
101	T	86.2	Confident	82.1	Confident	19 Å²	19	42.1 Å²	42.1	12%	0.117	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	142.7	-176.1	74	0	0	0	0	112.2	N43 V44 T98 G99 I146	N43-T101 PolarHBondContact ND2-OG1 3.08Å; N43-T101 WeakPolarHBondContact OD1-CB 3.38Å; N43-T101 WeakPolarHBondContact OD1-CG2 3.43Å; N43-T101 PolarHBondContact OD1-OG1 3.31Å; V44-T101 CarbonylContact O-C 3.58Å; V44-T101 VanDerWaalsContact O-CA 3.25Å; V44-T101 WeakPolarHBondContact O-CA 3.46Å; T98-T101 PolarHBondContact N-O 3.18Å; T98-T101 VanDerWaalsContact N-O 3.13Å; T98-T101 PolarHBondContact O-N 3.13Å; T98-T101 PolarHBondContact O-OG1 2.77Å; T98-T101 PolarHBondContact OG1-OG1 3.01Å; G99-T101 PolarHBondContact O-N 3.1Å; T101-I146 HydrophobicContact CG2-CD1 3.25Å
102	I	87.9	Confident	82.1	Confident	5 Å²	5	44.7 Å²	44.7	3%	0.026	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	144.4	174.5	65.4	172.2	0	0	0	109.1	V44 T46 W49 I92 V104 W141	V44-I102 HydrophobicContact CB-CG1 4Å; V44-I102 PolarHBondContact N-O 3.15Å; V44-I102 PolarHBondContact O-N 3.1Å; T46-I102 HydrophobicContact CG2-CD1 3.75Å; T46-I102 HydrophobicContact CG2-CG1 3.82Å; T46-I102 HydrophobicContact CG2-CG2 4.41Å; W49-I102 HydrophobicContact CD2-CG2 3.83Å; W49-I102 HydrophobicContact CE3-CD1 3.86Å; W49-I102 HydrophobicContact CE3-CG2 4.07Å; W49-I102 HydrophobicContact CG-CG2 4.21Å; W49-I102 HydrophobicContact CH2-CD1 3.81Å; W49-I102 HydrophobicContact CZ2-CG2 4.36Å; W49-I102 HydrophobicContact CZ3-CD1 3.39Å; W49-I102 HydrophobicContact CZ3-CG2 4.43Å; I92-I102 HydrophobicContact CD1-CD1 4.24Å; I102-V104 HydrophobicContact CD1-CG2 3.89Å; I102-V104 HydrophobicContact CG1-CG2 3.99Å; I102-W141 HydrophobicContact CD1-CZ3 3.97Å
103	N	90.1	Very high	82.2	Confident	33 Å²	33	44.6 Å²	44.6	18%	0.176	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	123.4	168.8	-70.1	-21.5	0	0	0	109.7	T41 L42 N43 Q96	T41-N103 HydrophobicContact CG2-CB 3.74Å; L42-N103 WeakPolarHBondContact O-CA 3.42Å; N43-N103 PolarHBondContact ND2-OD1 3.23Å; Q96-N103 HydrophobicContact CB-CB 3.84Å; Q96-N103 PolarHBondContact O-N 2.87Å; Q96-N103 VanDerWaalsContact OE1-CB 3.26Å; Q96-N103 PolarHBondContact OE1-ND2 3.15Å; Q96-N103 VanDerWaalsContact OE1-ND2 3.08Å
104	V	91.9	Very high	82.8	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	124.7	176.1	-175.3	0	0	0	0	108.3	T41 L42 V44 V72 C90 I92 I102	T41-V104 CarbonylContact C-O 3.49Å; T41-V104 WeakPolarHBondContact CA-O 3.3Å; L42-V104 HydrophobicContact CB-CB 4.3Å; L42-V104 PolarHBondContact N-O 2.75Å; L42-V104 PolarHBondContact O-N 3.4Å; V44-V104 HydrophobicContact CB-CG2 4.27Å; V44-V104 HydrophobicContact CG2-CB 4.34Å; V44-V104 HydrophobicContact CG2-CG2 3.73Å; V72-V104 HydrophobicContact CG1-CG1 4.2Å; V72-V104 HydrophobicContact CG2-CG1 4.19Å; V72-V104 HydrophobicContact CG2-CG2 4.08Å; C90-V104 HydrophobicContact CB-CG1 4.14Å; C90-V104 WeakPolarHBondContact SG-CG1 3.07Å; I92-V104 HydrophobicContact CD1-CG2 4.25Å; I92-V104 HydrophobicContact CG1-CB 4.48Å; I92-V104 HydrophobicContact CG1-CG1 4.09Å; I92-V104 HydrophobicContact CG1-CG2 4.13Å; I102-V104 HydrophobicContact CD1-CG2 3.89Å; I102-V104 HydrophobicContact CG1-CG2 3.99Å
105	E	93.6	Very high	83.9	Confident	36 Å²	36	50.6 Å²	50.6	17%	0.168	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	122	172.9	-61.5	-172.7	131.5	0	0	108.6	V39 C90 D91 C221 T222	V39-E105 HydrophobicContact CG1-CB 4.04Å; C90-E105 CarbonylContact C-O 3.46Å; C90-E105 WeakPolarHBondContact CA-O 3.09Å; C90-E105 VanDerWaalsContact CB-O 3.24Å; C90-E105 WeakPolarHBondContact CB-O 3.45Å; D91-E105 PolarHBondContact N-O 3.05Å; D91-E105 PolarHBondContact O-N 3.41Å; E105-C221 HydrophobicContact CB-CB 3.5Å; E105-C221 HydrophobicContact CG-CB 4.24Å; E105-C221 WeakPolarHBondContact OE2-CB 3.26Å; E105-T222 PolarHBondContact OE2-N 2.84Å; E105-T222 PolarHBondContact OE2-OG1 3.45Å
106	L	94.8	Very high	85.3	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	114	175.6	179.3	71.6	0	0	0	108.8	V39 T40 L42 L73 V76 L88 C90 L108	V39-L106 WeakPolarHBondContact CA-O 3.36Å; T40-L106 HydrophobicContact CG2-CB 3.92Å; T40-L106 HydrophobicContact CG2-CD2 4.15Å; T40-L106 HydrophobicContact CG2-CG 4.39Å; T40-L106 PolarHBondContact N-O 2.75Å; T40-L106 PolarHBondContact O-N 3.39Å; L42-L106 HydrophobicContact CD1-CB 4.19Å; L42-L106 HydrophobicContact CD1-CD2 4.22Å; L42-L106 HydrophobicContact CG-CB 4.23Å; L73-L106 HydrophobicContact CD2-CD1 3.53Å; V76-L106 HydrophobicContact CG1-CD2 4.49Å; L88-L106 HydrophobicContact CB-CD1 4.44Å; C90-L106 HydrophobicContact CB-CD1 4.22Å; L106-L108 HydrophobicContact CD2-CD1 4.05Å; L106-L108 HydrophobicContact CD2-CD2 4.46Å; L106-L108 HydrophobicContact CD2-CG 4.4Å; L106-L108 HydrophobicContact CG-CD1 4.13Å; L106-L108 HydrophobicContact CG-CG 4.27Å
107	A	93.8	Very high	86.7	Confident	0 Å²	0	44 Å²	44	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	137.1	172.1	0	0	0	0	0	111.4	I37 V38 V39 S89 M215 C220	I37-A107 HydrophobicContact CG2-CB 4.4Å; V38-A107 WeakPolarHBondContact O-CA 3.38Å; V39-A107 HydrophobicContact CG2-CB 4.19Å; S89-A107 PolarHBondContact N-O 2.88Å; S89-A107 VanDerWaalsContact N-O 3.11Å; S89-A107 PolarHBondContact O-N 2.91Å; A107-M215 HydrophobicContact CB-CG 3.8Å; A107-C220 HydrophobicContact CB-CB 3.6Å
108	L	93.5	Very high	87.8	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	156.9	-179.4	-59.5	124.4	0	0	0	110.2	I37 V38 T40 L88 L106 M113	I37-L108 WeakPolarHBondContact CA-O 3.24Å; V38-L108 HydrophobicContact CG2-CB 4.01Å; V38-L108 PolarHBondContact N-O 3.26Å; V38-L108 PolarHBondContact O-N 3.43Å; T40-L108 HydrophobicContact CG2-CD1 3.97Å; L88-L108 HydrophobicContact CD2-CD2 3.15Å; L88-L108 HydrophobicContact CD2-CG 3.89Å; L106-L108 HydrophobicContact CD2-CD1 4.05Å; L106-L108 HydrophobicContact CD2-CD2 4.46Å; L106-L108 HydrophobicContact CD2-CG 4.4Å; L106-L108 HydrophobicContact CG-CD1 4.13Å; L106-L108 HydrophobicContact CG-CG 4.27Å; L108-M113 HydrophobicContact CB-CG 4.08Å; L108-M113 HydrophobicContact CD2-CE 3.82Å; L108-M113 HydrophobicContact CD2-CG 4.01Å; L108-M113 HydrophobicContact CD2-SD 3.51Å; L108-M113 VanDerWaalsContact CD2-SD 3.51Å
109	L	91.8	Very high	89.1	Confident	9 Å²	9	44 Å²	44	5%	0.047	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	112.3	166.8	-71.3	179.6	0	0	0	110.8	D36 I37 T87 N111 E112 M113 L212 M215	D36-L109 HydrophobicContact CB-CD2 4.32Å; D36-L109 CarbonylContact O-C 3.57Å; D36-L109 WeakPolarHBondContact O-CA 3.26Å; I37-L109 HydrophobicContact CG1-CD2 3.96Å; T87-L109 HydrophobicContact CG2-CD1 4.24Å; L109-N111 VanDerWaalsContact C-N 3.29Å; L109-N111 WeakPolarHBondContact CB-OD1 3.49Å; L109-N111 PolarHBondContact O-N 2.82Å; L109-E112 HydrophobicContact CB-CB 4.12Å; L109-E112 HydrophobicContact CB-CG 3.99Å; L109-E112 HydrophobicContact CD1-CG 4.28Å; L109-E112 WeakPolarHBondContact CD1-OE1 2.93Å; L109-E112 PolarHBondContact O-N 3.48Å; L109-M113 VanDerWaalsContact O-CG 3.24Å; L109-M113 WeakPolarHBondContact O-CG 3.25Å; L109-M113 PolarHBondContact O-N 2.7Å; L109-L212 HydrophobicContact CD2-CD1 3.69Å; L109-M215 HydrophobicContact CD1-CE 3.96Å; L109-M215 HydrophobicContact CD2-CE 3.27Å; L109-M215 HydrophobicContact CG-CE 3.4Å
110	S	89.2	Confident	89.7	Confident	15 Å²	15	46.5 Å²	46.5	11%	0.105	26%	0.255	C	S	.	.	H	α-helix	trans	-56.9	-39.9	-176.8	58.9	0	0	0	0	112.6	K35 D36 M113 E114	K35-S110 PolarHBondContact O-OG 3.05Å; D36-S110 WeakPolarHBondContact CA-OG 3.43Å; D36-S110 PolarHBondContact O-N 2.85Å; D36-S110 PolarHBondContact O-OG 3.13Å; D36-S110 VanDerWaalsContact O-OG 3.09Å; S110-M113 PolarHBondContact O-N 3.36Å; S110-E114 WeakPolarHBondContact O-CB 3.45Å; S110-E114 VanDerWaalsContact O-CG 3.28Å; S110-E114 WeakPolarHBondContact O-CG 3.44Å; S110-E114 PolarHBondContact O-N 3.37Å
111	N	88.2	Confident	90.1	Very high	67 Å²	67	43.8 Å²	43.8	36%	0.358	25%	0.25	S	S	.	.	H	α-helix	trans	-64.3	-40.7	177.6	60.3	-2.6	0	0	0	113.5	L109 T115	L109-N111 VanDerWaalsContact C-N 3.29Å; L109-N111 WeakPolarHBondContact CB-OD1 3.49Å; L109-N111 PolarHBondContact O-N 2.82Å; N111-T115 PolarHBondContact O-N 3.46Å; N111-T115 VanDerWaalsContact O-N 3.15Å; N111-T115 PolarHBondContact O-OG1 3.05Å
112	E	91.7	Very high	90.4	Very high	58 Å²	58	44.3 Å²	44.3	27%	0.271	25%	0.25	S	S	.	.	H	α-helix	trans	-66.2	-43.9	174.2	-68.6	-175.7	176	0	0	110.1	T87 L109 T115 I116	T87-E112 VanDerWaalsContact CB-OE2 3.26Å; T87-E112 WeakPolarHBondContact CB-OE2 3.45Å; T87-E112 PolarHBondContact N-OE2 3.14Å; T87-E112 PolarHBondContact OG1-OE1 2.86Å; T87-E112 VanDerWaalsContact OG1-OE1 3.08Å; T87-E112 PolarHBondContact OG1-OE2 3.39Å; T87-E112 VanDerWaalsContact OG1-OE2 3.1Å; L109-E112 HydrophobicContact CB-CB 4.12Å; L109-E112 HydrophobicContact CB-CG 3.99Å; L109-E112 HydrophobicContact CD1-CG 4.28Å; L109-E112 WeakPolarHBondContact CD1-OE1 2.93Å; L109-E112 PolarHBondContact O-N 3.48Å; E112-T115 WeakPolarHBondContact O-CB 3.21Å; E112-T115 PolarHBondContact O-N 2.58Å; E112-T115 VanDerWaalsContact O-N 3.15Å; E112-I116 WeakPolarHBondContact O-CB 3.05Å; E112-I116 WeakPolarHBondContact O-CD1 3.32Å; E112-I116 WeakPolarHBondContact O-CG1 3.15Å; E112-I116 PolarHBondContact O-N 3.01Å
113	M	91.4	Very high	90.6	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.005	25%	0.254	C	S	.	.	H	α-helix	trans	-63.4	-43.3	179.2	-66.5	-59.5	-66.3	0	0	112.4	L83 A86 L108 L109 S110 T115 I116 F117 W122 L126	L83-M113 HydrophobicContact CD2-CE 3.7Å; L83-M113 HydrophobicContact CD2-SD 3.59Å; L83-M113 VanDerWaalsContact CD2-SD 3.59Å; A86-M113 HydrophobicContact CB-SD 4.44Å; L108-M113 HydrophobicContact CB-CG 4.08Å; L108-M113 HydrophobicContact CD2-CE 3.82Å; L108-M113 HydrophobicContact CD2-CG 4.01Å; L108-M113 HydrophobicContact CD2-SD 3.51Å; L108-M113 VanDerWaalsContact CD2-SD 3.51Å; L109-M113 VanDerWaalsContact O-CG 3.24Å; L109-M113 WeakPolarHBondContact O-CG 3.25Å; L109-M113 PolarHBondContact O-N 2.7Å; S110-M113 PolarHBondContact O-N 3.36Å; M113-T115 VanDerWaalsContact C-N 3.27Å; M113-T115 PolarHBondContact O-N 3.39Å; M113-I116 PolarHBondContact O-N 2.86Å; M113-F117 HydrophobicContact CE-CD2 3.97Å; M113-F117 HydrophobicContact CE-CE2 3.38Å; M113-F117 HydrophobicContact CE-CZ 4.16Å; M113-F117 WeakPolarHBondContact O-CD2 3.37Å; M113-F117 PolarHBondContact O-N 3.25Å; M113-F117 HydrophobicContact SD-CE2 4.28Å; M113-W122 HydrophobicContact CB-CB 4.26Å; M113-W122 HydrophobicContact CB-CD2 3.77Å; M113-W122 HydrophobicContact CB-CE3 4.03Å; M113-W122 HydrophobicContact CB-CG 3.88Å; M113-W122 HydrophobicContact CE-CD2 4.29Å; M113-W122 HydrophobicContact CE-CE3 3.5Å; M113-W122 VanDerWaalsContact CE-CE3 3.5Å; M113-W122 HydrophobicContact CE-CZ3 3.99Å; M113-W122 HydrophobicContact CG-CE3 4.33Å; M113-L126 HydrophobicContact CE-CD2 3.82Å
114	E	89.6	Confident	90.8	Very high	117 Å²	117	47.5 Å²	47.5	55%	0.547	27%	0.271	S	S	.	.	H	α-helix	trans	-59.2	-40.7	173.5	-76.3	173.7	-175.1	0	0	111.4	S110 S118	S110-E114 WeakPolarHBondContact O-CB 3.45Å; S110-E114 VanDerWaalsContact O-CG 3.28Å; S110-E114 WeakPolarHBondContact O-CG 3.44Å; S110-E114 PolarHBondContact O-N 3.37Å; E114-S118 VanDerWaalsContact O-CB 3.27Å; E114-S118 WeakPolarHBondContact O-CB 3.21Å; E114-S118 PolarHBondContact O-N 2.8Å
115	T	90.3	Very high	90.8	Very high	112 Å²	112	49.4 Å²	49.4	69%	0.687	28%	0.284	S	S	*	.	H	α-helix	trans	-67.3	-44	177.6	-56.5	0	0	0	0	112	N111 E112 M113	N111-T115 PolarHBondContact O-N 3.46Å; N111-T115 VanDerWaalsContact O-N 3.15Å; N111-T115 PolarHBondContact O-OG1 3.05Å; E112-T115 WeakPolarHBondContact O-CB 3.21Å; E112-T115 PolarHBondContact O-N 2.58Å; E112-T115 VanDerWaalsContact O-N 3.15Å; M113-T115 VanDerWaalsContact C-N 3.27Å; M113-T115 PolarHBondContact O-N 3.39Å
116	I	91.4	Very high	90.7	Very high	43 Å²	43	47.7 Å²	47.7	22%	0.221	28%	0.276	C	S	.	.	H	α-helix	trans	-68.4	-37.3	-175.6	-71.1	166.3	0	0	0	112.3	K82 A86 E112 M113	K82-I116 HydrophobicContact CB-CG2 3.67Å; A86-I116 HydrophobicContact CB-CD1 3.66Å; E112-I116 WeakPolarHBondContact O-CB 3.05Å; E112-I116 WeakPolarHBondContact O-CD1 3.32Å; E112-I116 WeakPolarHBondContact O-CG1 3.15Å; E112-I116 PolarHBondContact O-N 3.01Å; M113-I116 PolarHBondContact O-N 2.86Å
117	F	89.8	Confident	90.8	Very high	8 Å²	8	50.5 Å²	50.5	4%	0.035	29%	0.288	C	S	.	.	H	α-helix	trans	-98.9	-6.8	-175.8	-72.7	-100.5	0	0	0	113.9	E80 L83 M113 N120 W122 L126	E80-F117 HydrophobicContact CG-CE1 4.43Å; E80-F117 HydrophobicContact CG-CZ 3.89Å; L83-F117 HydrophobicContact CD2-CE2 3.93Å; L83-F117 HydrophobicContact CD2-CZ 4.29Å; M113-F117 HydrophobicContact CE-CD2 3.97Å; M113-F117 HydrophobicContact CE-CE2 3.38Å; M113-F117 HydrophobicContact CE-CZ 4.16Å; M113-F117 WeakPolarHBondContact O-CD2 3.37Å; M113-F117 PolarHBondContact O-N 3.25Å; M113-F117 HydrophobicContact SD-CE2 4.28Å; F117-N120 CarbonylContact C-O 3.56Å; F117-N120 PolarHBondContact O-N 3.47Å; F117-W122 HydrophobicContact CB-CB 3.51Å; F117-W122 HydrophobicContact CD1-CB 4.42Å; F117-W122 HydrophobicContact CD2-CB 3.74Å; F117-W122 HydrophobicContact CG-CB 3.64Å; F117-L126 HydrophobicContact CE1-CB 4.43Å; F117-L126 HydrophobicContact CZ-CB 4.23Å; F117-L126 HydrophobicContact CZ-CD1 4.37Å
118	S	87.5	Confident	90.8	Very high	84 Å²	84	56.7 Å²	56.7	59%	0.587	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.5	134.7	175.8	-174.3	0	0	0	0	111.4	E114	E114-S118 VanDerWaalsContact O-CB 3.27Å; E114-S118 WeakPolarHBondContact O-CB 3.21Å; E114-S118 PolarHBondContact O-N 2.8Å
119	P	86.8	Confident	90.7	Very high	119 Å²	119	58.3 Å²	58.3	77%	0.773	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	cis	-89.5	4	9.3	36.4	-37	0	0	0	115.1
120	N	84.6	Confident	90.9	Very high	104 Å²	104	57.9 Å²	57.9	56%	0.556	33%	0.325	S	S	*	.	S	Bend	trans	-87.4	151.3	-174.3	-64.9	-40.3	0	0	0	111.6	F117 W122	F117-N120 CarbonylContact C-O 3.56Å; F117-N120 PolarHBondContact O-N 3.47Å; N120-W122 PolarHBondContact O-N 3.3Å; N120-W122 VanDerWaalsContact O-N 3.14Å
121	P	88.8	Confident	91.1	Very high	89 Å²	89	60.7 Å²	60.7	58%	0.578	34%	0.336	S	S	*	.			trans	-54.5	121.3	167.2	-24.7	34.9	0	0	0	110.4	P124 S125	P121-P124 HydrophobicContact CB-CG 4.02Å; P121-S125 PolarHBondContact O-OG 3.32Å
122	W	91.7	Very high	91.3	Very high	30 Å²	30	61 Å²	61	11%	0.114	34%	0.343	C	S	.	.	H	α-helix	trans	-65.9	-43.7	-173.2	69.3	-97.6	0	0	0	112.1	V38 M113 F117 N120 S125 L126 P151	V38-W122 HydrophobicContact CG2-CH2 3.9Å; V38-W122 HydrophobicContact CG2-CZ2 4.06Å; M113-W122 HydrophobicContact CB-CB 4.26Å; M113-W122 HydrophobicContact CB-CD2 3.77Å; M113-W122 HydrophobicContact CB-CE3 4.03Å; M113-W122 HydrophobicContact CB-CG 3.88Å; M113-W122 HydrophobicContact CE-CD2 4.29Å; M113-W122 HydrophobicContact CE-CE3 3.5Å; M113-W122 VanDerWaalsContact CE-CE3 3.5Å; M113-W122 HydrophobicContact CE-CZ3 3.99Å; M113-W122 HydrophobicContact CG-CE3 4.33Å; F117-W122 HydrophobicContact CB-CB 3.51Å; F117-W122 HydrophobicContact CD1-CB 4.42Å; F117-W122 HydrophobicContact CD2-CB 3.74Å; F117-W122 HydrophobicContact CG-CB 3.64Å; N120-W122 PolarHBondContact O-N 3.3Å; N120-W122 VanDerWaalsContact O-N 3.14Å; W122-S125 PolarHBondContact O-N 2.87Å; W122-L126 HydrophobicContact CE3-CD2 4.23Å; W122-L126 HydrophobicContact CZ3-CD2 3.98Å; W122-L126 WeakPolarHBondContact O-CB 3.48Å; W122-L126 PolarHBondContact O-N 3.46Å; W122-P151 HydrophobicContact CH2-CB 3.85Å; W122-P151 HydrophobicContact CH2-CG 3.83Å; W122-P151 HydrophobicContact CZ2-CB 4.29Å; W122-P151 HydrophobicContact CZ2-CG 4.01Å
123	F	93.1	Very high	91.2	Very high	25 Å²	25	58.9 Å²	58.9	11%	0.11	34%	0.337	C	S	.	.	H	α-helix	trans	-69.5	-48.1	-171	179.5	-108.2	0	0	0	114	S125 L126 K127 V148 S149 D150 P151	F123-S125 PolarHBondContact O-N 2.92Å; F123-L126 PolarHBondContact O-N 3.02Å; F123-K127 HydrophobicContact CE1-CB 4.49Å; F123-K127 HydrophobicContact CE1-CD 4Å; F123-K127 HydrophobicContact CE2-CB 4.32Å; F123-K127 HydrophobicContact CZ-CB 4.17Å; F123-K127 HydrophobicContact CZ-CD 3.87Å; F123-K127 VanDerWaalsContact O-CB 3.26Å; F123-K127 WeakPolarHBondContact O-CB 3.33Å; F123-K127 PolarHBondContact O-N 3.49Å; F123-V148 HydrophobicContact CE2-CG1 3.98Å; F123-V148 HydrophobicContact CZ-CG1 4.34Å; F123-S149 VanDerWaalsContact CZ-O 3.23Å; F123-S149 WeakPolarHBondContact CZ-O 3.47Å; F123-D150 HydrophobicContact CE1-CB 4.44Å; F123-D150 VanDerWaalsContact CE1-OD1 3.3Å; F123-D150 WeakPolarHBondContact CE1-OD1 3.3Å; F123-P151 HydrophobicContact CB-CG 4.41Å; F123-P151 HydrophobicContact CD1-CG 4.29Å; F123-P151 HydrophobicContact CD2-CG 3.89Å; F123-P151 HydrophobicContact CE2-CG 4.27Å; F123-P151 HydrophobicContact CG-CG 3.91Å
124	P	93.1	Very high	91	Very high	80 Å²	80	66.2 Å²	66.2	52%	0.519	38%	0.375	S	S	.	.	H	α-helix	trans	-58	-38	175.5	-25.9	35.5	0	0	0	112.9	P121 H128	P121-P124 HydrophobicContact CB-CG 4.02Å; P124-H128 WeakPolarHBondContact O-CB 2.98Å; P124-H128 PolarHBondContact O-N 2.94Å; P124-H128 VanDerWaalsContact O-N 3.07Å
125	S	91.2	Very high	90.9	Very high	40 Å²	40	61.4 Å²	61.4	28%	0.28	35%	0.353	S	S	.	.	H	α-helix	trans	-65.6	-51.3	177.4	-53.3	0	0	0	0	110.8	P121 W122 F123 H128 T129	P121-S125 PolarHBondContact O-OG 3.32Å; W122-S125 PolarHBondContact O-N 2.87Å; F123-S125 PolarHBondContact O-N 2.92Å; S125-H128 PolarHBondContact O-N 3.07Å; S125-T129 PolarHBondContact O-N 3.42Å; S125-T129 PolarHBondContact O-OG1 2.78Å; S125-T129 VanDerWaalsContact O-OG1 3.09Å
126	L	93.3	Very high	90.2	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-60.1	-48.4	178.6	178.2	64.4	0	0	0	111.8	E80 L83 M113 F117 W122 F123 H128 T129 L130	E80-L126 HydrophobicContact CB-CD1 4.36Å; E80-L126 HydrophobicContact CG-CD1 4.34Å; L83-L126 HydrophobicContact CD1-CD1 3.77Å; M113-L126 HydrophobicContact CE-CD2 3.82Å; F117-L126 HydrophobicContact CE1-CB 4.43Å; F117-L126 HydrophobicContact CZ-CB 4.23Å; F117-L126 HydrophobicContact CZ-CD1 4.37Å; W122-L126 HydrophobicContact CE3-CD2 4.23Å; W122-L126 HydrophobicContact CZ3-CD2 3.98Å; W122-L126 WeakPolarHBondContact O-CB 3.48Å; W122-L126 PolarHBondContact O-N 3.46Å; F123-L126 PolarHBondContact O-N 3.02Å; L126-H128 VanDerWaalsContact C-N 3.33Å; L126-H128 PolarHBondContact O-N 3.44Å; L126-T129 PolarHBondContact O-N 3.16Å; L126-L130 HydrophobicContact CD1-CD1 3.85Å; L126-L130 HydrophobicContact CD1-CD2 4.43Å; L126-L130 HydrophobicContact CD1-CG 3.93Å; L126-L130 HydrophobicContact CD2-CD1 4.47Å; L126-L130 HydrophobicContact CG-CD1 3.89Å; L126-L130 HydrophobicContact CG-CG 4.29Å; L126-L130 WeakPolarHBondContact O-CG 2.92Å; L126-L130 PolarHBondContact O-N 2.93Å
127	K	95.3	Very high	88.8	Confident	60 Å²	60	68.6 Å²	68.6	26%	0.261	38%	0.378	S	S	.	.	H	α-helix	trans	-56.1	-48.7	178.8	175.8	167.9	-174.1	168.8	0	111.1	F123 T129 L130 E131 V148	F123-K127 HydrophobicContact CE1-CB 4.49Å; F123-K127 HydrophobicContact CE1-CD 4Å; F123-K127 HydrophobicContact CE2-CB 4.32Å; F123-K127 HydrophobicContact CZ-CB 4.17Å; F123-K127 HydrophobicContact CZ-CD 3.87Å; F123-K127 VanDerWaalsContact O-CB 3.26Å; F123-K127 WeakPolarHBondContact O-CB 3.33Å; F123-K127 PolarHBondContact O-N 3.49Å; K127-T129 PolarHBondContact O-N 2.83Å; K127-L130 PolarHBondContact O-N 2.93Å; K127-E131 VanDerWaalsContact CE-CD 3.49Å; K127-E131 WeakPolarHBondContact CE-OE1 3.06Å; K127-E131 VanDerWaalsContact CE-OE2 3.28Å; K127-E131 WeakPolarHBondContact CE-OE2 3.28Å; K127-E131 HydrophobicContact CG-CG 4.32Å; K127-E131 WeakPolarHBondContact CG-OE2 3.4Å; K127-E131 IonicContact NZ-OE1 3.36Å; K127-E131 WeakPolarHBondContact O-CB 3.24Å; K127-E131 WeakPolarHBondContact O-CG 3.33Å; K127-E131 PolarHBondContact O-N 2.64Å; K127-V148 WeakPolarHBondContact CE-O 3.42Å; K127-V148 HydrophobicContact CG-CB 4.23Å; K127-V148 PolarHBondContact NZ-O 3.48Å
128	H	93.6	Very high	87.7	Confident	129 Å²	129	75.9 Å²	75.9	60%	0.597	41%	0.412	S	S	*	.	H	α-helix	trans	-60.5	-45.7	177.8	-177.8	62.3	0	0	0	112.1	P124 S125 L126 L130 S132	P124-H128 WeakPolarHBondContact O-CB 2.98Å; P124-H128 PolarHBondContact O-N 2.94Å; P124-H128 VanDerWaalsContact O-N 3.07Å; S125-H128 PolarHBondContact O-N 3.07Å; L126-H128 VanDerWaalsContact C-N 3.33Å; L126-H128 PolarHBondContact O-N 3.44Å; H128-L130 PolarHBondContact O-N 3.33Å; H128-S132 VanDerWaalsContact O-CB 3.31Å; H128-S132 WeakPolarHBondContact O-CB 3.23Å; H128-S132 PolarHBondContact O-N 2.03Å; H128-S132 PolarHBondContact O-OG 3.1Å
129	T	93.4	Very high	86.8	Confident	35 Å²	35	73.2 Å²	73.2	22%	0.215	39%	0.394	C	S	.	.	H	α-helix	trans	-61	-42.8	178.3	-59.4	0	0	0	0	112	L79 E80 S125 L126 K127 G133	L79-T129 HydrophobicContact CB-CG2 4.46Å; L79-T129 WeakPolarHBondContact O-CG2 3.4Å; E80-T129 HydrophobicContact CB-CG2 3.99Å; E80-T129 PolarHBondContact OE2-OG1 2.89Å; S125-T129 PolarHBondContact O-N 3.42Å; S125-T129 PolarHBondContact O-OG1 2.78Å; S125-T129 VanDerWaalsContact O-OG1 3.09Å; L126-T129 PolarHBondContact O-N 3.16Å; K127-T129 PolarHBondContact O-N 2.83Å; T129-G133 WeakPolarHBondContact O-CA 3.3Å; T129-G133 PolarHBondContact O-N 2.8Å
130	L	94.1	Very high	86.1	Confident	0 Å²	0	73 Å²	73	0%	0	39%	0.391	C	S	.	.	H	α-helix	trans	-72.4	-42.1	-178.3	-66.4	-179.1	0	0	0	112.7	L42 V76 L79 L126 K127 H128 I145 V148	L42-L130 HydrophobicContact CD2-CD1 4.16Å; V76-L130 HydrophobicContact CB-CD2 4.39Å; V76-L130 HydrophobicContact CG1-CD2 4.2Å; V76-L130 HydrophobicContact CG2-CD2 4.15Å; L79-L130 HydrophobicContact CB-CD2 4.18Å; L79-L130 HydrophobicContact CD1-CD2 4.08Å; L126-L130 HydrophobicContact CD1-CD1 3.85Å; L126-L130 HydrophobicContact CD1-CD2 4.43Å; L126-L130 HydrophobicContact CD1-CG 3.93Å; L126-L130 HydrophobicContact CD2-CD1 4.47Å; L126-L130 HydrophobicContact CG-CD1 3.89Å; L126-L130 HydrophobicContact CG-CG 4.29Å; L126-L130 WeakPolarHBondContact O-CG 2.92Å; L126-L130 PolarHBondContact O-N 2.93Å; K127-L130 PolarHBondContact O-N 2.93Å; H128-L130 PolarHBondContact O-N 3.33Å; L130-I145 HydrophobicContact CB-CG2 4.48Å; L130-I145 HydrophobicContact CD2-CD1 4.21Å; L130-V148 HydrophobicContact CB-CG2 3.91Å; L130-V148 HydrophobicContact CD1-CG2 4.11Å
131	E	94.6	Very high	85.8	Confident	74 Å²	74	68.4 Å²	68.4	35%	0.346	37%	0.365	S	S	.	.	H	α-helix	trans	-78.5	-22.3	-178	-66.4	179.7	159.8	0	0	113.6	K127 S147 V148	K127-E131 VanDerWaalsContact CE-CD 3.49Å; K127-E131 WeakPolarHBondContact CE-OE1 3.06Å; K127-E131 VanDerWaalsContact CE-OE2 3.28Å; K127-E131 WeakPolarHBondContact CE-OE2 3.28Å; K127-E131 HydrophobicContact CG-CG 4.32Å; K127-E131 WeakPolarHBondContact CG-OE2 3.4Å; K127-E131 IonicContact NZ-OE1 3.36Å; K127-E131 WeakPolarHBondContact O-CB 3.24Å; K127-E131 WeakPolarHBondContact O-CG 3.33Å; K127-E131 PolarHBondContact O-N 2.64Å; E131-S147 WeakPolarHBondContact OE1-CA 2.93Å; E131-V148 HydrophobicContact CG-CB 4.46Å; E131-V148 HydrophobicContact CG-CG2 3.99Å; E131-V148 PolarHBondContact OE1-N 2.91Å
132	S	92.9	Very high	85.7	Confident	72 Å²	72	64.4 Å²	64.4	50%	0.503	34%	0.339	S	S	.	.	H	α-helix	trans	-102	-7.4	176.9	68	0	0	0	0	113.8	H128	H128-S132 VanDerWaalsContact O-CB 3.31Å; H128-S132 WeakPolarHBondContact O-CB 3.23Å; H128-S132 PolarHBondContact O-N 2.03Å; H128-S132 PolarHBondContact O-OG 3.1Å
133	G	89	Confident	85.4	Confident	14 Å²	14	66 Å²	66	14%	0.144	35%	0.352	C	S	.	.			trans	-70.3	134.9	-175.1	0	0	0	0	0	112.2	T129 V135	T129-G133 WeakPolarHBondContact O-CA 3.3Å; T129-G133 PolarHBondContact O-N 2.8Å; G133-V135 PolarHBondContact O-N 2.62Å
134	I	87.7	Confident	85.2	Confident	156 Å²	156	68 Å²	68	80%	0.8	36%	0.364	S	S	*	.			trans	-85.5	110.5	172.8	-57.6	175.5	0	0	0	107.9	N136	I134-N136 PolarHBondContact O-N 3.24Å
135	V	86.2	Confident	85.2	Confident	15 Å²	15	64.2 Å²	64.2	9%	0.091	34%	0.339	C	S	.	.			trans	-61	130.2	173.8	-178.3	0	0	0	0	109.3	V75 G133 K137 I142	V75-V135 HydrophobicContact CG1-CB 4.49Å; V75-V135 HydrophobicContact CG1-CG1 3.96Å; V75-V135 HydrophobicContact CG1-CG2 3.92Å; V75-V135 HydrophobicContact CG2-CG1 4.06Å; G133-V135 PolarHBondContact O-N 2.62Å; V135-K137 PolarHBondContact O-N 3.04Å; V135-I142 HydrophobicContact CG1-CB 4.44Å; V135-I142 HydrophobicContact CG1-CG2 4.26Å; V135-I142 HydrophobicContact CG2-CG2 4.32Å
136	N	76	Confident	85.2	Confident	101 Å²	101	66.3 Å²	66.3	54%	0.54	35%	0.347	S	S	.	.			trans	-57.9	137.7	179.2	-177.1	-1.1	0	0	0	110	I134 E138 S139	I134-N136 PolarHBondContact O-N 3.24Å; N136-E138 PolarHBondContact ND2-OE2 3.21Å; N136-E138 PolarHBondContact O-N 2.83Å; N136-E138 PolarHBondContact OD1-N 3.26Å; N136-S139 WeakPolarHBondContact O-CB 3.34Å; N136-S139 PolarHBondContact O-N 3.47Å
137	K	63	Low	85.2	Confident	206 Å²	206	68.7 Å²	68.7	90%	0.896	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-18.9	176.1	-67.2	-174.7	179	-177.8	0	113.9	V135 S139	V135-K137 PolarHBondContact O-N 3.04Å; K137-S139 VanDerWaalsContact C-N 3.26Å
138	E	65.9	Low	85.2	Confident	160 Å²	160	66 Å²	66	75%	0.748	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-10.9	174.1	-62.8	-178.7	165.1	0	0	113.4	N136 T140	N136-E138 PolarHBondContact ND2-OE2 3.21Å; N136-E138 PolarHBondContact O-N 2.83Å; N136-E138 PolarHBondContact OD1-N 3.26Å; E138-T140 PolarHBondContact O-N 2.79Å; E138-T140 VanDerWaalsContact O-N 3.1Å
139	S	69.1	Low	85.3	Confident	28 Å²	28	61.7 Å²	61.7	20%	0.196	34%	0.336	C	S	.	.			trans	-60.8	114.4	168.2	173.3	0	0	0	0	108.7	N136 K137 W141 I142	N136-S139 WeakPolarHBondContact O-CB 3.34Å; N136-S139 PolarHBondContact O-N 3.47Å; K137-S139 VanDerWaalsContact C-N 3.26Å; S139-W141 PolarHBondContact O-N 3.29Å; S139-I142 WeakPolarHBondContact CB-O 3.39Å; S139-I142 WeakPolarHBondContact OG-CB 3.26Å; S139-I142 PolarHBondContact OG-N 2.93Å; S139-I142 PolarHBondContact OG-O 3.32Å
140	T	71.1	Confident	85.3	Confident	116 Å²	116	65.1 Å²	65.1	71%	0.712	35%	0.353	S	S	*	.	S	Bend	trans	-71.6	-16.2	-168.7	38.1	0	0	0	0	114	E138	E138-T140 PolarHBondContact O-N 2.79Å; E138-T140 VanDerWaalsContact O-N 3.1Å
141	W	79.3	Confident	85.3	Confident	7 Å²	7	66.8 Å²	66.8	3%	0.027	36%	0.364	C	S	.	.	S	Bend	trans	-152.8	-19.9	-171.7	59.6	-83.6	0	0	0	114	T46 I47 W49 Y68 N71 V72 I102 S139	T46-W141 CarbonylContact C-O 3.58Å; T46-W141 WeakPolarHBondContact CA-O 3.28Å; T46-W141 HydrophobicContact CG2-CE3 3.62Å; T46-W141 HydrophobicContact CG2-CZ3 3.62Å; I47-W141 PolarHBondContact N-O 2.89Å; W49-W141 HydrophobicContact CZ3-CZ3 4.29Å; Y68-W141 AromaticContact CD1-CD2 3.38Å; Y68-W141 HydrophobicContact CD1-CD2 3.38Å; Y68-W141 AromaticContact CD1-CE2 3.5Å; Y68-W141 VanDerWaalsContact CD1-CE2 3.5Å; Y68-W141 AromaticContact CD1-CE3 3.42Å; Y68-W141 HydrophobicContact CD1-CE3 3.42Å; Y68-W141 VanDerWaalsContact CD1-CE3 3.42Å; Y68-W141 HydrophobicContact CD1-CG 4.05Å; Y68-W141 AromaticContact CD1-CH2 3.59Å; Y68-W141 HydrophobicContact CD1-CH2 3.59Å; Y68-W141 AromaticContact CD1-CZ2 3.66Å; Y68-W141 HydrophobicContact CD1-CZ2 3.66Å; Y68-W141 AromaticContact CD1-CZ3 3.5Å; Y68-W141 HydrophobicContact CD1-CZ3 3.5Å; Y68-W141 HydrophobicContact CE1-CB 4.21Å; Y68-W141 AromaticContact CE1-CD2 3.42Å; Y68-W141 HydrophobicContact CE1-CD2 3.42Å; Y68-W141 VanDerWaalsContact CE1-CD2 3.42Å; Y68-W141 AromaticContact CE1-CE3 3.48Å; Y68-W141 HydrophobicContact CE1-CE3 3.48Å; Y68-W141 VanDerWaalsContact CE1-CE3 3.48Å; Y68-W141 AromaticContact CE1-CG 3.71Å; Y68-W141 HydrophobicContact CE1-CG 3.71Å; Y68-W141 HydrophobicContact CE1-CH2 4.47Å; Y68-W141 HydrophobicContact CE1-CZ3 4Å; Y68-W141 HydrophobicContact CG-CH2 4.34Å; Y68-W141 HydrophobicContact CG-CZ2 4.49Å; Y68-W141 HydrophobicContact CG-CZ3 4.46Å; Y68-W141 WeakPolarHBondContact O-CH2 3.26Å; Y68-W141 WeakPolarHBondContact O-CZ2 3.4Å; N71-W141 VanDerWaalsContact CB-CE2 3.45Å; N71-W141 HydrophobicContact CB-CZ2 3.3Å; N71-W141 PolarHBondContact ND2-NE1 3.11Å; V72-W141 HydrophobicContact CG2-CH2 3.43Å; V72-W141 VanDerWaalsContact CG2-CH2 3.43Å; V72-W141 HydrophobicContact CG2-CZ2 3.98Å; I102-W141 HydrophobicContact CD1-CZ3 3.97Å; S139-W141 PolarHBondContact O-N 3.29Å
142	I	85.6	Confident	85.1	Confident	5 Å²	5	70.1 Å²	70.1	3%	0.026	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	126.3	172.4	-56.2	169.7	0	0	0	108.8	V44 V72 V75 V135 S139	V44-I142 HydrophobicContact CG1-CB 4.22Å; V44-I142 HydrophobicContact CG1-CD1 4.23Å; V44-I142 HydrophobicContact CG1-CG1 3.88Å; V44-I142 HydrophobicContact CG1-CG2 3.47Å; V44-I142 VanDerWaalsContact CG1-CG2 3.47Å; V72-I142 HydrophobicContact CB-CD1 4.29Å; V72-I142 HydrophobicContact CG2-CD1 3.91Å; V75-I142 HydrophobicContact CB-CD1 4.2Å; V75-I142 HydrophobicContact CG2-CD1 3.82Å; V135-I142 HydrophobicContact CG1-CB 4.44Å; V135-I142 HydrophobicContact CG1-CG2 4.26Å; V135-I142 HydrophobicContact CG2-CG2 4.32Å; S139-I142 WeakPolarHBondContact CB-O 3.39Å; S139-I142 WeakPolarHBondContact OG-CB 3.26Å; S139-I142 PolarHBondContact OG-N 2.93Å; S139-I142 PolarHBondContact OG-O 3.32Å
143	T	85.9	Confident	84.9	Confident	62 Å²	62	71.3 Å²	71.3	38%	0.38	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	-38.7	173.1	43.4	0	0	0	0	112.4	S45 I47	S45-T143 WeakPolarHBondContact CB-OG1 3.46Å; S45-T143 PolarHBondContact O-N 3.28Å; S45-T143 VanDerWaalsContact O-N 3.07Å; S45-T143 PolarHBondContact O-OG1 2.89Å; S45-T143 PolarHBondContact OG-OG1 3.14Å; I47-T143 HydrophobicContact CD1-CG2 3.3Å; I47-T143 HydrophobicContact CG1-CG2 3.48Å; I47-T143 VanDerWaalsContact CG1-CG2 3.48Å
144	D	89.5	Confident	84.6	Confident	68 Å²	68	72.1 Å²	72.1	36%	0.364	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.5	157.3	-174.2	-154.3	0.4	0	0	0	112.7	S45	S45-D144 PolarHBondContact N-O 3.11Å
145	I	92	Very high	83.9	Confident	1 Å²	1	69.2 Å²	69.2	1%	0.005	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	100.8	166.5	-58.9	178.4	0	0	0	107.4	V75 V76 L79 L130 V148	V75-I145 HydrophobicContact CG1-CD1 4.31Å; V76-I145 HydrophobicContact CG2-CD1 4.31Å; L79-I145 HydrophobicContact CD1-CD1 3.9Å; L130-I145 HydrophobicContact CB-CG2 4.48Å; L130-I145 HydrophobicContact CD2-CD1 4.21Å; I145-V148 HydrophobicContact CG2-CG2 4.05Å
146	I	92	Very high	83.3	Confident	84 Å²	84	71.8 Å²	71.8	43%	0.431	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	-41.1	-170	-65.9	164.6	0	0	0	111.8	N43 T101	N43-I146 HydrophobicContact CB-CB 4.46Å; N43-I146 PolarHBondContact O-N 3.16Å; T101-I146 HydrophobicContact CG2-CD1 3.25Å
147	S	93.8	Very high	83.3	Confident	50 Å²	50	70 Å²	70	35%	0.35	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	152.3	-178.2	68.6	0	0	0	0	112.3	N43 E131	N43-S147 WeakPolarHBondContact CB-OG 3.38Å; N43-S147 PolarHBondContact N-O 2.95Å; E131-S147 WeakPolarHBondContact OE1-CA 2.93Å
148	V	95.6	Very high	84.3	Confident	3 Å²	3	61.2 Å²	61.2	2%	0.018	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	121.5	175.9	-178	0	0	0	0	109.7	T40 L42 F123 K127 L130 E131 I145	T40-V148 HydrophobicContact CG2-CG1 4.36Å; T40-V148 VanDerWaalsContact OG1-CG1 3.28Å; T40-V148 WeakPolarHBondContact OG1-CG1 3.43Å; L42-V148 HydrophobicContact CD2-CB 4.27Å; L42-V148 HydrophobicContact CD2-CG1 3.86Å; L42-V148 HydrophobicContact CD2-CG2 3.7Å; F123-V148 HydrophobicContact CE2-CG1 3.98Å; F123-V148 HydrophobicContact CZ-CG1 4.34Å; K127-V148 WeakPolarHBondContact CE-O 3.42Å; K127-V148 HydrophobicContact CG-CB 4.23Å; K127-V148 PolarHBondContact NZ-O 3.48Å; L130-V148 HydrophobicContact CB-CG2 3.91Å; L130-V148 HydrophobicContact CD1-CG2 4.11Å; E131-V148 HydrophobicContact CG-CB 4.46Å; E131-V148 HydrophobicContact CG-CG2 3.99Å; E131-V148 PolarHBondContact OE1-N 2.91Å; I145-V148 HydrophobicContact CG2-CG2 4.05Å
149	S	94.8	Very high	85.2	Confident	38 Å²	38	54.5 Å²	54.5	27%	0.266	30%	0.299	S	S	.	.	P	Polyproline II helix	trans	-71.9	155.9	178.6	85.2	0	0	0	0	111.8	T40 T41 F123	T40-S149 PolarHBondContact OG1-O 3.06Å; T41-S149 PolarHBondContact N-OG 3.45Å; T41-S149 PolarHBondContact O-N 3.42Å; F123-S149 VanDerWaalsContact CZ-O 3.23Å; F123-S149 WeakPolarHBondContact CZ-O 3.47Å
150	D	93.7	Very high	86.1	Confident	107 Å²	107	56.5 Å²	56.5	57%	0.572	31%	0.307	S	S	*	.	P	Polyproline II helix	trans	-58.7	141.6	170.3	-63.7	-23.4	0	0	0	110.6	F123 K152	F123-D150 HydrophobicContact CE1-CB 4.44Å; F123-D150 VanDerWaalsContact CE1-OD1 3.3Å; F123-D150 WeakPolarHBondContact CE1-OD1 3.3Å; D150-K152 PolarHBondContact O-N 3.45Å
151	P	92.9	Very high	87	Confident	36 Å²	36	51 Å²	51	23%	0.234	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-70.8	131.5	-176.4	28.7	-32.7	0	0	0	109.5	V38 V39 W122 F123	V38-P151 HydrophobicContact CB-CB 4.04Å; V38-P151 HydrophobicContact CG2-CB 4.28Å; V39-P151 WeakPolarHBondContact O-CA 3.26Å; W122-P151 HydrophobicContact CH2-CB 3.85Å; W122-P151 HydrophobicContact CH2-CG 3.83Å; W122-P151 HydrophobicContact CZ2-CB 4.29Å; W122-P151 HydrophobicContact CZ2-CG 4.01Å; F123-P151 HydrophobicContact CB-CG 4.41Å; F123-P151 HydrophobicContact CD1-CG 4.29Å; F123-P151 HydrophobicContact CD2-CG 3.89Å; F123-P151 HydrophobicContact CE2-CG 4.27Å; F123-P151 HydrophobicContact CG-CG 3.91Å
152	K	91.4	Very high	87.5	Confident	144 Å²	144	53.7 Å²	53.7	63%	0.626	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.6	128.9	176.9	-64.9	176.6	-174.8	170.3	0	109	V38 V39 D150 L154	V38-K152 WeakPolarHBondContact CA-O 3.42Å; V39-K152 PolarHBondContact N-O 2.94Å; V39-K152 PolarHBondContact O-N 3.17Å; D150-K152 PolarHBondContact O-N 3.45Å; K152-L154 PolarHBondContact O-N 3.19Å
153	P	88.1	Confident	87.7	Confident	96 Å²	96	56.1 Å²	56.1	62%	0.623	30%	0.298	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.1	137.8	174.2	28.2	-33.5	0	0	0	109.2
154	L	82.5	Confident	88	Confident	32 Å²	32	57.7 Å²	57.7	17%	0.168	30%	0.304	C	S	.	.			trans	-95.1	122.4	171.2	-167.5	81.4	0	0	0	109.6	I37 V39 K152 R156 Y211	I37-L154 HydrophobicContact CB-CB 4.36Å; I37-L154 HydrophobicContact CG2-CB 4.25Å; I37-L154 PolarHBondContact O-N 3.29Å; V39-L154 HydrophobicContact CG2-CB 4.42Å; K152-L154 PolarHBondContact O-N 3.19Å; L154-R156 HydrophobicContact CD2-CB 4.33Å; L154-R156 HydrophobicContact CG-CB 4.34Å; L154-R156 HydrophobicContact CG-CG 4.31Å; L154-R156 PolarHBondContact O-N 3.29Å; L154-Y211 HydrophobicContact CD2-CD1 3.44Å; L154-Y211 VanDerWaalsContact CD2-CD1 3.44Å; L154-Y211 HydrophobicContact CD2-CD2 4.17Å; L154-Y211 HydrophobicContact CD2-CE1 2.95Å; L154-Y211 HydrophobicContact CD2-CE2 3.72Å; L154-Y211 HydrophobicContact CD2-CG 4.02Å; L154-Y211 VanDerWaalsContact CD2-OH 3.23Å; L154-Y211 WeakPolarHBondContact CD2-OH 3.26Å; L154-Y211 HydrophobicContact CG-CE1 4.45Å
155	D	73.1	Confident	87.9	Confident	95 Å²	95	56 Å²	56	51%	0.508	29%	0.293	S	S	.	.			trans	-95.6	25.4	-171.9	63.6	-17.7	0	0	0	114.1	S32	S32-D155 VanDerWaalsContact CB-C 3.48Å; S32-D155 WeakPolarHBondContact CB-O 3.33Å; S32-D155 PolarHBondContact N-O 2.75Å; S32-D155 VanDerWaalsContact N-O 3.08Å
156	R	74.1	Confident	87.7	Confident	69 Å²	69	57.1 Å²	57.1	26%	0.26	31%	0.305	S	S	.	.	B	Isolated β-bridge	trans	-111.5	123.5	-172.1	-61	-177	-176.6	-149.9	1.8	113	L154 N223	L154-R156 HydrophobicContact CD2-CB 4.33Å; L154-R156 HydrophobicContact CG-CB 4.34Å; L154-R156 HydrophobicContact CG-CG 4.31Å; L154-R156 PolarHBondContact O-N 3.29Å; R156-N223 PolarHBondContact NH1-ND2 3.5Å; R156-N223 PolarHBondContact NH1-OD1 3.19Å; R156-N223 PolarHBondContact NH2-ND2 3.12Å
157	E	76.9	Confident	87.4	Confident	63 Å²	63	59.5 Å²	59.5	29%	0.294	31%	0.313	S	S	.	.	S	Bend	trans	-82.3	-40.5	174	-58.9	-168	154	0	0	112.4	S32 T33 N210 Y211	S32-E157 WeakPolarHBondContact CA-OE1 3.47Å; T33-E157 PolarHBondContact N-OE1 2.63Å; T33-E157 VanDerWaalsContact N-OE1 3.09Å; T33-E157 PolarHBondContact OG1-OE1 3.13Å; E157-N210 PolarHBondContact O-ND2 2.92Å; E157-Y211 PolarHBondContact O-N 3.45Å
158	S	83.2	Confident	87.1	Confident	22 Å²	22	64.7 Å²	64.7	15%	0.154	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	156.4	-173.1	62.9	0	0	0	0	112.4	M209	S158-M209 CarbonylContact C-O 3.51Å; S158-M209 VanDerWaalsContact CA-O 3.26Å; S158-M209 WeakPolarHBondContact CA-O 3.3Å; S158-M209 WeakPolarHBondContact CB-O 3.49Å
159	Y	85	Confident	86.7	Confident	19 Å²	19	66.8 Å²	66.8	8%	0.075	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	121	169.6	-174.8	-86.3	0	0	0	108.5	F161 E208 M209 N223 I226 Y227 I230	Y159-F161 HydrophobicContact CE1-CB 4.08Å; Y159-E208 WeakPolarHBondContact O-CA 3.28Å; Y159-M209 HydrophobicContact CD1-CE 3.87Å; Y159-M209 HydrophobicContact CE1-CE 4.4Å; Y159-M209 PolarHBondContact N-O 3.13Å; Y159-M209 PolarHBondContact O-N 3.06Å; Y159-N223 HydrophobicContact CE2-CB 3.84Å; Y159-N223 WeakPolarHBondContact CE2-OD1 3.32Å; Y159-N223 PolarHBondContact OH-O 3.05Å; Y159-I226 HydrophobicContact CD1-CG2 3.76Å; Y159-I226 HydrophobicContact CD2-CD1 4.18Å; Y159-I226 HydrophobicContact CD2-CG2 4.2Å; Y159-I226 HydrophobicContact CE1-CB 4.35Å; Y159-I226 HydrophobicContact CE1-CG2 3.54Å; Y159-I226 HydrophobicContact CE2-CB 4.07Å; Y159-I226 HydrophobicContact CE2-CD1 4.35Å; Y159-I226 HydrophobicContact CE2-CG2 4Å; Y159-I226 HydrophobicContact CG-CG2 4.08Å; Y159-Y227 WeakPolarHBondContact OH-CA 3.19Å; Y159-Y227 WeakPolarHBondContact OH-CB 2.97Å; Y159-Y227 PolarHBondContact OH-N 3.23Å; Y159-I230 HydrophobicContact CD1-CD1 4.3Å; Y159-I230 HydrophobicContact CE1-CD1 3.73Å
160	L	88.3	Confident	86.3	Confident	69 Å²	69	65 Å²	65	36%	0.361	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	117.3	178.2	-178.7	63.7	0	0	0	109.6	I162	L160-I162 HydrophobicContact CD1-CG1 4.29Å; L160-I162 HydrophobicContact CD2-CD1 3.98Å; L160-I162 HydrophobicContact CD2-CG1 4.44Å; L160-I162 HydrophobicContact CG-CD1 4.16Å; L160-I162 HydrophobicContact CG-CG1 4.07Å
161	F	89.5	Confident	85.9	Confident	2 Å²	2	64.4 Å²	64.4	1%	0.009	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	133.5	170.3	176.5	-83.8	0	0	0	109.3	Y159 K163 K206 T207 Y227 I230 I234	Y159-F161 HydrophobicContact CE1-CB 4.08Å; F161-K163 HydrophobicContact CE1-CB 3.62Å; F161-K163 HydrophobicContact CE2-CB 4.49Å; F161-K163 HydrophobicContact CZ-CB 3.56Å; F161-K163 HydrophobicContact CZ-CD 4.21Å; F161-K206 CarbonylContact O-C 3.55Å; F161-K206 WeakPolarHBondContact O-CA 3.49Å; F161-T207 WeakPolarHBondContact CB-OG1 3.01Å; F161-T207 PolarHBondContact N-O 3.39Å; F161-T207 PolarHBondContact O-N 3.49Å; F161-Y227 AromaticContact CD2-CD2 3.6Å; F161-Y227 HydrophobicContact CD2-CD2 3.6Å; F161-Y227 HydrophobicContact CD2-CE2 4.16Å; F161-Y227 HydrophobicContact CD2-CG 4.48Å; F161-Y227 AromaticContact CE2-CD2 3.22Å; F161-Y227 HydrophobicContact CE2-CD2 3.22Å; F161-Y227 AromaticContact CE2-CE2 3.39Å; F161-Y227 HydrophobicContact CE2-CE2 3.39Å; F161-Y227 HydrophobicContact CE2-CG 4.17Å; F161-Y227 HydrophobicContact CZ-CD2 4.34Å; F161-Y227 HydrophobicContact CZ-CE2 4.11Å; F161-I230 HydrophobicContact CB-CD1 3.66Å; F161-I230 HydrophobicContact CD1-CG2 3.86Å; F161-I230 HydrophobicContact CD2-CB 4.03Å; F161-I230 HydrophobicContact CD2-CD1 3.71Å; F161-I230 HydrophobicContact CD2-CG2 3.86Å; F161-I230 HydrophobicContact CE1-CG2 3.91Å; F161-I230 HydrophobicContact CE2-CB 4.06Å; F161-I230 HydrophobicContact CE2-CG2 3.85Å; F161-I230 HydrophobicContact CG-CB 4.44Å; F161-I230 HydrophobicContact CG-CD1 3.85Å; F161-I230 HydrophobicContact CG-CG2 3.86Å; F161-I230 HydrophobicContact CZ-CG2 3.9Å; F161-I234 HydrophobicContact CE1-CD1 3.63Å; F161-I234 HydrophobicContact CZ-CD1 3.91Å
162	I	90.1	Very high	85.7	Confident	63 Å²	63	67.5 Å²	67.5	32%	0.323	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	124.5	171	-56.1	-179	0	0	0	107	L160 I205 K206	L160-I162 HydrophobicContact CD1-CG1 4.29Å; L160-I162 HydrophobicContact CD2-CD1 3.98Å; L160-I162 HydrophobicContact CD2-CG1 4.44Å; L160-I162 HydrophobicContact CG-CD1 4.16Å; L160-I162 HydrophobicContact CG-CG1 4.07Å; I162-I205 WeakPolarHBondContact CA-O 3.4Å; I162-K206 HydrophobicContact CB-CG 4.41Å; I162-K206 HydrophobicContact CD1-CD 4.13Å; I162-K206 HydrophobicContact CD1-CG 4.49Å; I162-K206 HydrophobicContact CG1-CB 4.39Å; I162-K206 HydrophobicContact CG1-CD 4.13Å; I162-K206 HydrophobicContact CG1-CG 3.95Å; I162-K206 HydrophobicContact CG2-CD 4.48Å; I162-K206 HydrophobicContact CG2-CG 4.11Å
163	K	90.3	Very high	85.7	Confident	56 Å²	56	64.6 Å²	64.6	24%	0.243	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	136.9	172.6	-176.4	165.9	-179.4	175.1	0	111.2	F161 Y165 N204 I205 Y227 H231	F161-K163 HydrophobicContact CE1-CB 3.62Å; F161-K163 HydrophobicContact CE2-CB 4.49Å; F161-K163 HydrophobicContact CZ-CB 3.56Å; F161-K163 HydrophobicContact CZ-CD 4.21Å; K163-Y165 HydrophobicContact CB-CD2 4.39Å; K163-Y165 HydrophobicContact CB-CE2 3.74Å; K163-Y165 HydrophobicContact CD-CE1 4.28Å; K163-Y165 HydrophobicContact CD-CE2 4.08Å; K163-Y165 HydrophobicContact CG-CD2 4.27Å; K163-Y165 HydrophobicContact CG-CE2 3.78Å; K163-Y165 WeakPolarHBondContact O-CD2 3.11Å; K163-N204 CarbonylContact O-C 3.59Å; K163-N204 WeakPolarHBondContact O-CA 3.38Å; K163-I205 PolarHBondContact N-O 2.67Å; K163-I205 PolarHBondContact O-N 3.39Å; K163-Y227 HydrophobicContact CD-CE2 4.25Å; K163-Y227 PolarHBondContact NZ-OH 2.66Å; K163-H231 PolarHBondContact NZ-CD2 3.11Å; K163-H231 PolarHBondContact NZ-NE2 2.79Å
164	D	91.1	Very high	85.9	Confident	94 Å²	94	63.2 Å²	63.2	50%	0.503	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	124.1	172.5	-166.7	-4	0	0	0	109.8	G166 N204	D164-G166 WeakPolarHBondContact OD1-CA 3.42Å; D164-G166 PolarHBondContact OD1-N 3.39Å; D164-N204 WeakPolarHBondContact CA-OD1 3.46Å; D164-N204 VanDerWaalsContact CB-OD1 3.23Å; D164-N204 WeakPolarHBondContact CB-OD1 3.42Å; D164-N204 PolarHBondContact N-OD1 2.84Å
165	Y	88.3	Confident	86.5	Confident	32 Å²	32	62.5 Å²	62.5	13%	0.125	32%	0.324	C	S	.	.			trans	-111.2	-2.4	172.8	-68.4	-90.3	0	0	0	111.9	K163 V169 G203 I205 H231 I234 M235 L238	K163-Y165 HydrophobicContact CB-CD2 4.39Å; K163-Y165 HydrophobicContact CB-CE2 3.74Å; K163-Y165 HydrophobicContact CD-CE1 4.28Å; K163-Y165 HydrophobicContact CD-CE2 4.08Å; K163-Y165 HydrophobicContact CG-CD2 4.27Å; K163-Y165 HydrophobicContact CG-CE2 3.78Å; K163-Y165 WeakPolarHBondContact O-CD2 3.11Å; Y165-V169 WeakPolarHBondContact O-CB 3.43Å; Y165-V169 VanDerWaalsContact O-CG2 3.23Å; Y165-V169 WeakPolarHBondContact O-CG2 3.24Å; Y165-G203 PolarHBondContact N-O 3.04Å; Y165-I205 HydrophobicContact CD2-CB 4.18Å; Y165-I205 HydrophobicContact CD2-CD1 3.67Å; Y165-I205 HydrophobicContact CD2-CG1 3.93Å; Y165-I205 HydrophobicContact CE2-CB 4.1Å; Y165-I205 HydrophobicContact CE2-CD1 3.86Å; Y165-I205 HydrophobicContact CE2-CG1 4.24Å; Y165-I205 HydrophobicContact CG-CD1 4.37Å; Y165-H231 PolarHBondContact OH-CD2 3.13Å; Y165-I234 HydrophobicContact CD1-CG2 4.34Å; Y165-I234 HydrophobicContact CD2-CG2 4.38Å; Y165-I234 HydrophobicContact CE1-CG2 3.72Å; Y165-I234 HydrophobicContact CE2-CD1 3.96Å; Y165-I234 HydrophobicContact CE2-CG2 3.75Å; Y165-I234 WeakPolarHBondContact OH-CD1 3.49Å; Y165-I234 WeakPolarHBondContact OH-CG2 3.26Å; Y165-M235 HydrophobicContact CE1-SD 4.2Å; Y165-L238 HydrophobicContact CD1-CD1 4.19Å; Y165-L238 HydrophobicContact CG-CD1 4.33Å
166	G	86.8	Confident	87.5	Confident	26 Å²	26	61.7 Å²	61.7	27%	0.268	33%	0.325	S	S	.	.			trans	85.2	149.1	-177.9	0	0	0	0	0	113.7	D164 N168 V169 V170 G203	D164-G166 WeakPolarHBondContact OD1-CA 3.42Å; D164-G166 PolarHBondContact OD1-N 3.39Å; G166-N168 PolarHBondContact O-N 3.09Å; G166-V169 PolarHBondContact O-N 3.48Å; G166-V170 PolarHBondContact O-N 3.08Å; G166-V170 VanDerWaalsContact O-N 3.15Å; G166-G203 PolarHBondContact N-O 3.48Å
167	K	86.8	Confident	88.4	Confident	134 Å²	134	62.5 Å²	62.5	58%	0.583	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-22.8	-175.6	-51.9	-176.1	-168	-156.2	0	114.1	V169 K201	K167-V169 VanDerWaalsContact C-N 3.28Å; K167-K201 WeakPolarHBondContact CD-O 3.39Å; K167-K201 WeakPolarHBondContact CE-O 3.21Å; K167-K201 PolarHBondContact NZ-O 3.21Å
168	N	86.5	Confident	89.3	Confident	158 Å²	158	59.5 Å²	59.5	85%	0.845	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-17.1	178.3	-62.9	-22	0	0	0	112.4	G166	G166-N168 PolarHBondContact O-N 3.09Å
169	V	86.4	Confident	89.9	Confident	47 Å²	47	61.6 Å²	61.6	29%	0.285	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.9	-45.8	-177.8	-177.8	0	0	0	0	110.3	Y165 G166 K167 T171 L238 F239	Y165-V169 WeakPolarHBondContact O-CB 3.43Å; Y165-V169 VanDerWaalsContact O-CG2 3.23Å; Y165-V169 WeakPolarHBondContact O-CG2 3.24Å; G166-V169 PolarHBondContact O-N 3.48Å; K167-V169 VanDerWaalsContact C-N 3.28Å; V169-T171 PolarHBondContact O-N 2.76Å; V169-L238 HydrophobicContact CG1-CB 4.3Å; V169-L238 HydrophobicContact CG1-CD1 3.64Å; V169-L238 HydrophobicContact CG1-CD2 4.19Å; V169-L238 HydrophobicContact CG1-CG 4.26Å; V169-F239 HydrophobicContact CG1-CE1 4.44Å; V169-F239 HydrophobicContact CG1-CZ 3.86Å; V169-F239 HydrophobicContact CG2-CZ 4.42Å
170	V	87.1	Confident	90.4	Very high	1 Å²	1	66.9 Å²	66.9	1%	0.006	35%	0.349	C	S	.	.			trans	-87.7	84	178.6	-177.8	0	0	0	0	109.7	G166 F198 V200 G203 I205	G166-V170 PolarHBondContact O-N 3.08Å; G166-V170 VanDerWaalsContact O-N 3.15Å; V170-F198 HydrophobicContact CG1-CB 3.81Å; V170-F198 HydrophobicContact CG1-CD1 4Å; V170-F198 HydrophobicContact CG1-CG 4.4Å; V170-V200 HydrophobicContact CG1-CG2 4.44Å; V170-V200 WeakPolarHBondContact O-CA 3.49Å; V170-G203 WeakPolarHBondContact CG2-O 3.03Å; V170-I205 HydrophobicContact CG2-CD1 3.97Å; V170-I205 HydrophobicContact CG2-CG1 3.8Å
171	T	85.9	Confident	90.7	Very high	94 Å²	94	64.2 Å²	64.2	58%	0.577	34%	0.336	S	S	*	.			trans	-98	-21.1	-175.6	61.6	0	0	0	0	114	V169	V169-T171 PolarHBondContact O-N 2.76Å
172	I	88.8	Confident	90.9	Very high	101 Å²	101	64.1 Å²	64.1	52%	0.518	34%	0.336	S	S	.	.	S	Bend	trans	-150.5	157.6	-178.2	-167.7	168.3	0	0	0	109.4	K174	I172-K174 HydrophobicContact CG2-CD 4.37Å; I172-K174 HydrophobicContact CG2-CG 3.78Å; I172-K174 PolarHBondContact O-N 2.89Å
173	D	90.5	Very high	91.1	Very high	83 Å²	83	62.5 Å²	62.5	44%	0.444	33%	0.33	S	S	.	.			trans	-67.8	120.3	168.3	-168.5	-1.9	0	0	0	110.9	C175 F198	D173-C175 WeakPolarHBondContact OD1-CB 3.13Å; D173-C175 PolarHBondContact OD1-N 2.76Å; D173-F198 HydrophobicContact CB-CB 4.44Å; D173-F198 WeakPolarHBondContact OD1-CD2 3.37Å
174	K	93	Very high	91.2	Very high	67 Å²	67	66 Å²	66	29%	0.291	34%	0.342	S	S	.	.			trans	-122.3	31.3	176.8	-64.1	-171.1	173.6	-176.1	0	111.4	I172 S176 E177 L178 F198 L237	I172-K174 HydrophobicContact CG2-CD 4.37Å; I172-K174 HydrophobicContact CG2-CG 3.78Å; I172-K174 PolarHBondContact O-N 2.89Å; K174-S176 VanDerWaalsContact C-N 3.33Å; K174-S176 PolarHBondContact O-N 2.63Å; K174-E177 WeakPolarHBondContact CA-OE2 3.28Å; K174-E177 HydrophobicContact CB-CB 4.44Å; K174-E177 PolarHBondContact O-N 2.75Å; K174-L178 WeakPolarHBondContact O-CB 3.17Å; K174-L178 PolarHBondContact O-N 3.36Å; K174-F198 HydrophobicContact CB-CD1 4.49Å; K174-F198 HydrophobicContact CB-CE1 4.04Å; K174-F198 HydrophobicContact CB-CZ 4.09Å; K174-L237 HydrophobicContact CB-CD2 3.89Å; K174-L237 HydrophobicContact CD-CD1 4.31Å; K174-L237 HydrophobicContact CD-CD2 4.45Å; K174-L237 HydrophobicContact CD-CG 4.28Å
175	C	94.3	Very high	91.1	Very high	18 Å²	18	65.5 Å²	65.5	12%	0.122	33%	0.333	C	S	.	.	H	α-helix	trans	-62.7	-37.5	-174.1	-169.8	0	0	0	0	113.5	D173 L178 K179 C196 F198	D173-C175 WeakPolarHBondContact OD1-CB 3.13Å; D173-C175 PolarHBondContact OD1-N 2.76Å; C175-L178 PolarHBondContact O-N 3.18Å; C175-K179 WeakPolarHBondContact O-CG 3.4Å; C175-K179 PolarHBondContact O-N 2.84Å; C175-K179 VanDerWaalsContact O-N 3.12Å; C175-C196 WeakPolarHBondContact CA-SG 3.37Å; C175-C196 HydrophobicContact CB-CB 4.34Å; C175-C196 WeakPolarHBondContact CB-SG 3.47Å; C175-C196 WeakPolarHBondContact SG-CB 3.38Å; C175-C196 PolarHBondContact SG-O 3.27Å; C175-C196 CovalentContact SG-SG 2.03Å; C175-C196 PolarHBondContact SG-SG 3.26Å; C175-F198 HydrophobicContact CB-CD2 4.3Å; C175-F198 HydrophobicContact CB-CE2 4.25Å
176	S	93.9	Very high	91.2	Very high	77 Å²	77	64.3 Å²	64.3	54%	0.538	33%	0.328	S	S	.	.	H	α-helix	trans	-65.5	-47	177.9	-165.8	0	0	0	0	110.9	K174 L178 K179 E180	K174-S176 VanDerWaalsContact C-N 3.33Å; K174-S176 PolarHBondContact O-N 2.63Å; S176-L178 VanDerWaalsContact C-N 3.3Å; S176-L178 PolarHBondContact O-N 2.85Å; S176-K179 PolarHBondContact O-N 3.43Å; S176-E180 PolarHBondContact O-N 2.92Å
177	E	94.6	Very high	91.3	Very high	87 Å²	87	68 Å²	68	41%	0.407	35%	0.347	S	S	.	.	H	α-helix	trans	-64.4	-37.4	178.6	-60.6	87.5	158.5	0	0	111	K174 K179 E180 V181 L237	K174-E177 WeakPolarHBondContact CA-OE2 3.28Å; K174-E177 HydrophobicContact CB-CB 4.44Å; K174-E177 PolarHBondContact O-N 2.75Å; E177-K179 PolarHBondContact O-N 2.89Å; E177-E180 PolarHBondContact O-N 3.38Å; E177-V181 VanDerWaalsContact O-CG2 3.28Å; E177-V181 WeakPolarHBondContact O-CG2 3.47Å; E177-V181 PolarHBondContact O-N 3.26Å; E177-L237 HydrophobicContact CB-CD1 3.54Å
178	L	95.4	Very high	91.4	Very high	0 Å²	0	62.3 Å²	62.3	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-59.8	-46.8	173.7	-178.7	57.5	0	0	0	111.1	K174 C175 S176 E180 V181 M182 F198 I205 T207 I234 L237	K174-L178 WeakPolarHBondContact O-CB 3.17Å; K174-L178 PolarHBondContact O-N 3.36Å; C175-L178 PolarHBondContact O-N 3.18Å; S176-L178 VanDerWaalsContact C-N 3.3Å; S176-L178 PolarHBondContact O-N 2.85Å; L178-E180 VanDerWaalsContact C-N 3.3Å; L178-E180 PolarHBondContact O-N 3.27Å; L178-V181 PolarHBondContact O-N 2.99Å; L178-M182 HydrophobicContact CD1-CG 4.13Å; L178-M182 HydrophobicContact CD1-SD 4.16Å; L178-M182 HydrophobicContact CD2-SD 4.38Å; L178-M182 HydrophobicContact CG-CG 4.32Å; L178-M182 HydrophobicContact CG-SD 3.81Å; L178-M182 WeakPolarHBondContact O-CB 3.41Å; L178-M182 WeakPolarHBondContact O-CG 3.19Å; L178-M182 PolarHBondContact O-N 2.92Å; L178-F198 HydrophobicContact CB-CE2 4.24Å; L178-F198 HydrophobicContact CB-CZ 4.07Å; L178-F198 HydrophobicContact CD2-CE2 3.88Å; L178-F198 HydrophobicContact CD2-CZ 3.83Å; L178-F198 HydrophobicContact CG-CZ 4.48Å; L178-I205 HydrophobicContact CD2-CG2 4.31Å; L178-T207 HydrophobicContact CD2-CG2 4.04Å; L178-I234 HydrophobicContact CD1-CB 4.46Å; L178-I234 HydrophobicContact CD1-CG1 3.61Å; L178-I234 HydrophobicContact CD2-CG1 4.04Å; L178-L237 HydrophobicContact CB-CD2 3.71Å; L178-L237 HydrophobicContact CD1-CD2 4.04Å; L178-L237 HydrophobicContact CG-CD2 4.4Å
179	K	95.7	Very high	91.8	Very high	66 Å²	66	54.8 Å²	54.8	29%	0.287	29%	0.286	S	S	.	.	H	α-helix	trans	-62.2	-38.5	177.6	-67.4	-175.9	-168	-160.1	0	111.8	C175 S176 E177 M182 S183 G190 V193	C175-K179 WeakPolarHBondContact O-CG 3.4Å; C175-K179 PolarHBondContact O-N 2.84Å; C175-K179 VanDerWaalsContact O-N 3.12Å; S176-K179 PolarHBondContact O-N 3.43Å; E177-K179 PolarHBondContact O-N 2.89Å; K179-M182 PolarHBondContact O-N 2.71Å; K179-S183 WeakPolarHBondContact O-CB 3.49Å; K179-S183 PolarHBondContact O-N 2.85Å; K179-S183 PolarHBondContact O-OG 3.48Å; K179-G190 WeakPolarHBondContact O-CA 3.17Å; K179-V193 HydrophobicContact CD-CB 4.21Å; K179-V193 HydrophobicContact CG-CB 4.1Å; K179-V193 HydrophobicContact CG-CG1 4.45Å; K179-V193 HydrophobicContact CG-CG2 4.4Å; K179-V193 PolarHBondContact NZ-O 3.48Å
180	E	94.9	Very high	92.1	Very high	129 Å²	129	52.6 Å²	52.6	60%	0.603	27%	0.273	S	S	*	.	H	α-helix	trans	-64.5	-45.7	174.9	-71.3	179.5	-173.4	0	0	112	S176 E177 L178 S183 R184	S176-E180 PolarHBondContact O-N 2.92Å; E177-E180 PolarHBondContact O-N 3.38Å; L178-E180 VanDerWaalsContact C-N 3.3Å; L178-E180 PolarHBondContact O-N 3.27Å; E180-S183 PolarHBondContact O-N 3.47Å; E180-R184 VanDerWaalsContact O-CB 3.28Å; E180-R184 WeakPolarHBondContact O-CB 3.43Å; E180-R184 PolarHBondContact O-N 2.87Å
181	V	94.6	Very high	92.4	Very high	14 Å²	14	58.7 Å²	58.7	9%	0.085	30%	0.302	C	S	.	.	H	α-helix	trans	-62	-45.2	176.1	174.7	0	0	0	0	110.8	E177 L178 S183 R184 R185 S233 E236 L237	E177-V181 VanDerWaalsContact O-CG2 3.28Å; E177-V181 WeakPolarHBondContact O-CG2 3.47Å; E177-V181 PolarHBondContact O-N 3.26Å; L178-V181 PolarHBondContact O-N 2.99Å; V181-S183 PolarHBondContact O-N 2.81Å; V181-R184 PolarHBondContact O-N 3.44Å; V181-R185 HydrophobicContact CG1-CG 4.43Å; V181-R185 WeakPolarHBondContact O-CG 3.4Å; V181-R185 PolarHBondContact O-N 2.92Å; V181-S233 WeakPolarHBondContact CG1-O 3.43Å; V181-E236 HydrophobicContact CG1-CB 4.07Å; V181-E236 HydrophobicContact CG1-CG 4.14Å; V181-E236 WeakPolarHBondContact CG1-OE2 3.43Å; V181-L237 HydrophobicContact CG2-CB 4.38Å; V181-L237 HydrophobicContact CG2-CD1 4.17Å
182	M	94.1	Very high	92.7	Very high	0 Å²	0	55 Å²	55	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-57.3	-49.1	176.7	-74.6	172	80.6	0	0	111.5	L178 K179 R184 R185 Y186 F189 V193 M209 I230 S233	L178-M182 HydrophobicContact CD1-CG 4.13Å; L178-M182 HydrophobicContact CD1-SD 4.16Å; L178-M182 HydrophobicContact CD2-SD 4.38Å; L178-M182 HydrophobicContact CG-CG 4.32Å; L178-M182 HydrophobicContact CG-SD 3.81Å; L178-M182 WeakPolarHBondContact O-CB 3.41Å; L178-M182 WeakPolarHBondContact O-CG 3.19Å; L178-M182 PolarHBondContact O-N 2.92Å; K179-M182 PolarHBondContact O-N 2.71Å; M182-R184 VanDerWaalsContact C-N 3.31Å; M182-R184 PolarHBondContact O-N 3.36Å; M182-R185 PolarHBondContact O-N 3.39Å; M182-Y186 CarbonylContact O-C 3.48Å; M182-Y186 WeakPolarHBondContact O-CA 3.39Å; M182-Y186 PolarHBondContact O-N 3.16Å; M182-Y186 VanDerWaalsContact O-O 3.06Å; M182-F189 HydrophobicContact CB-CD1 4.05Å; M182-F189 HydrophobicContact CE-CD1 3.4Å; M182-F189 VanDerWaalsContact CE-CD1 3.4Å; M182-F189 HydrophobicContact CE-CE1 3.24Å; M182-F189 HydrophobicContact CE-CG 4.37Å; M182-F189 HydrophobicContact CE-CZ 4.11Å; M182-F189 HydrophobicContact CG-CD1 4.28Å; M182-V193 HydrophobicContact CE-CG2 3.51Å; M182-V193 HydrophobicContact SD-CG2 3.77Å; M182-M209 HydrophobicContact CE-SD 4.36Å; M182-I230 HydrophobicContact CE-CG1 4.06Å; M182-S233 VanDerWaalsContact CG-CB 3.45Å; M182-S233 WeakPolarHBondContact CG-OG 3.45Å
183	S	94.2	Very high	92.9	Very high	29 Å²	29	50.4 Å²	50.4	20%	0.203	26%	0.255	C	S	.	.	H	α-helix	trans	-69.2	-29.9	-178.8	-48.2	0	0	0	0	112.5	K179 E180 V181 Y186 P187 G190 E191	K179-S183 WeakPolarHBondContact O-CB 3.49Å; K179-S183 PolarHBondContact O-N 2.85Å; K179-S183 PolarHBondContact O-OG 3.48Å; E180-S183 PolarHBondContact O-N 3.47Å; V181-S183 PolarHBondContact O-N 2.81Å; S183-Y186 WeakPolarHBondContact CA-O 3.43Å; S183-Y186 CarbonylContact O-C 3.13Å; S183-P187 WeakPolarHBondContact O-CA 3.41Å; S183-G190 WeakPolarHBondContact OG-CA 3.5Å; S183-G190 PolarHBondContact OG-N 3.06Å; S183-G190 VanDerWaalsContact OG-N 3.16Å; S183-E191 PolarHBondContact OG-OE2 2.82Å
184	R	92.3	Very high	93	Very high	130 Å²	130	53.2 Å²	53.2	49%	0.491	26%	0.263	S	S	.	.	H	α-helix	trans	-71.6	-42.5	174.7	178	172.3	55.4	103.7	1.9	112.2	E180 V181 M182 E236	E180-R184 VanDerWaalsContact O-CB 3.28Å; E180-R184 WeakPolarHBondContact O-CB 3.43Å; E180-R184 PolarHBondContact O-N 2.87Å; V181-R184 PolarHBondContact O-N 3.44Å; M182-R184 VanDerWaalsContact C-N 3.31Å; M182-R184 PolarHBondContact O-N 3.36Å; R184-E236 IonicContact CZ-OE1 3.57Å; R184-E236 IonicContact NH1-OE1 2.84Å; R184-E236 PolarHBondContact NH1-OE1 3.34Å; R184-E236 IonicContact NH2-OE1 3.72Å; R184-E236 PolarHBondContact NH2-OE1 3.09Å; R184-E236 IonicContact NH2-OE2 3.58Å
185	R	90	Very high	92.9	Very high	83 Å²	83	52.6 Å²	52.6	31%	0.313	27%	0.267	S	S	.	.	H	α-helix	trans	-73.5	-41	176.9	-68.5	-171.9	86.5	101.5	-5.4	111.7	V181 M182 E236	V181-R185 HydrophobicContact CG1-CG 4.43Å; V181-R185 WeakPolarHBondContact O-CG 3.4Å; V181-R185 PolarHBondContact O-N 2.92Å; M182-R185 PolarHBondContact O-N 3.39Å; R185-E236 WeakPolarHBondContact CD-OE2 3.45Å; R185-E236 VanDerWaalsContact CG-OE2 3.26Å; R185-E236 WeakPolarHBondContact CG-OE2 3.4Å; R185-E236 IonicContact CZ-OE2 3.35Å; R185-E236 IonicContact NE-OE2 2.75Å; R185-E236 VanDerWaalsContact NH1-CD 3.34Å; R185-E236 IonicContact NH1-OE2 2.67Å; R185-E236 PolarHBondContact NH1-OE2 2.91Å
186	Y	90.2	Very high	92.9	Very high	7 Å²	7	52.7 Å²	52.7	3%	0.027	27%	0.268	C	S	.	.	S	Bend	trans	-132.4	101.1	-173.4	-51.2	-70.7	0	0	0	108.5	L62 M182 S183 G188 F189 R229	L62-Y186 HydrophobicContact CB-CE1 4.47Å; L62-Y186 HydrophobicContact CD1-CE1 4.46Å; M182-Y186 CarbonylContact O-C 3.48Å; M182-Y186 WeakPolarHBondContact O-CA 3.39Å; M182-Y186 PolarHBondContact O-N 3.16Å; M182-Y186 VanDerWaalsContact O-O 3.06Å; S183-Y186 WeakPolarHBondContact CA-O 3.43Å; S183-Y186 CarbonylContact O-C 3.13Å; Y186-G188 PolarHBondContact O-N 2.73Å; Y186-F189 HydrophobicContact CD2-CD1 4.08Å; Y186-F189 WeakPolarHBondContact O-CB 3.24Å; Y186-F189 PolarHBondContact O-N 3.15Å; Y186-R229 HydrophobicContact CD1-CG 4.07Å; Y186-R229 HydrophobicContact CD2-CB 3.85Å; Y186-R229 HydrophobicContact CD2-CG 4.08Å; Y186-R229 HydrophobicContact CE1-CG 3.88Å; Y186-R229 HydrophobicContact CE2-CB 3.65Å; Y186-R229 HydrophobicContact CE2-CG 3.89Å; Y186-R229 WeakPolarHBondContact CE2-O 3.43Å; Y186-R229 HydrophobicContact CG-CB 4.4Å; Y186-R229 HydrophobicContact CG-CG 4.17Å
187	P	88.5	Confident	92.8	Very high	103 Å²	103	54.1 Å²	54.1	67%	0.669	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.8	129.1	-175.2	-29.1	35.7	0	0	0	112.5	S183 F189 Y219	S183-P187 WeakPolarHBondContact O-CA 3.41Å; P187-F189 PolarHBondContact O-N 2.95Å; P187-Y219 PolarHBondContact O-OH 3.28Å
188	G	89.5	Confident	92.7	Very high	14 Å²	14	50.2 Å²	50.2	14%	0.144	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.9	-3.8	178.9	0	0	0	0	0	115.5	Y186 E191 L192	Y186-G188 PolarHBondContact O-N 2.73Å; G188-E191 WeakPolarHBondContact CA-OE2 3.23Å; G188-E191 VanDerWaalsContact O-OE2 3.07Å; G188-L192 WeakPolarHBondContact O-CG 3.48Å
189	F	93	Very high	92.5	Very high	0 Å²	0	52 Å²	52	0%	0	26%	0.256	C	S	.	.	S	Bend	trans	-79.3	-37.8	-171	-168.7	-120.3	0	0	0	113.4	M182 Y186 P187 E191 L192 M209 L214 Y219 I226 R229 I230	M182-F189 HydrophobicContact CB-CD1 4.05Å; M182-F189 HydrophobicContact CE-CD1 3.4Å; M182-F189 VanDerWaalsContact CE-CD1 3.4Å; M182-F189 HydrophobicContact CE-CE1 3.24Å; M182-F189 HydrophobicContact CE-CG 4.37Å; M182-F189 HydrophobicContact CE-CZ 4.11Å; M182-F189 HydrophobicContact CG-CD1 4.28Å; Y186-F189 HydrophobicContact CD2-CD1 4.08Å; Y186-F189 WeakPolarHBondContact O-CB 3.24Å; Y186-F189 PolarHBondContact O-N 3.15Å; P187-F189 PolarHBondContact O-N 2.95Å; F189-E191 VanDerWaalsContact C-N 3.32Å; F189-E191 PolarHBondContact N-OE2 3.28Å; F189-E191 PolarHBondContact O-N 3.49Å; F189-L192 HydrophobicContact CD2-CD1 4.25Å; F189-L192 WeakPolarHBondContact O-CB 3.35Å; F189-L192 PolarHBondContact O-N 3.4Å; F189-M209 HydrophobicContact CE2-CE 4.49Å; F189-M209 HydrophobicContact CE2-SD 4.22Å; F189-M209 HydrophobicContact CZ-CE 4.08Å; F189-M209 HydrophobicContact CZ-SD 4.15Å; F189-L214 HydrophobicContact CD2-CD2 4.08Å; F189-L214 HydrophobicContact CE2-CD2 3.58Å; F189-Y219 HydrophobicContact CB-CE2 4.1Å; F189-Y219 HydrophobicContact CD2-CD1 4.2Å; F189-Y219 AromaticContact CD2-CD2 3.79Å; F189-Y219 HydrophobicContact CD2-CD2 3.79Å; F189-Y219 HydrophobicContact CD2-CE1 4.22Å; F189-Y219 AromaticContact CD2-CE2 3.82Å; F189-Y219 HydrophobicContact CD2-CE2 3.82Å; F189-Y219 AromaticContact CD2-CG 3.99Å; F189-Y219 HydrophobicContact CD2-CG 3.99Å; F189-Y219 HydrophobicContact CE2-CD1 4.45Å; F189-Y219 HydrophobicContact CE2-CD2 4.44Å; F189-Y219 HydrophobicContact CE2-CG 4.25Å; F189-Y219 HydrophobicContact CG-CE2 4.42Å; F189-I226 HydrophobicContact CZ-CG2 4.28Å; F189-R229 HydrophobicContact CD1-CB 4.12Å; F189-R229 HydrophobicContact CE1-CB 3.39Å; F189-R229 HydrophobicContact CE1-CG 4.48Å; F189-R229 HydrophobicContact CE2-CB 4.44Å; F189-R229 HydrophobicContact CZ-CB 3.6Å; F189-R229 HydrophobicContact CZ-CG 4.45Å; F189-I230 HydrophobicContact CE1-CG1 4.02Å; F189-I230 HydrophobicContact CZ-CG1 4.07Å
190	G	93.3	Very high	92.1	Very high	1 Å²	1	52 Å²	52	1%	0.01	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-71.7	-28.2	179.7	0	0	0	0	0	112.9	K179 S183 L192 V193	K179-G190 WeakPolarHBondContact O-CA 3.17Å; S183-G190 WeakPolarHBondContact OG-CA 3.5Å; S183-G190 PolarHBondContact OG-N 3.06Å; S183-G190 VanDerWaalsContact OG-N 3.16Å; G190-L192 PolarHBondContact O-N 2.9Å; G190-V193 WeakPolarHBondContact O-CB 3.48Å; G190-V193 PolarHBondContact O-N 3.34Å
191	E	93.1	Very high	91.8	Very high	130 Å²	130	54.1 Å²	54.1	61%	0.607	27%	0.268	S	S	*	.	G	3₁₀ helix	trans	-64.2	-21.3	174.2	-60.7	93.1	150.9	0	0	112.7	S183 G188 F189 V193	S183-E191 PolarHBondContact OG-OE2 2.82Å; G188-E191 WeakPolarHBondContact CA-OE2 3.23Å; G188-E191 VanDerWaalsContact O-OE2 3.07Å; F189-E191 VanDerWaalsContact C-N 3.32Å; F189-E191 PolarHBondContact N-OE2 3.28Å; F189-E191 PolarHBondContact O-N 3.49Å; E191-V193 VanDerWaalsContact C-N 3.31Å
192	L	93.5	Very high	91.6	Very high	16 Å²	16	55 Å²	55	8%	0.084	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-80.6	-12.2	179.6	-62.7	169.3	0	0	0	113.6	G188 F189 G190 K194 M209 E213 L214 K217 Y219	G188-L192 WeakPolarHBondContact O-CG 3.48Å; F189-L192 HydrophobicContact CD2-CD1 4.25Å; F189-L192 WeakPolarHBondContact O-CB 3.35Å; F189-L192 PolarHBondContact O-N 3.4Å; G190-L192 PolarHBondContact O-N 2.9Å; L192-K194 PolarHBondContact O-N 3.43Å; L192-M209 HydrophobicContact CB-SD 4.42Å; L192-M209 WeakPolarHBondContact O-CG 3.49Å; L192-E213 HydrophobicContact CD2-CB 3.72Å; L192-E213 WeakPolarHBondContact CD2-O 3.32Å; L192-L214 HydrophobicContact CB-CD2 4.47Å; L192-L214 HydrophobicContact CD1-CD2 3.66Å; L192-L214 HydrophobicContact CD1-CG 4.2Å; L192-K217 HydrophobicContact CD1-CB 3.85Å; L192-K217 HydrophobicContact CD1-CG 3.97Å; L192-K217 HydrophobicContact CD2-CB 4.38Å; L192-K217 HydrophobicContact CD2-CG 3.72Å; L192-K217 HydrophobicContact CG-CG 4.16Å; L192-Y219 HydrophobicContact CD1-CD2 3.95Å; L192-Y219 HydrophobicContact CD1-CE2 4.33Å
193	V	93.5	Very high	91.4	Very high	4 Å²	4	55 Å²	55	2%	0.024	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	100.7	179.2	-177.2	0	0	0	0	109.7	K179 M182 G190 E191 S195 C196 M209	K179-V193 HydrophobicContact CD-CB 4.21Å; K179-V193 HydrophobicContact CG-CB 4.1Å; K179-V193 HydrophobicContact CG-CG1 4.45Å; K179-V193 HydrophobicContact CG-CG2 4.4Å; K179-V193 PolarHBondContact NZ-O 3.48Å; M182-V193 HydrophobicContact CE-CG2 3.51Å; M182-V193 HydrophobicContact SD-CG2 3.77Å; G190-V193 WeakPolarHBondContact O-CB 3.48Å; G190-V193 PolarHBondContact O-N 3.34Å; E191-V193 VanDerWaalsContact C-N 3.31Å; V193-S195 WeakPolarHBondContact CG1-O 3.38Å; V193-C196 HydrophobicContact CG1-CB 3.51Å; V193-M209 HydrophobicContact CG2-CG 4.19Å; V193-M209 HydrophobicContact CG2-SD 4.1Å
194	K	91.7	Very high	91.3	Very high	142 Å²	142	55.2 Å²	55.2	62%	0.617	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.4	-50.9	178.1	178	-175.1	167.4	-158.7	0	111	L192 E208	L192-K194 PolarHBondContact O-N 3.43Å; K194-E208 WeakPolarHBondContact CB-O 3.42Å; K194-E208 PolarHBondContact N-O 3.46Å; K194-E208 IonicContact NZ-OE1 2.82Å; K194-E208 PolarHBondContact NZ-OE1 3.46Å; K194-E208 IonicContact NZ-OE2 3.92Å
195	S	91.6	Very high	91.3	Very high	54 Å²	54	49 Å²	49	38%	0.378	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	145.2	175.9	75.5	0	0	0	0	109.7	V193 T207 E208	V193-S195 WeakPolarHBondContact CG1-O 3.38Å; S195-T207 CarbonylContact O-C 3.52Å; S195-T207 WeakPolarHBondContact O-CA 3.48Å; S195-E208 PolarHBondContact N-O 3.23Å; S195-E208 PolarHBondContact O-N 3.22Å; S195-E208 WeakPolarHBondContact OG-CB 3.36Å; S195-E208 PolarHBondContact OG-OE2 2.93Å
196	C	93.7	Very high	91.5	Very high	21 Å²	21	48.6 Å²	48.6	14%	0.142	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	142.7	173.8	128.6	0	0	0	0	109.8	C175 V193 K206 T207	C175-C196 WeakPolarHBondContact CA-SG 3.37Å; C175-C196 HydrophobicContact CB-CB 4.34Å; C175-C196 WeakPolarHBondContact CB-SG 3.47Å; C175-C196 WeakPolarHBondContact SG-CB 3.38Å; C175-C196 PolarHBondContact SG-O 3.27Å; C175-C196 CovalentContact SG-SG 2.03Å; C175-C196 PolarHBondContact SG-SG 3.26Å; V193-C196 HydrophobicContact CG1-CB 3.51Å; C196-K206 CarbonylContact C-O 3.47Å; C196-K206 WeakPolarHBondContact CA-O 3.4Å; C196-T207 HydrophobicContact CB-CG2 4.02Å
197	F	91.9	Very high	91.6	Very high	106 Å²	106	48.3 Å²	48.3	47%	0.465	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	127.4	-168.3	-175	-109.5	0	0	0	110.6	D199 I205 K206	F197-D199 HydrophobicContact CD1-CB 3.89Å; F197-D199 HydrophobicContact CE1-CB 3.44Å; F197-D199 VanDerWaalsContact CE1-CB 3.44Å; F197-D199 HydrophobicContact CZ-CB 4.39Å; F197-I205 WeakPolarHBondContact O-CA 3.45Å; F197-K206 HydrophobicContact CB-CB 4.41Å; F197-K206 PolarHBondContact N-O 3.41Å; F197-K206 PolarHBondContact O-N 3Å
198	F	93.2	Very high	91.8	Very high	6 Å²	6	45.6 Å²	45.6	3%	0.026	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	99.4	173.7	-76.1	-114.1	0	0	0	107.6	V170 D173 K174 C175 L178 V200 I205 L237	V170-F198 HydrophobicContact CG1-CB 3.81Å; V170-F198 HydrophobicContact CG1-CD1 4Å; V170-F198 HydrophobicContact CG1-CG 4.4Å; D173-F198 HydrophobicContact CB-CB 4.44Å; D173-F198 WeakPolarHBondContact OD1-CD2 3.37Å; K174-F198 HydrophobicContact CB-CD1 4.49Å; K174-F198 HydrophobicContact CB-CE1 4.04Å; K174-F198 HydrophobicContact CB-CZ 4.09Å; C175-F198 HydrophobicContact CB-CD2 4.3Å; C175-F198 HydrophobicContact CB-CE2 4.25Å; L178-F198 HydrophobicContact CB-CE2 4.24Å; L178-F198 HydrophobicContact CB-CZ 4.07Å; L178-F198 HydrophobicContact CD2-CE2 3.88Å; L178-F198 HydrophobicContact CD2-CZ 3.83Å; L178-F198 HydrophobicContact CG-CZ 4.48Å; F198-V200 PolarHBondContact O-N 3.09Å; F198-V200 VanDerWaalsContact O-N 3.1Å; F198-I205 HydrophobicContact CD1-CD1 3.75Å; F198-I205 HydrophobicContact CD1-CG1 3.68Å; F198-I205 HydrophobicContact CD2-CG2 4.38Å; F198-I205 HydrophobicContact CE1-CD1 3.36Å; F198-I205 HydrophobicContact CE1-CG1 3.76Å; F198-I205 HydrophobicContact CE1-CG2 4.32Å; F198-I205 HydrophobicContact CE2-CG2 4.05Å; F198-I205 HydrophobicContact CG-CG1 4.19Å; F198-I205 HydrophobicContact CZ-CD1 3.99Å; F198-I205 HydrophobicContact CZ-CG1 4.33Å; F198-I205 HydrophobicContact CZ-CG2 4.02Å; F198-L237 HydrophobicContact CE1-CD2 4.16Å; F198-L237 HydrophobicContact CZ-CD2 3.81Å
199	D	90.5	Very high	92	Very high	37 Å²	37	44.9 Å²	44.9	20%	0.198	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	91.4	178.8	-171.8	-11.1	0	0	0	110.6	F197 K201 S202 G203 N204	F197-D199 HydrophobicContact CD1-CB 3.89Å; F197-D199 HydrophobicContact CE1-CB 3.44Å; F197-D199 VanDerWaalsContact CE1-CB 3.44Å; F197-D199 HydrophobicContact CZ-CB 4.39Å; D199-K201 PolarHBondContact O-N 3.1Å; D199-K201 VanDerWaalsContact O-N 3.16Å; D199-K201 WeakPolarHBondContact OD1-CB 3.39Å; D199-K201 PolarHBondContact OD1-N 3.44Å; D199-S202 VanDerWaalsContact CB-OG 3.24Å; D199-S202 WeakPolarHBondContact CB-OG 3.28Å; D199-S202 PolarHBondContact O-N 3.39Å; D199-S202 PolarHBondContact OD1-N 3.22Å; D199-S202 WeakPolarHBondContact OD2-CB 3.46Å; D199-S202 PolarHBondContact OD2-OG 2.84Å; D199-G203 WeakPolarHBondContact O-CA 3.19Å; D199-G203 PolarHBondContact O-N 2.64Å; D199-N204 HydrophobicContact CB-CB 4.25Å; D199-N204 PolarHBondContact N-O 2.83Å; D199-N204 PolarHBondContact O-N 2.91Å
200	V	87.6	Confident	91.8	Very high	65 Å²	65	47.8 Å²	47.8	39%	0.394	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-29.5	177.9	-180	0	0	0	0	112.5	V170 F198	V170-V200 HydrophobicContact CG1-CG2 4.44Å; V170-V200 WeakPolarHBondContact O-CA 3.49Å; F198-V200 PolarHBondContact O-N 3.09Å; F198-V200 VanDerWaalsContact O-N 3.1Å
201	K	88.5	Confident	91.5	Very high	174 Å²	174	47.8 Å²	47.8	76%	0.757	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-37.1	-178	-68.3	-177.4	179.7	177.8	0	112.3	K167 D199	K167-K201 WeakPolarHBondContact CD-O 3.39Å; K167-K201 WeakPolarHBondContact CE-O 3.21Å; K167-K201 PolarHBondContact NZ-O 3.21Å; D199-K201 PolarHBondContact O-N 3.1Å; D199-K201 VanDerWaalsContact O-N 3.16Å; D199-K201 WeakPolarHBondContact OD1-CB 3.39Å; D199-K201 PolarHBondContact OD1-N 3.44Å
202	S	89.7	Confident	91.3	Very high	32 Å²	32	43.6 Å²	43.6	22%	0.224	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.8	-25.7	-179.3	63.8	0	0	0	0	113.3	D199 N204	D199-S202 VanDerWaalsContact CB-OG 3.24Å; D199-S202 WeakPolarHBondContact CB-OG 3.28Å; D199-S202 PolarHBondContact O-N 3.39Å; D199-S202 PolarHBondContact OD1-N 3.22Å; D199-S202 WeakPolarHBondContact OD2-CB 3.46Å; D199-S202 PolarHBondContact OD2-OG 2.84Å; S202-N204 VanDerWaalsContact CB-ND2 3.31Å; S202-N204 WeakPolarHBondContact CB-ND2 3.37Å; S202-N204 WeakPolarHBondContact OG-CB 3.23Å; S202-N204 PolarHBondContact OG-N 3.19Å; S202-N204 PolarHBondContact OG-ND2 3.04Å
203	G	89.7	Confident	91.1	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	89.7	4.9	-169.4	0	0	0	0	0	113.3	Y165 G166 V170 D199	Y165-G203 PolarHBondContact N-O 3.04Å; G166-G203 PolarHBondContact N-O 3.48Å; V170-G203 WeakPolarHBondContact CG2-O 3.03Å; D199-G203 WeakPolarHBondContact O-CA 3.19Å; D199-G203 PolarHBondContact O-N 2.64Å
204	N	91.8	Very high	91	Very high	35 Å²	35	46.5 Å²	46.5	19%	0.187	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	140.1	-175	-70.7	-52.2	0	0	0	112.7	K163 D164 D199 S202	K163-N204 CarbonylContact O-C 3.59Å; K163-N204 WeakPolarHBondContact O-CA 3.38Å; D164-N204 WeakPolarHBondContact CA-OD1 3.46Å; D164-N204 VanDerWaalsContact CB-OD1 3.23Å; D164-N204 WeakPolarHBondContact CB-OD1 3.42Å; D164-N204 PolarHBondContact N-OD1 2.84Å; D199-N204 HydrophobicContact CB-CB 4.25Å; D199-N204 PolarHBondContact N-O 2.83Å; D199-N204 PolarHBondContact O-N 2.91Å; S202-N204 VanDerWaalsContact CB-ND2 3.31Å; S202-N204 WeakPolarHBondContact CB-ND2 3.37Å; S202-N204 WeakPolarHBondContact OG-CB 3.23Å; S202-N204 PolarHBondContact OG-N 3.19Å; S202-N204 PolarHBondContact OG-ND2 3.04Å
205	I	92.4	Very high	90.9	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	129.4	163.8	-60.2	173	0	0	0	108.1	I162 K163 Y165 V170 L178 F197 F198 I234 L238	I162-I205 WeakPolarHBondContact CA-O 3.4Å; K163-I205 PolarHBondContact N-O 2.67Å; K163-I205 PolarHBondContact O-N 3.39Å; Y165-I205 HydrophobicContact CD2-CB 4.18Å; Y165-I205 HydrophobicContact CD2-CD1 3.67Å; Y165-I205 HydrophobicContact CD2-CG1 3.93Å; Y165-I205 HydrophobicContact CE2-CB 4.1Å; Y165-I205 HydrophobicContact CE2-CD1 3.86Å; Y165-I205 HydrophobicContact CE2-CG1 4.24Å; Y165-I205 HydrophobicContact CG-CD1 4.37Å; V170-I205 HydrophobicContact CG2-CD1 3.97Å; V170-I205 HydrophobicContact CG2-CG1 3.8Å; L178-I205 HydrophobicContact CD2-CG2 4.31Å; F197-I205 WeakPolarHBondContact O-CA 3.45Å; F198-I205 HydrophobicContact CD1-CD1 3.75Å; F198-I205 HydrophobicContact CD1-CG1 3.68Å; F198-I205 HydrophobicContact CD2-CG2 4.38Å; F198-I205 HydrophobicContact CE1-CD1 3.36Å; F198-I205 HydrophobicContact CE1-CG1 3.76Å; F198-I205 HydrophobicContact CE1-CG2 4.32Å; F198-I205 HydrophobicContact CE2-CG2 4.05Å; F198-I205 HydrophobicContact CG-CG1 4.19Å; F198-I205 HydrophobicContact CZ-CD1 3.99Å; F198-I205 HydrophobicContact CZ-CG1 4.33Å; F198-I205 HydrophobicContact CZ-CG2 4.02Å; I205-I234 HydrophobicContact CB-CD1 4.22Å; I205-I234 HydrophobicContact CD1-CD1 4.31Å; I205-I234 HydrophobicContact CD1-CG1 4.45Å; I205-I234 HydrophobicContact CD1-CG2 3.61Å; I205-I234 HydrophobicContact CG2-CD1 3.76Å; I205-I234 HydrophobicContact CG2-CG1 4.45Å; I205-L238 HydrophobicContact CD1-CD1 4.02Å
206	K	93.7	Very high	90.9	Very high	74 Å²	74	41.8 Å²	41.8	32%	0.322	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	137.6	179.4	-53.1	-171	178.3	175.6	0	110.4	F161 I162 C196 F197	F161-K206 CarbonylContact O-C 3.55Å; F161-K206 WeakPolarHBondContact O-CA 3.49Å; I162-K206 HydrophobicContact CB-CG 4.41Å; I162-K206 HydrophobicContact CD1-CD 4.13Å; I162-K206 HydrophobicContact CD1-CG 4.49Å; I162-K206 HydrophobicContact CG1-CB 4.39Å; I162-K206 HydrophobicContact CG1-CD 4.13Å; I162-K206 HydrophobicContact CG1-CG 3.95Å; I162-K206 HydrophobicContact CG2-CD 4.48Å; I162-K206 HydrophobicContact CG2-CG 4.11Å; C196-K206 CarbonylContact C-O 3.47Å; C196-K206 WeakPolarHBondContact CA-O 3.4Å; F197-K206 HydrophobicContact CB-CB 4.41Å; F197-K206 PolarHBondContact N-O 3.41Å; F197-K206 PolarHBondContact O-N 3Å
207	T	93.4	Very high	90.7	Very high	1 Å²	1	46.8 Å²	46.8	1%	0.006	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	136.1	170.7	73.3	0	0	0	0	110.2	F161 L178 S195 C196 I230	F161-T207 WeakPolarHBondContact CB-OG1 3.01Å; F161-T207 PolarHBondContact N-O 3.39Å; F161-T207 PolarHBondContact O-N 3.49Å; L178-T207 HydrophobicContact CD2-CG2 4.04Å; S195-T207 CarbonylContact O-C 3.52Å; S195-T207 WeakPolarHBondContact O-CA 3.48Å; C196-T207 HydrophobicContact CB-CG2 4.02Å; T207-I230 HydrophobicContact CG2-CG2 4.3Å
208	E	93.3	Very high	90.6	Very high	45 Å²	45	43.4 Å²	43.4	21%	0.21	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	131.7	173.6	-170.2	-164	164.8	0	0	109.1	Y159 K194 S195	Y159-E208 WeakPolarHBondContact O-CA 3.28Å; K194-E208 WeakPolarHBondContact CB-O 3.42Å; K194-E208 PolarHBondContact N-O 3.46Å; K194-E208 IonicContact NZ-OE1 2.82Å; K194-E208 PolarHBondContact NZ-OE1 3.46Å; K194-E208 IonicContact NZ-OE2 3.92Å; S195-E208 PolarHBondContact N-O 3.23Å; S195-E208 PolarHBondContact O-N 3.22Å; S195-E208 WeakPolarHBondContact OG-CB 3.36Å; S195-E208 PolarHBondContact OG-OE2 2.93Å
209	M	92.2	Very high	90.4	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	145	175.7	-66.6	-179.4	-72	0	0	109.4	S158 Y159 M182 F189 L192 V193 L214 I226 I230	S158-M209 CarbonylContact C-O 3.51Å; S158-M209 VanDerWaalsContact CA-O 3.26Å; S158-M209 WeakPolarHBondContact CA-O 3.3Å; S158-M209 WeakPolarHBondContact CB-O 3.49Å; Y159-M209 HydrophobicContact CD1-CE 3.87Å; Y159-M209 HydrophobicContact CE1-CE 4.4Å; Y159-M209 PolarHBondContact N-O 3.13Å; Y159-M209 PolarHBondContact O-N 3.06Å; M182-M209 HydrophobicContact CE-SD 4.36Å; F189-M209 HydrophobicContact CE2-CE 4.49Å; F189-M209 HydrophobicContact CE2-SD 4.22Å; F189-M209 HydrophobicContact CZ-CE 4.08Å; F189-M209 HydrophobicContact CZ-SD 4.15Å; L192-M209 HydrophobicContact CB-SD 4.42Å; L192-M209 WeakPolarHBondContact O-CG 3.49Å; V193-M209 HydrophobicContact CG2-CG 4.19Å; V193-M209 HydrophobicContact CG2-SD 4.1Å; M209-L214 HydrophobicContact CB-CD1 3.62Å; M209-L214 HydrophobicContact CB-CG 4.13Å; M209-L214 HydrophobicContact CE-CD1 4.3Å; M209-L214 HydrophobicContact CE-CD2 4.47Å; M209-L214 HydrophobicContact SD-CD1 4.37Å; M209-L214 HydrophobicContact SD-CD2 4Å; M209-L214 HydrophobicContact SD-CG 4.48Å; M209-I226 HydrophobicContact CE-CG2 3.71Å; M209-I230 HydrophobicContact CE-CD1 3.43Å; M209-I230 VanDerWaalsContact CE-CD1 3.43Å; M209-I230 HydrophobicContact CE-CG1 3.94Å
210	N	88.8	Confident	90.2	Very high	60 Å²	60	42.3 Å²	42.3	32%	0.321	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	130.8	173	179.3	-78.3	0	0	0	109.4	E157 L212 E213 L214	E157-N210 PolarHBondContact O-ND2 2.92Å; N210-L212 WeakPolarHBondContact OD1-CA 3.44Å; N210-L212 VanDerWaalsContact OD1-CB 3.24Å; N210-L212 WeakPolarHBondContact OD1-CB 3.36Å; N210-L212 PolarHBondContact OD1-N 3.02Å; N210-E213 HydrophobicContact CB-CB 4.28Å; N210-E213 HydrophobicContact CB-CG 4.18Å; N210-E213 PolarHBondContact O-N 3.46Å; N210-E213 PolarHBondContact OD1-N 3.34Å; N210-E213 VanDerWaalsContact OD1-N 3.1Å; N210-L214 PolarHBondContact O-N 3.39Å
211	Y	87.4	Confident	90	Very high	1 Å²	1	39.8 Å²	39.8	0%	0.004	20%	0.196	C	C	.	.	H	α-helix	trans	-69.7	-36.3	-174.3	-169	-80.3	0	0	0	112.5	I37 L154 E157 E213 L214 M215 C221	I37-Y211 HydrophobicContact CD1-CD1 3.63Å; I37-Y211 HydrophobicContact CD1-CE1 4.07Å; I37-Y211 HydrophobicContact CG2-CE1 4.37Å; L154-Y211 HydrophobicContact CD2-CD1 3.44Å; L154-Y211 VanDerWaalsContact CD2-CD1 3.44Å; L154-Y211 HydrophobicContact CD2-CD2 4.17Å; L154-Y211 HydrophobicContact CD2-CE1 2.95Å; L154-Y211 HydrophobicContact CD2-CE2 3.72Å; L154-Y211 HydrophobicContact CD2-CG 4.02Å; L154-Y211 VanDerWaalsContact CD2-OH 3.23Å; L154-Y211 WeakPolarHBondContact CD2-OH 3.26Å; L154-Y211 HydrophobicContact CG-CE1 4.45Å; E157-Y211 PolarHBondContact O-N 3.45Å; Y211-E213 VanDerWaalsContact C-N 3.33Å; Y211-E213 PolarHBondContact O-N 3.25Å; Y211-L214 WeakPolarHBondContact O-CB 3.36Å; Y211-L214 PolarHBondContact O-N 3.31Å; Y211-M215 HydrophobicContact CE1-CB 4.32Å; Y211-M215 WeakPolarHBondContact O-CB 3.36Å; Y211-M215 PolarHBondContact O-N 2.86Å; Y211-C221 WeakPolarHBondContact OH-CA 3.4Å; Y211-C221 PolarHBondContact OH-N 2.89Å
212	L	88.2	Confident	89.7	Confident	43 Å²	43	32.2 Å²	32.2	23%	0.225	16%	0.164	C	C	.	.	H	α-helix	trans	-61.8	-41.9	176.1	175	64.9	0	0	0	111.4	I37 L109 N210 M215 K216	I37-L212 HydrophobicContact CD1-CB 4.11Å; I37-L212 HydrophobicContact CD1-CD1 3.98Å; I37-L212 HydrophobicContact CG1-CD1 4.12Å; L109-L212 HydrophobicContact CD2-CD1 3.69Å; N210-L212 WeakPolarHBondContact OD1-CA 3.44Å; N210-L212 VanDerWaalsContact OD1-CB 3.24Å; N210-L212 WeakPolarHBondContact OD1-CB 3.36Å; N210-L212 PolarHBondContact OD1-N 3.02Å; L212-M215 HydrophobicContact CD1-CE 3.9Å; L212-M215 PolarHBondContact O-N 3.3Å; L212-K216 HydrophobicContact CG-CD 4.39Å; L212-K216 VanDerWaalsContact O-CG 3.3Å; L212-K216 WeakPolarHBondContact O-CG 3.38Å; L212-K216 PolarHBondContact O-N 2.9Å
213	E	90.7	Very high	89.5	Confident	81 Å²	81	32.9 Å²	32.9	38%	0.379	17%	0.166	S	C	.	.	H	α-helix	trans	-70.3	-37.3	177.6	-63.5	-57.5	127.9	0	0	112.4	L192 N210 Y211 K216 K217	L192-E213 HydrophobicContact CD2-CB 3.72Å; L192-E213 WeakPolarHBondContact CD2-O 3.32Å; N210-E213 HydrophobicContact CB-CB 4.28Å; N210-E213 HydrophobicContact CB-CG 4.18Å; N210-E213 PolarHBondContact O-N 3.46Å; N210-E213 PolarHBondContact OD1-N 3.34Å; N210-E213 VanDerWaalsContact OD1-N 3.1Å; Y211-E213 VanDerWaalsContact C-N 3.33Å; Y211-E213 PolarHBondContact O-N 3.25Å; E213-K216 PolarHBondContact O-N 3.24Å; E213-K216 IonicContact OE1-NZ 2.81Å; E213-K216 PolarHBondContact OE1-NZ 3.01Å; E213-K217 PolarHBondContact O-N 3.04Å; E213-K217 VanDerWaalsContact O-N 3.11Å
214	L	91.1	Very high	89.3	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-56.7	-51.4	169.7	-83.4	163.7	0	0	0	111.7	F189 L192 M209 N210 Y211 K216 K217 G218 Y219 I226	F189-L214 HydrophobicContact CD2-CD2 4.08Å; F189-L214 HydrophobicContact CE2-CD2 3.58Å; L192-L214 HydrophobicContact CB-CD2 4.47Å; L192-L214 HydrophobicContact CD1-CD2 3.66Å; L192-L214 HydrophobicContact CD1-CG 4.2Å; M209-L214 HydrophobicContact CB-CD1 3.62Å; M209-L214 HydrophobicContact CB-CG 4.13Å; M209-L214 HydrophobicContact CE-CD1 4.3Å; M209-L214 HydrophobicContact CE-CD2 4.47Å; M209-L214 HydrophobicContact SD-CD1 4.37Å; M209-L214 HydrophobicContact SD-CD2 4Å; M209-L214 HydrophobicContact SD-CG 4.48Å; N210-L214 PolarHBondContact O-N 3.39Å; Y211-L214 WeakPolarHBondContact O-CB 3.36Å; Y211-L214 PolarHBondContact O-N 3.31Å; L214-K216 PolarHBondContact O-N 3.26Å; L214-K217 PolarHBondContact O-N 3.23Å; L214-K217 VanDerWaalsContact O-N 3.14Å; L214-G218 PolarHBondContact O-N 2.98Å; L214-Y219 CarbonylContact C-O 3.59Å; L214-Y219 WeakPolarHBondContact CB-O 3.21Å; L214-Y219 PolarHBondContact O-N 2.84Å; L214-I226 HydrophobicContact CD1-CD1 4.35Å
215	M	90.2	Very high	89.1	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-60.2	-47.8	179.4	-176.2	-74.3	-71.3	0	0	110.9	I37 T87 S89 A107 L109 Y211 L212 K217 G218 Y219 C220	I37-M215 HydrophobicContact CD1-CE 4.36Å; I37-M215 HydrophobicContact CG1-CE 4.16Å; T87-M215 HydrophobicContact CG2-CE 4.14Å; T87-M215 HydrophobicContact CG2-SD 3.73Å; S89-M215 VanDerWaalsContact CB-O 3.26Å; S89-M215 WeakPolarHBondContact CB-O 3.08Å; S89-M215 PolarHBondContact OG-O 2.83Å; A107-M215 HydrophobicContact CB-CG 3.8Å; L109-M215 HydrophobicContact CD1-CE 3.96Å; L109-M215 HydrophobicContact CD2-CE 3.27Å; L109-M215 HydrophobicContact CG-CE 3.4Å; Y211-M215 HydrophobicContact CE1-CB 4.32Å; Y211-M215 WeakPolarHBondContact O-CB 3.36Å; Y211-M215 PolarHBondContact O-N 2.86Å; L212-M215 HydrophobicContact CD1-CE 3.9Å; L212-M215 PolarHBondContact O-N 3.3Å; M215-K217 PolarHBondContact O-N 2.98Å; M215-K217 VanDerWaalsContact O-N 3.16Å; M215-G218 PolarHBondContact O-N 2.7Å; M215-Y219 PolarHBondContact N-O 3.15Å; M215-C220 HydrophobicContact CG-CB 4.21Å
216	K	90.5	Very high	89	Confident	97 Å²	97	37.1 Å²	37.1	42%	0.422	18%	0.18	S	C	.	.	H	α-helix	trans	-58.6	-28.4	176.8	-74.9	172.9	-176	169	0	113.9	T87 L212 E213 L214 G218	T87-K216 HydrophobicContact CG2-CB 4.4Å; T87-K216 HydrophobicContact CG2-CG 4.07Å; L212-K216 HydrophobicContact CG-CD 4.39Å; L212-K216 VanDerWaalsContact O-CG 3.3Å; L212-K216 WeakPolarHBondContact O-CG 3.38Å; L212-K216 PolarHBondContact O-N 2.9Å; E213-K216 PolarHBondContact O-N 3.24Å; E213-K216 IonicContact OE1-NZ 2.81Å; E213-K216 PolarHBondContact OE1-NZ 3.01Å; L214-K216 PolarHBondContact O-N 3.26Å; K216-G218 VanDerWaalsContact C-N 3.34Å
217	K	90.3	Very high	88.8	Confident	126 Å²	126	36.1 Å²	36.1	55%	0.548	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-0.1	175.2	-76.4	-62.6	-171	176	0	114.3	L192 E213 L214 M215 Y219	L192-K217 HydrophobicContact CD1-CB 3.85Å; L192-K217 HydrophobicContact CD1-CG 3.97Å; L192-K217 HydrophobicContact CD2-CB 4.38Å; L192-K217 HydrophobicContact CD2-CG 3.72Å; L192-K217 HydrophobicContact CG-CG 4.16Å; E213-K217 PolarHBondContact O-N 3.04Å; E213-K217 VanDerWaalsContact O-N 3.11Å; L214-K217 PolarHBondContact O-N 3.23Å; L214-K217 VanDerWaalsContact O-N 3.14Å; M215-K217 PolarHBondContact O-N 2.98Å; M215-K217 VanDerWaalsContact O-N 3.16Å; K217-Y219 HydrophobicContact CB-CD2 3.96Å; K217-Y219 HydrophobicContact CB-CE2 4.18Å
218	G	90.1	Very high	88.5	Confident	34 Å²	34	36.5 Å²	36.5	35%	0.351	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	92.6	14.4	178.8	0	0	0	0	0	114.7	S89 L214 M215 K216	S89-G218 VanDerWaalsContact OG-CA 3.26Å; S89-G218 WeakPolarHBondContact OG-CA 3.38Å; S89-G218 PolarHBondContact OG-O 3.49Å; L214-G218 PolarHBondContact O-N 2.98Å; M215-G218 PolarHBondContact O-N 2.7Å; K216-G218 VanDerWaalsContact C-N 3.34Å
219	Y	89.3	Confident	88.4	Confident	20 Å²	20	34.5 Å²	34.5	8%	0.078	17%	0.166	C	C	.	.			trans	-112.5	93.2	175.9	-55.9	-75.8	0	0	0	109.7	S89 P187 F189 L192 L214 M215 K217	S89-Y219 PolarHBondContact OG-N 3.29Å; P187-Y219 PolarHBondContact O-OH 3.28Å; F189-Y219 HydrophobicContact CB-CE2 4.1Å; F189-Y219 HydrophobicContact CD2-CD1 4.2Å; F189-Y219 AromaticContact CD2-CD2 3.79Å; F189-Y219 HydrophobicContact CD2-CD2 3.79Å; F189-Y219 HydrophobicContact CD2-CE1 4.22Å; F189-Y219 AromaticContact CD2-CE2 3.82Å; F189-Y219 HydrophobicContact CD2-CE2 3.82Å; F189-Y219 AromaticContact CD2-CG 3.99Å; F189-Y219 HydrophobicContact CD2-CG 3.99Å; F189-Y219 HydrophobicContact CE2-CD1 4.45Å; F189-Y219 HydrophobicContact CE2-CD2 4.44Å; F189-Y219 HydrophobicContact CE2-CG 4.25Å; F189-Y219 HydrophobicContact CG-CE2 4.42Å; L192-Y219 HydrophobicContact CD1-CD2 3.95Å; L192-Y219 HydrophobicContact CD1-CE2 4.33Å; L214-Y219 CarbonylContact C-O 3.59Å; L214-Y219 WeakPolarHBondContact CB-O 3.21Å; L214-Y219 PolarHBondContact O-N 2.84Å; M215-Y219 PolarHBondContact N-O 3.15Å; K217-Y219 HydrophobicContact CB-CD2 3.96Å; K217-Y219 HydrophobicContact CB-CE2 4.18Å
220	C	86	Confident	88.4	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.166	C	C	.	.			trans	-114.9	178.2	178.7	83.3	0	0	0	0	113.5	S89 C90 D91 A107 M215 T222	S89-C220 VanDerWaalsContact C-SG 3.6Å; S89-C220 VanDerWaalsContact OG-CB 3.28Å; S89-C220 WeakPolarHBondContact OG-CB 3.44Å; S89-C220 PolarHBondContact OG-N 2.82Å; C90-C220 VanDerWaalsContact CA-SG 3.51Å; D91-C220 VanDerWaalsContact CB-O 3.24Å; D91-C220 WeakPolarHBondContact CB-O 3.38Å; A107-C220 HydrophobicContact CB-CB 3.6Å; M215-C220 HydrophobicContact CG-CB 4.21Å; C220-T222 PolarHBondContact O-N 3.42Å
221	C	82.9	Confident	88.5	Confident	13 Å²	13	33 Å²	33	9%	0.088	16%	0.157	C	C	.	.	S	Bend	trans	70.9	-77.3	150	-44	0	0	0	0	116.3	D91 E105 Y211 N223	D91-C221 HydrophobicContact CB-CB 3.91Å; E105-C221 HydrophobicContact CB-CB 3.5Å; E105-C221 HydrophobicContact CG-CB 4.24Å; E105-C221 WeakPolarHBondContact OE2-CB 3.26Å; Y211-C221 WeakPolarHBondContact OH-CA 3.4Å; Y211-C221 PolarHBondContact OH-N 2.89Å; C221-N223 PolarHBondContact O-N 3.28Å
222	T	83	Confident	88.6	Confident	14 Å²	14	35.4 Å²	35.4	9%	0.086	17%	0.166	C	C	.	.			trans	-85.4	106.6	-169.9	-65	0	0	0	0	111.2	D91 E105 C220 Y224 N225 I226	D91-T222 WeakPolarHBondContact OD2-CB 3.43Å; D91-T222 PolarHBondContact OD2-N 2.93Å; E105-T222 PolarHBondContact OE2-N 2.84Å; E105-T222 PolarHBondContact OE2-OG1 3.45Å; C220-T222 PolarHBondContact O-N 3.42Å; T222-Y224 PolarHBondContact O-N 2.85Å; T222-N225 HydrophobicContact CG2-CB 4.46Å; T222-N225 PolarHBondContact O-N 3.45Å; T222-I226 PolarHBondContact O-N 3.44Å
223	N	84.6	Confident	88.8	Confident	47 Å²	47	33.3 Å²	33.3	25%	0.251	16%	0.155	S	C	.	.	H	α-helix	trans	-52.4	-33.2	178	-66.5	-53	0	0	0	113.5	R156 Y159 C221 Y227	R156-N223 PolarHBondContact NH1-ND2 3.5Å; R156-N223 PolarHBondContact NH1-OD1 3.19Å; R156-N223 PolarHBondContact NH2-ND2 3.12Å; Y159-N223 HydrophobicContact CE2-CB 3.84Å; Y159-N223 WeakPolarHBondContact CE2-OD1 3.32Å; Y159-N223 PolarHBondContact OH-O 3.05Å; C221-N223 PolarHBondContact O-N 3.28Å; N223-Y227 WeakPolarHBondContact O-CB 3.39Å; N223-Y227 PolarHBondContact O-N 2.8Å
224	Y	85	Confident	88.9	Confident	124 Å²	124	29.5 Å²	29.5	49%	0.486	14%	0.137	S	C	.	.	H	α-helix	trans	-66.3	-41	179.9	-175.3	-109	0	0	0	112	T222 Y227 R228	T222-Y224 PolarHBondContact O-N 2.85Å; Y224-Y227 HydrophobicContact CD2-CD1 4.5Å; Y224-Y227 WeakPolarHBondContact O-CB 3.41Å; Y224-Y227 PolarHBondContact O-N 3.05Å; Y224-R228 HydrophobicContact CD1-CG 4.42Å; Y224-R228 HydrophobicContact CE1-CG 4.14Å; Y224-R228 WeakPolarHBondContact O-CG 2.88Å; Y224-R228 PolarHBondContact O-N 2.93Å
225	N	87.8	Confident	88.8	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-70.7	-38	177.8	-68.7	-15	0	0	0	110.9	L62 D91 I92 T222 R228 R229	L62-N225 HydrophobicContact CD2-CB 4.16Å; D91-N225 VanDerWaalsContact CG-ND2 3.35Å; D91-N225 PolarHBondContact OD1-ND2 3.44Å; D91-N225 WeakPolarHBondContact OD2-CB 3.28Å; D91-N225 PolarHBondContact OD2-ND2 3.39Å; I92-N225 PolarHBondContact O-ND2 3.04Å; T222-N225 HydrophobicContact CG2-CB 4.46Å; T222-N225 PolarHBondContact O-N 3.45Å; N225-R228 PolarHBondContact O-N 3.05Å; N225-R229 VanDerWaalsContact C-NH1 3.31Å; N225-R229 WeakPolarHBondContact O-CG 3.47Å; N225-R229 PolarHBondContact O-N 2.88Å; N225-R229 PolarHBondContact O-NH1 3.17Å
226	I	90.1	Very high	88.8	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-59.8	-47.6	170.9	-60.5	173.1	0	0	0	110.3	Y159 F189 M209 L214 T222 R228 R229 I230	Y159-I226 HydrophobicContact CD1-CG2 3.76Å; Y159-I226 HydrophobicContact CD2-CD1 4.18Å; Y159-I226 HydrophobicContact CD2-CG2 4.2Å; Y159-I226 HydrophobicContact CE1-CB 4.35Å; Y159-I226 HydrophobicContact CE1-CG2 3.54Å; Y159-I226 HydrophobicContact CE2-CB 4.07Å; Y159-I226 HydrophobicContact CE2-CD1 4.35Å; Y159-I226 HydrophobicContact CE2-CG2 4Å; Y159-I226 HydrophobicContact CG-CG2 4.08Å; F189-I226 HydrophobicContact CZ-CG2 4.28Å; M209-I226 HydrophobicContact CE-CG2 3.71Å; L214-I226 HydrophobicContact CD1-CD1 4.35Å; T222-I226 PolarHBondContact O-N 3.44Å; I226-R228 VanDerWaalsContact C-N 3.32Å; I226-R228 PolarHBondContact O-N 3.34Å; I226-R229 PolarHBondContact O-N 3.48Å; I226-I230 HydrophobicContact CG2-CD1 4.14Å; I226-I230 WeakPolarHBondContact O-CG1 3.37Å; I226-I230 PolarHBondContact O-N 2.91Å; I226-I230 VanDerWaalsContact O-N 3.15Å
227	Y	89.2	Confident	89	Confident	52 Å²	52	31.1 Å²	31.1	20%	0.204	15%	0.148	C	C	.	.	H	α-helix	trans	-55.4	-47.2	175.6	165	-91	0	0	0	111.2	Y159 F161 K163 N223 Y224 R229 I230 H231	Y159-Y227 WeakPolarHBondContact OH-CA 3.19Å; Y159-Y227 WeakPolarHBondContact OH-CB 2.97Å; Y159-Y227 PolarHBondContact OH-N 3.23Å; F161-Y227 AromaticContact CD2-CD2 3.6Å; F161-Y227 HydrophobicContact CD2-CD2 3.6Å; F161-Y227 HydrophobicContact CD2-CE2 4.16Å; F161-Y227 HydrophobicContact CD2-CG 4.48Å; F161-Y227 AromaticContact CE2-CD2 3.22Å; F161-Y227 HydrophobicContact CE2-CD2 3.22Å; F161-Y227 AromaticContact CE2-CE2 3.39Å; F161-Y227 HydrophobicContact CE2-CE2 3.39Å; F161-Y227 HydrophobicContact CE2-CG 4.17Å; F161-Y227 HydrophobicContact CZ-CD2 4.34Å; F161-Y227 HydrophobicContact CZ-CE2 4.11Å; K163-Y227 HydrophobicContact CD-CE2 4.25Å; K163-Y227 PolarHBondContact NZ-OH 2.66Å; N223-Y227 WeakPolarHBondContact O-CB 3.39Å; N223-Y227 PolarHBondContact O-N 2.8Å; Y224-Y227 HydrophobicContact CD2-CD1 4.5Å; Y224-Y227 WeakPolarHBondContact O-CB 3.41Å; Y224-Y227 PolarHBondContact O-N 3.05Å; Y227-R229 PolarHBondContact O-N 2.85Å; Y227-I230 PolarHBondContact O-N 2.88Å; Y227-H231 HydrophobicContact CE1-CB 4.23Å; Y227-H231 VanDerWaalsContact O-CB 3.26Å; Y227-H231 WeakPolarHBondContact O-CB 3.36Å; Y227-H231 PolarHBondContact O-N 2.94Å
228	R	88.4	Confident	89	Confident	10 Å²	10	26.8 Å²	26.8	4%	0.038	13%	0.13	C	C	.	.	H	α-helix	trans	-62	-41.2	179.9	-76.5	-179.2	67.7	-159.8	6.9	112.3	V58 E59 L62 E94 Y224 N225 I226 I230 H231 W232	V58-R228 PolarHBondContact O-NH2 2.84Å; E59-R228 VanDerWaalsContact C-NH2 3.29Å; E59-R228 PolarHBondContact O-NH2 2.91Å; L62-R228 HydrophobicContact CD1-CB 3.88Å; L62-R228 HydrophobicContact CD2-CB 4.48Å; L62-R228 VanDerWaalsContact CD2-NH1 3.32Å; L62-R228 HydrophobicContact CG-CB 4.46Å; E94-R228 IonicContact OE1-CZ 3.6Å; E94-R228 IonicContact OE1-NH1 2.64Å; E94-R228 PolarHBondContact OE1-NH1 2.95Å; E94-R228 IonicContact OE1-NH2 3.92Å; E94-R228 IonicContact OE2-NH1 3.89Å; Y224-R228 HydrophobicContact CD1-CG 4.42Å; Y224-R228 HydrophobicContact CE1-CG 4.14Å; Y224-R228 WeakPolarHBondContact O-CG 2.88Å; Y224-R228 PolarHBondContact O-N 2.93Å; N225-R228 PolarHBondContact O-N 3.05Å; I226-R228 VanDerWaalsContact C-N 3.32Å; I226-R228 PolarHBondContact O-N 3.34Å; R228-I230 VanDerWaalsContact C-N 3.34Å; R228-I230 PolarHBondContact O-N 2.92Å; R228-H231 PolarHBondContact O-N 3Å; R228-W232 WeakPolarHBondContact O-CB 3.26Å; R228-W232 PolarHBondContact O-N 3.23Å
229	R	91.1	Very high	88.9	Confident	3 Å²	3	28.7 Å²	28.7	1%	0.011	13%	0.129	C	C	.	.	H	α-helix	trans	-58.9	-45.9	174.9	-67.5	-177.3	-176.8	87.1	-4	111.4	L62 D66 Y186 F189 N225 I226 Y227 S233	L62-R229 HydrophobicContact CD1-CB 4.27Å; L62-R229 HydrophobicContact CD1-CG 3.22Å; D66-R229 IonicContact OD1-CZ 3.09Å; D66-R229 IonicContact OD1-NH2 2.63Å; D66-R229 PolarHBondContact OD1-NH2 3.35Å; D66-R229 IonicContact OD2-NH2 3.64Å; Y186-R229 HydrophobicContact CD1-CG 4.07Å; Y186-R229 HydrophobicContact CD2-CB 3.85Å; Y186-R229 HydrophobicContact CD2-CG 4.08Å; Y186-R229 HydrophobicContact CE1-CG 3.88Å; Y186-R229 HydrophobicContact CE2-CB 3.65Å; Y186-R229 HydrophobicContact CE2-CG 3.89Å; Y186-R229 WeakPolarHBondContact CE2-O 3.43Å; Y186-R229 HydrophobicContact CG-CB 4.4Å; Y186-R229 HydrophobicContact CG-CG 4.17Å; F189-R229 HydrophobicContact CD1-CB 4.12Å; F189-R229 HydrophobicContact CE1-CB 3.39Å; F189-R229 HydrophobicContact CE1-CG 4.48Å; F189-R229 HydrophobicContact CE2-CB 4.44Å; F189-R229 HydrophobicContact CZ-CB 3.6Å; F189-R229 HydrophobicContact CZ-CG 4.45Å; N225-R229 VanDerWaalsContact C-NH1 3.31Å; N225-R229 WeakPolarHBondContact O-CG 3.47Å; N225-R229 PolarHBondContact O-N 2.88Å; N225-R229 PolarHBondContact O-NH1 3.17Å; I226-R229 PolarHBondContact O-N 3.48Å; Y227-R229 PolarHBondContact O-N 2.85Å; R229-S233 WeakPolarHBondContact O-CB 3.35Å; R229-S233 PolarHBondContact O-N 2.84Å; R229-S233 PolarHBondContact O-OG 2.86Å
230	I	92.2	Very high	88	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-65.4	-49.4	177.3	-58.2	162.9	0	0	0	110.2	Y159 F161 M182 F189 T207 M209 I226 Y227 R228 W232 S233 I234	Y159-I230 HydrophobicContact CD1-CD1 4.3Å; Y159-I230 HydrophobicContact CE1-CD1 3.73Å; F161-I230 HydrophobicContact CB-CD1 3.66Å; F161-I230 HydrophobicContact CD1-CG2 3.86Å; F161-I230 HydrophobicContact CD2-CB 4.03Å; F161-I230 HydrophobicContact CD2-CD1 3.71Å; F161-I230 HydrophobicContact CD2-CG2 3.86Å; F161-I230 HydrophobicContact CE1-CG2 3.91Å; F161-I230 HydrophobicContact CE2-CB 4.06Å; F161-I230 HydrophobicContact CE2-CG2 3.85Å; F161-I230 HydrophobicContact CG-CB 4.44Å; F161-I230 HydrophobicContact CG-CD1 3.85Å; F161-I230 HydrophobicContact CG-CG2 3.86Å; F161-I230 HydrophobicContact CZ-CG2 3.9Å; M182-I230 HydrophobicContact CE-CG1 4.06Å; F189-I230 HydrophobicContact CE1-CG1 4.02Å; F189-I230 HydrophobicContact CZ-CG1 4.07Å; T207-I230 HydrophobicContact CG2-CG2 4.3Å; M209-I230 HydrophobicContact CE-CD1 3.43Å; M209-I230 VanDerWaalsContact CE-CD1 3.43Å; M209-I230 HydrophobicContact CE-CG1 3.94Å; I226-I230 HydrophobicContact CG2-CD1 4.14Å; I226-I230 WeakPolarHBondContact O-CG1 3.37Å; I226-I230 PolarHBondContact O-N 2.91Å; I226-I230 VanDerWaalsContact O-N 3.15Å; Y227-I230 PolarHBondContact O-N 2.88Å; R228-I230 VanDerWaalsContact C-N 3.34Å; R228-I230 PolarHBondContact O-N 2.92Å; I230-W232 PolarHBondContact O-N 2.84Å; I230-S233 WeakPolarHBondContact O-CB 3.42Å; I230-S233 PolarHBondContact O-N 3.39Å; I230-I234 HydrophobicContact CG2-CD1 3.71Å; I230-I234 HydrophobicContact CG2-CG1 4.35Å; I230-I234 WeakPolarHBondContact O-CG1 3.21Å; I230-I234 PolarHBondContact O-N 2.94Å
231	H	90.1	Very high	86.3	Confident	27 Å²	27	37.9 Å²	37.9	13%	0.125	18%	0.182	C	C	.	.	H	α-helix	trans	-56.7	-51.9	-177.5	178.5	-100.3	0	0	0	112.2	K163 Y165 Y227 R228 S233 I234 M235	K163-H231 PolarHBondContact NZ-CD2 3.11Å; K163-H231 PolarHBondContact NZ-NE2 2.79Å; Y165-H231 PolarHBondContact OH-CD2 3.13Å; Y227-H231 HydrophobicContact CE1-CB 4.23Å; Y227-H231 VanDerWaalsContact O-CB 3.26Å; Y227-H231 WeakPolarHBondContact O-CB 3.36Å; Y227-H231 PolarHBondContact O-N 2.94Å; R228-H231 PolarHBondContact O-N 3Å; H231-S233 VanDerWaalsContact C-N 3.29Å; H231-S233 PolarHBondContact O-N 3.41Å; H231-I234 WeakPolarHBondContact O-CB 3.44Å; H231-I234 PolarHBondContact O-N 3.46Å; H231-I234 VanDerWaalsContact O-N 3.13Å; H231-M235 WeakPolarHBondContact O-CG 3.23Å; H231-M235 PolarHBondContact O-N 2.94Å
232	W	89.6	Confident	84.4	Confident	52 Å²	52	45.1 Å²	45.1	20%	0.197	22%	0.215	C	C	.	.	H	α-helix	trans	-67.7	-30.7	-179.2	-71.4	124.4	0	0	0	112.8	E59 Q60 R228 I230 M235 E236	E59-W232 VanDerWaalsContact O-CZ2 3.23Å; E59-W232 WeakPolarHBondContact O-CZ2 3.14Å; E59-W232 PolarHBondContact O-NE1 2.9Å; Q60-W232 HydrophobicContact CB-CZ2 4.45Å; Q60-W232 HydrophobicContact CG-CH2 3.83Å; Q60-W232 HydrophobicContact CG-CZ2 3.94Å; Q60-W232 HydrophobicContact CG-CZ3 4.35Å; R228-W232 WeakPolarHBondContact O-CB 3.26Å; R228-W232 PolarHBondContact O-N 3.23Å; I230-W232 PolarHBondContact O-N 2.84Å; W232-M235 HydrophobicContact CE3-CB 4.16Å; W232-M235 HydrophobicContact CE3-CG 4.24Å; W232-M235 HydrophobicContact CZ3-CG 4.47Å; W232-M235 PolarHBondContact O-N 2.91Å; W232-E236 WeakPolarHBondContact O-CB 3.45Å; W232-E236 PolarHBondContact O-N 3.48Å
233	S	92.8	Very high	82.2	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-66.3	-40.2	171.4	-56	0	0	0	0	111.7	V181 M182 R229 I230 H231 L237	V181-S233 WeakPolarHBondContact CG1-O 3.43Å; M182-S233 VanDerWaalsContact CG-CB 3.45Å; M182-S233 WeakPolarHBondContact CG-OG 3.45Å; R229-S233 WeakPolarHBondContact O-CB 3.35Å; R229-S233 PolarHBondContact O-N 2.84Å; R229-S233 PolarHBondContact O-OG 2.86Å; I230-S233 WeakPolarHBondContact O-CB 3.42Å; I230-S233 PolarHBondContact O-N 3.39Å; H231-S233 VanDerWaalsContact C-N 3.29Å; H231-S233 PolarHBondContact O-N 3.41Å; S233-L237 WeakPolarHBondContact O-CB 3.45Å; S233-L237 PolarHBondContact O-N 2.82Å
234	I	92.7	Very high	79.6	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-66.8	-44.4	174.8	-68.5	169	0	0	0	111	F161 Y165 L178 I205 I230 H231 E236 L237 L238	F161-I234 HydrophobicContact CE1-CD1 3.63Å; F161-I234 HydrophobicContact CZ-CD1 3.91Å; Y165-I234 HydrophobicContact CD1-CG2 4.34Å; Y165-I234 HydrophobicContact CD2-CG2 4.38Å; Y165-I234 HydrophobicContact CE1-CG2 3.72Å; Y165-I234 HydrophobicContact CE2-CD1 3.96Å; Y165-I234 HydrophobicContact CE2-CG2 3.75Å; Y165-I234 WeakPolarHBondContact OH-CD1 3.49Å; Y165-I234 WeakPolarHBondContact OH-CG2 3.26Å; L178-I234 HydrophobicContact CD1-CB 4.46Å; L178-I234 HydrophobicContact CD1-CG1 3.61Å; L178-I234 HydrophobicContact CD2-CG1 4.04Å; I205-I234 HydrophobicContact CB-CD1 4.22Å; I205-I234 HydrophobicContact CD1-CD1 4.31Å; I205-I234 HydrophobicContact CD1-CG1 4.45Å; I205-I234 HydrophobicContact CD1-CG2 3.61Å; I205-I234 HydrophobicContact CG2-CD1 3.76Å; I205-I234 HydrophobicContact CG2-CG1 4.45Å; I230-I234 HydrophobicContact CG2-CD1 3.71Å; I230-I234 HydrophobicContact CG2-CG1 4.35Å; I230-I234 WeakPolarHBondContact O-CG1 3.21Å; I230-I234 PolarHBondContact O-N 2.94Å; H231-I234 WeakPolarHBondContact O-CB 3.44Å; H231-I234 PolarHBondContact O-N 3.46Å; H231-I234 VanDerWaalsContact O-N 3.13Å; I234-E236 VanDerWaalsContact C-N 3.31Å; I234-E236 PolarHBondContact O-N 3.34Å; I234-L237 WeakPolarHBondContact O-CB 3.46Å; I234-L237 PolarHBondContact O-N 2.79Å; I234-L237 VanDerWaalsContact O-N 3.17Å; I234-L238 HydrophobicContact CG2-CD1 3.37Å; I234-L238 HydrophobicContact CG2-CG 4.05Å; I234-L238 WeakPolarHBondContact O-CB 3.47Å; I234-L238 VanDerWaalsContact O-CG 3.3Å; I234-L238 WeakPolarHBondContact O-CG 3.19Å; I234-L238 PolarHBondContact O-N 3.08Å
235	M	89.7	Confident	76.8	Confident	59 Å²	59	50.9 Å²	50.9	29%	0.291	28%	0.28	S	S	.	.	H	α-helix	trans	-59.9	-42.6	178	-69.8	-59.4	-71.2	0	0	111.4	Y165 H231 W232 L238 F239	Y165-M235 HydrophobicContact CE1-SD 4.2Å; H231-M235 WeakPolarHBondContact O-CG 3.23Å; H231-M235 PolarHBondContact O-N 2.94Å; W232-M235 HydrophobicContact CE3-CB 4.16Å; W232-M235 HydrophobicContact CE3-CG 4.24Å; W232-M235 HydrophobicContact CZ3-CG 4.47Å; W232-M235 PolarHBondContact O-N 2.91Å; M235-L238 PolarHBondContact O-N 2.03Å; M235-F239 HydrophobicContact CE-CD2 3.66Å; M235-F239 HydrophobicContact CE-CE2 3.82Å; M235-F239 WeakPolarHBondContact O-CB 3.23Å; M235-F239 WeakPolarHBondContact O-CD2 3.46Å; M235-F239 PolarHBondContact O-N 2.95Å; M235-F239 HydrophobicContact SD-CD2 3.87Å; M235-F239 HydrophobicContact SD-CE2 3.72Å
236	E	90.5	Very high	74.2	Confident	46 Å²	46	57.8 Å²	57.8	22%	0.215	32%	0.317	C	S	.	.	H	α-helix	trans	-64.4	-43.5	173.9	-178.9	174.7	-170.9	0	0	112.2	V181 R184 R185 W232 I234 L238 G240	V181-E236 HydrophobicContact CG1-CB 4.07Å; V181-E236 HydrophobicContact CG1-CG 4.14Å; V181-E236 WeakPolarHBondContact CG1-OE2 3.43Å; R184-E236 IonicContact CZ-OE1 3.57Å; R184-E236 IonicContact NH1-OE1 2.84Å; R184-E236 PolarHBondContact NH1-OE1 3.34Å; R184-E236 IonicContact NH2-OE1 3.72Å; R184-E236 PolarHBondContact NH2-OE1 3.09Å; R184-E236 IonicContact NH2-OE2 3.58Å; R185-E236 WeakPolarHBondContact CD-OE2 3.45Å; R185-E236 VanDerWaalsContact CG-OE2 3.26Å; R185-E236 WeakPolarHBondContact CG-OE2 3.4Å; R185-E236 IonicContact CZ-OE2 3.35Å; R185-E236 IonicContact NE-OE2 2.75Å; R185-E236 VanDerWaalsContact NH1-CD 3.34Å; R185-E236 IonicContact NH1-OE2 2.67Å; R185-E236 PolarHBondContact NH1-OE2 2.91Å; W232-E236 WeakPolarHBondContact O-CB 3.45Å; W232-E236 PolarHBondContact O-N 3.48Å; I234-E236 VanDerWaalsContact C-N 3.31Å; I234-E236 PolarHBondContact O-N 3.34Å; E236-L238 VanDerWaalsContact C-N 3.3Å; E236-L238 PolarHBondContact O-N 2.82Å; E236-G240 WeakPolarHBondContact O-CA 3.35Å; E236-G240 PolarHBondContact O-N 3.28Å
237	L	93	Very high	71.4	Confident	27 Å²	27	67 Å²	67	14%	0.141	36%	0.357	C	S	.	.	H	α-helix	trans	-60.9	-39.6	178.6	177.6	67.5	0	0	0	112.8	K174 E177 L178 V181 F198 S233 I234	K174-L237 HydrophobicContact CB-CD2 3.89Å; K174-L237 HydrophobicContact CD-CD1 4.31Å; K174-L237 HydrophobicContact CD-CD2 4.45Å; K174-L237 HydrophobicContact CD-CG 4.28Å; E177-L237 HydrophobicContact CB-CD1 3.54Å; L178-L237 HydrophobicContact CB-CD2 3.71Å; L178-L237 HydrophobicContact CD1-CD2 4.04Å; L178-L237 HydrophobicContact CG-CD2 4.4Å; V181-L237 HydrophobicContact CG2-CB 4.38Å; V181-L237 HydrophobicContact CG2-CD1 4.17Å; F198-L237 HydrophobicContact CE1-CD2 4.16Å; F198-L237 HydrophobicContact CZ-CD2 3.81Å; S233-L237 WeakPolarHBondContact O-CB 3.45Å; S233-L237 PolarHBondContact O-N 2.82Å; I234-L237 WeakPolarHBondContact O-CB 3.46Å; I234-L237 PolarHBondContact O-N 2.79Å; I234-L237 VanDerWaalsContact O-N 3.17Å
238	L	90.3	Very high	68.6	Low	34 Å²	34	69.7 Å²	69.7	18%	0.178	38%	0.379	C	S	.	.	H	α-helix	trans	-88.6	-33.2	-173.6	-63.8	174.2	0	0	0	112.9	Y165 V169 I205 I234 M235 E236	Y165-L238 HydrophobicContact CD1-CD1 4.19Å; Y165-L238 HydrophobicContact CG-CD1 4.33Å; V169-L238 HydrophobicContact CG1-CB 4.3Å; V169-L238 HydrophobicContact CG1-CD1 3.64Å; V169-L238 HydrophobicContact CG1-CD2 4.19Å; V169-L238 HydrophobicContact CG1-CG 4.26Å; I205-L238 HydrophobicContact CD1-CD1 4.02Å; I234-L238 HydrophobicContact CG2-CD1 3.37Å; I234-L238 HydrophobicContact CG2-CG 4.05Å; I234-L238 WeakPolarHBondContact O-CB 3.47Å; I234-L238 VanDerWaalsContact O-CG 3.3Å; I234-L238 WeakPolarHBondContact O-CG 3.19Å; I234-L238 PolarHBondContact O-N 3.08Å; M235-L238 PolarHBondContact O-N 2.03Å; E236-L238 VanDerWaalsContact C-N 3.3Å; E236-L238 PolarHBondContact O-N 2.82Å
239	F	87.8	Confident	66	Low	74 Å²	74	77.9 Å²	77.9	33%	0.325	42%	0.415	S	S	.	.	H	α-helix	trans	-126.9	-3.7	-170.4	-52.3	-72.8	0	0	0	114.4	V169 M235 E241 Q242	V169-F239 HydrophobicContact CG1-CE1 4.44Å; V169-F239 HydrophobicContact CG1-CZ 3.86Å; V169-F239 HydrophobicContact CG2-CZ 4.42Å; M235-F239 HydrophobicContact CE-CD2 3.66Å; M235-F239 HydrophobicContact CE-CE2 3.82Å; M235-F239 WeakPolarHBondContact O-CB 3.23Å; M235-F239 WeakPolarHBondContact O-CD2 3.46Å; M235-F239 PolarHBondContact O-N 2.95Å; M235-F239 HydrophobicContact SD-CD2 3.87Å; M235-F239 HydrophobicContact SD-CE2 3.72Å; F239-E241 PolarHBondContact O-N 3.04Å; F239-Q242 PolarHBondContact O-N 3.11Å
240	G	71.2	Confident	63.3	Low	35 Å²	35	82.6 Å²	82.6	36%	0.361	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-15	-170.3	0	0	0	0	0	116.2	E236 Q242	E236-G240 WeakPolarHBondContact O-CA 3.35Å; E236-G240 PolarHBondContact O-N 3.28Å; G240-Q242 VanDerWaalsContact C-N 3.33Å
241	E	50.6	Low	60.4	Low	178 Å²	178	88.2 Å²	88.2	83%	0.832	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-15.2	171.1	-69.5	-166.1	143.3	0	0	113.5	F239	F239-E241 PolarHBondContact O-N 3.04Å
242	Q	42.7	Very low	57.4	Low	166 Å²	166	90.4 Å²	90.4	78%	0.776	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-7.4	-179.7	-66.2	-162.7	-13.5	0	0	114.6	F239 G240	F239-Q242 PolarHBondContact O-N 3.11Å; G240-Q242 VanDerWaalsContact C-N 3.33Å
243	H	37.2	Very low	54.5	Low	168 Å²	168	95.4 Å²	95.4	78%	0.778	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.6	28.6	177.9	-70.1	-61.5	0	0	0	113.4	G245	H243-G245 VanDerWaalsContact C-N 3.34Å; H243-G245 PolarHBondContact O-N 3.3Å
244	G	29.2	Very low	51.4	Low	69 Å²	69	101 Å²	101	71%	0.711	58%	0.584	S	S	*	*			trans	-62.9	78.4	-171.8	0	0	0	0	0	116.1
245	G	26.9	Very low	48.4	Very low	68 Å²	68	109.1 Å²	109.1	70%	0.701	62%	0.621	S	S	*	*	S	Bend	trans	-81.5	122.9	143.7	0	0	0	0	0	109.2	H243	H243-G245 VanDerWaalsContact C-N 3.34Å; H243-G245 PolarHBondContact O-N 3.3Å
246	D	32	Very low	45.5	Very low	145 Å²	145	111.9 Å²	111.9	78%	0.775	64%	0.644	S	S	*	*			trans	41.1	102.1	172	-81.9	-26.4	0	0	0	119.6	T248	D246-T248 VanDerWaalsContact C-N 3.31Å; D246-T248 PolarHBondContact O-N 2.82Å
247	K	32.2	Very low	42.4	Very low	195 Å²	195	117.8 Å²	117.8	85%	0.848	68%	0.677	S	S	*	*			trans	-68.9	82.3	160.9	-70.4	-178.7	177.4	177.9	0	110.6	K249	K247-K249 PolarHBondContact O-N 3.37Å
248	T	31.1	Very low	39.5	Very low	107 Å²	107	125.3 Å²	125.3	66%	0.656	71%	0.708	S	S	*	*			trans	-79.4	101.4	156.8	12.1	0	0	0	0	108.8	D246 P250	D246-T248 VanDerWaalsContact C-N 3.31Å; D246-T248 PolarHBondContact O-N 2.82Å; T248-P250 WeakPolarHBondContact O-CD 3.18Å
249	K	33.3	Very low	36.4	Very low	183 Å²	183	130.6 Å²	130.6	80%	0.796	74%	0.742	S	S	*	*			trans	-66.3	119.6	169.2	-139.9	-179.1	-169.5	-179.8	0	108	K247 S251	K247-K249 PolarHBondContact O-N 3.37Å; K249-S251 PolarHBondContact O-N 2.95Å
250	P	34.5	Very low	33.6	Very low	102 Å²	102	132.9 Å²	132.9	66%	0.662	76%	0.763	S	S	*	*			trans	-73.9	101.6	170.8	-4.8	21.5	0	0	0	107.7	T248	T248-P250 WeakPolarHBondContact O-CD 3.18Å
251	S	30.6	Very low	31.5	Very low	117 Å²	117	138.3 Å²	138.3	82%	0.818	78%	0.783	S	S	*	*			trans	-82.2	109.7	160.5	56	0	0	0	0	107.9	K249	K249-S251 PolarHBondContact O-N 2.95Å
252	G	26.8	Very low	30.7	Very low	74 Å²	74	137.2 Å²	137.2	76%	0.763	78%	0.776	S	S	*	*			trans	161.1	54.4	174.3	0	0	0	0	0	116.2
253	I	30.5	Very low	29.9	Very low	157 Å²	157	137.6 Å²	137.6	81%	0.805	78%	0.775	S	S	*	*			trans	-116.1	115.5	147.2	-59.4	177.3	0	0	0	105.2	Q255	I253-Q255 PolarHBondContact O-N 2.85Å; I253-Q255 VanDerWaalsContact O-N 3.13Å
254	S	26.8	Very low	29.7	Very low	118 Å²	118	134.4 Å²	134.4	83%	0.825	76%	0.76	S	S	*	*			trans	-50.4	111.3	175.8	41.7	0	0	0	0	110.8
255	Q	29.8	Very low	29.6	Very low	170 Å²	170	137.3 Å²	137.3	79%	0.794	76%	0.759	S	S	*	*			trans	-113.9	149.4	161.3	-73.6	-123.8	-35.8	0	0	108.7	I253	I253-Q255 PolarHBondContact O-N 2.85Å; I253-Q255 VanDerWaalsContact O-N 3.13Å
256	P	29.4	Very low	29.9	Very low	116 Å²	116	138 Å²	138	75%	0.753	75%	0.747	S	S	*	*			trans	-66.9	155.3	-178.8	-7.3	23.3	0	0	0	111.6	K258	P256-K258 PolarHBondContact O-N 3.43Å
257	D	25.2	Very low	29.7	Very low	170 Å²	170	134.9 Å²	134.9	91%	0.909	75%	0.748	S	S	*	*			trans	-35.2	119.3	-173.9	-64.9	-47.2	0	0	0	115.8
258	K	30.6	Very low	29.6	Very low	185 Å²	185	128.5 Å²	128.5	80%	0.804	74%	0.738	S	S	*	*			trans	-133.9	113.4	158	-80.7	-175.1	179.8	173.9	0	109.6	P256 T260	P256-K258 PolarHBondContact O-N 3.43Å; K258-T260 PolarHBondContact O-N 2.88Å
259	T	25.7	Very low	29.5	Very low	146 Å²	146	130.8 Å²	130.8	90%	0.896	75%	0.746	S	S	*	*			trans	-61.7	119.6	164.4	35.7	0	0	0	0	110.2
260	T	30	Very low	29.4	Very low	122 Å²	122	129.1 Å²	129.1	75%	0.748	74%	0.739	S	S	*	*			trans	-144.5	117.3	169.3	-17.4	0	0	0	0	111.1	K258 K262	K258-T260 PolarHBondContact O-N 2.88Å; T260-K262 PolarHBondContact O-N 3.5Å
261	D	27.3	Very low	29.2	Very low	149 Å²	149	130.6 Å²	130.6	80%	0.797	75%	0.746	S	S	*	*			trans	-67	122.5	169.9	-66.9	-38.8	0	0	0	110.2
262	K	32.7	Very low	29.3	Very low	155 Å²	155	132.6 Å²	132.6	67%	0.674	74%	0.743	S	S	*	*			trans	-126.2	120.2	174.8	-131.7	-174.5	-177.9	-161.9	0	111.1	T260 E264	T260-K262 PolarHBondContact O-N 3.5Å; K262-E264 IonicContact NZ-OE1 2.76Å
263	K	26.7	Very low	29.6	Very low	173 Å²	173	134.2 Å²	134.2	75%	0.752	74%	0.74	S	S	*	*			trans	-96.2	106	175.1	-151.5	-178.5	-171.5	-174.2	0	107.6
264	E	32.2	Very low	29.5	Very low	101 Å²	101	131.1 Å²	131.1	47%	0.472	73%	0.732	S	S	.	*			trans	-112.9	119.3	178.6	-115.9	169.5	-153.5	0	0	109.6	K262 L266	K262-E264 IonicContact NZ-OE1 2.76Å; E264-L266 HydrophobicContact CB-CD1 4.46Å; E264-L266 HydrophobicContact CB-CG 4.42Å; E264-L266 HydrophobicContact CG-CD1 4.29Å; E264-L266 HydrophobicContact CG-CG 4.32Å
265	N	28	Very low	29.5	Very low	130 Å²	130	128.2 Å²	128.2	70%	0.695	72%	0.721	S	S	*	*			trans	-92.9	111	164.4	-79.2	-23.1	0	0	0	106.6
266	L	33.7	Very low	29.4	Very low	84 Å²	84	128 Å²	128	44%	0.44	72%	0.724	S	S	.	*			trans	-127.9	105	176.5	-68.6	173	0	0	0	108.5	E264 K270	E264-L266 HydrophobicContact CB-CD1 4.46Å; E264-L266 HydrophobicContact CB-CG 4.42Å; E264-L266 HydrophobicContact CG-CD1 4.29Å; E264-L266 HydrophobicContact CG-CG 4.32Å; L266-K270 VanDerWaalsContact CD1-NZ 3.27Å
267	G	25.9	Very low	29.3	Very low	78 Å²	78	128 Å²	128	80%	0.804	73%	0.726	S	S	*	*			trans	-96.1	126.6	163.4	0	0	0	0	0	108.6
268	G	30	Very low	29.7	Very low	61 Å²	61	125.6 Å²	125.6	63%	0.629	71%	0.709	S	S	*	*	S	Bend	trans	149.8	136.8	-178.6	0	0	0	0	0	110.6	K270	G268-K270 PolarHBondContact O-N 3.08Å
269	D	29.7	Very low	29.7	Very low	155 Å²	155	121.8 Å²	121.8	83%	0.829	70%	0.704	S	S	*	*			trans	-54.6	124	-179.5	-66.2	-31.6	0	0	0	110.4
270	K	31.6	Very low	29.9	Very low	148 Å²	148	121.6 Å²	121.6	64%	0.643	70%	0.697	S	S	*	*			trans	-117.8	124.5	176.1	-82.6	-175.3	177.9	178	0	109.5	L266 G268	L266-K270 VanDerWaalsContact CD1-NZ 3.27Å; G268-K270 PolarHBondContact O-N 3.08Å
271	T	30.2	Very low	30.1	Very low	134 Å²	134	122.5 Å²	122.5	82%	0.822	69%	0.691	S	S	*	*			trans	-100.4	112.5	165	-31.6	0	0	0	0	107.7
272	E	32.4	Very low	30.1	Very low	159 Å²	159	121.7 Å²	121.7	74%	0.743	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-84.5	128.5	174.2	-92.3	-178	167.9	0	0	110.2
273	P	32.9	Very low	30.1	Very low	108 Å²	108	118 Å²	118	70%	0.701	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-78.9	136	169.7	25.3	-21.1	0	0	0	111.1
274	S	28.7	Very low	30.2	Very low	92 Å²	92	115.4 Å²	115.4	64%	0.643	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-76	129	174	50.5	0	0	0	0	111.8
275	G	27	Very low	30.3	Very low	57 Å²	57	115.8 Å²	115.8	59%	0.588	68%	0.676	S	S	*	*			trans	152.5	132	162	0	0	0	0	0	116
276	I	28.5	Very low	30.5	Very low	166 Å²	166	115.5 Å²	115.5	85%	0.851	67%	0.669	S	S	*	*			trans	87.3	127.6	163.1	-39.4	171.5	0	0	0	116.8
277	S	26.9	Very low	30.5	Very low	115 Å²	115	113.5 Å²	113.5	80%	0.804	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-48.4	131.6	-177.8	-21.5	0	0	0	0	114.4
278	Q	32.5	Very low	30.7	Very low	119 Å²	119	113.8 Å²	113.8	56%	0.556	64%	0.64	S	S	*	*	P	Polyproline II helix	trans	-102.6	142.7	169	-68.6	-96.3	-56.2	0	0	109.7
279	P	31.7	Very low	30.9	Very low	106 Å²	106	112.8 Å²	112.8	69%	0.688	62%	0.62	S	S	*	*	P	Polyproline II helix	trans	-73	158.2	160.9	28.6	-24.4	0	0	0	110.5	K281	P279-K281 PolarHBondContact O-N 2.89Å
280	D	28.7	Very low	30.7	Very low	142 Å²	142	108.3 Å²	108.3	76%	0.759	61%	0.61	S	S	*	*	P	Polyproline II helix	trans	-50.7	124.8	-176.4	-64.8	-37.9	0	0	0	112.5
281	K	34.3	Very low	30.7	Very low	141 Å²	141	103.8 Å²	103.8	61%	0.613	61%	0.606	S	S	*	*			trans	-124.2	118.2	173.3	-86.5	179.3	-179	157.6	0	109.6	P279	P279-K281 PolarHBondContact O-N 2.89Å
282	T	27.7	Very low	30.7	Very low	131 Å²	131	103.3 Å²	103.3	80%	0.804	60%	0.599	S	S	*	*			trans	-74.6	120.2	156.8	35.5	0	0	0	0	108.7
283	T	32.2	Very low	30.7	Very low	78 Å²	78	100.8 Å²	100.8	48%	0.479	59%	0.585	S	S	.	*			trans	-147.1	119.5	174.5	-41.2	0	0	0	0	110.3	K285	T283-K285 PolarHBondContact O-N 3.02Å
284	D	29.8	Very low	30.5	Very low	118 Å²	118	102.2 Å²	102.2	63%	0.631	59%	0.592	S	S	*	*			trans	-77.6	110.2	168.6	-73.5	-24.7	0	0	0	109.3
285	K	34.7	Very low	30.6	Very low	109 Å²	109	103.5 Å²	103.5	47%	0.474	59%	0.588	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-117.1	119.4	179.1	-124.2	-172.2	178.9	-157.7	0	110.5	T283 E287	T283-K285 PolarHBondContact O-N 3.02Å; K285-E287 IonicContact NZ-OE1 2.85Å; K285-E287 PolarHBondContact NZ-OE1 2.82Å
286	K	31.6	Very low	30.7	Very low	124 Å²	124	105 Å²	105	54%	0.539	59%	0.588	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-99.9	98.7	170.3	-155.8	177.9	-171.6	176.8	0	108.4
287	E	33.4	Very low	30.7	Very low	43 Å²	43	101.7 Å²	101.7	20%	0.201	58%	0.579	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-107.6	122.7	-178.2	-124	164.6	-149.4	0	0	109.3	K285 L289	K285-E287 IonicContact NZ-OE1 2.85Å; K285-E287 PolarHBondContact NZ-OE1 2.82Å; E287-L289 HydrophobicContact CB-CD1 4.48Å; E287-L289 HydrophobicContact CB-CG 4.33Å; E287-L289 HydrophobicContact CG-CD1 4.29Å; E287-L289 HydrophobicContact CG-CD2 4.3Å; E287-L289 HydrophobicContact CG-CG 4.08Å
288	N	30.3	Very low	30.7	Very low	84 Å²	84	98.7 Å²	98.7	45%	0.449	57%	0.566	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-99.4	110.1	163.1	-81.8	-25.5	0	0	0	106.1	N311	N288-N311 PolarHBondContact OD1-ND2 3.18Å
289	L	33.8	Very low	30.5	Very low	40 Å²	40	97.5 Å²	97.5	21%	0.209	56%	0.563	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-115.5	112.8	179.1	-68.4	169.6	0	0	0	108.4	E287 L312	E287-L289 HydrophobicContact CB-CD1 4.48Å; E287-L289 HydrophobicContact CB-CG 4.33Å; E287-L289 HydrophobicContact CG-CD1 4.29Å; E287-L289 HydrophobicContact CG-CD2 4.3Å; E287-L289 HydrophobicContact CG-CG 4.08Å; L289-L312 HydrophobicContact CB-CD2 4.33Å
290	G	26.7	Very low	30.3	Very low	60 Å²	60	97.9 Å²	97.9	62%	0.619	57%	0.568	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-115.4	128	161.8	0	0	0	0	0	107.7
291	G	31.1	Very low	30.5	Very low	54 Å²	54	95.5 Å²	95.5	56%	0.557	55%	0.552	S	S	*	*	S	Bend	trans	141.2	143	-177.1	0	0	0	0	0	111.6	K293	G291-K293 PolarHBondContact O-N 3.45Å
292	D	30	Very low	30.3	Very low	124 Å²	124	92.7 Å²	92.7	66%	0.663	55%	0.548	S	S	*	.			trans	-61.9	127.4	-179.9	-65.3	-30	0	0	0	110
293	K	31.7	Very low	30.4	Very low	106 Å²	106	91.6 Å²	91.6	46%	0.461	54%	0.538	S	S	.	.			trans	-112.6	125.1	177.2	-91.3	-170.7	172.9	-170.6	0	110.2	G291	G291-K293 PolarHBondContact O-N 3.45Å
294	T	30	Very low	30.6	Very low	137 Å²	137	92.9 Å²	92.9	84%	0.84	54%	0.536	S	S	*	.			trans	-105.5	110.4	163.3	-39.9	0	0	0	0	107.9
295	E	30.9	Very low	30.6	Very low	119 Å²	119	92 Å²	92	56%	0.556	54%	0.536	S	S	*	.	P	Polyproline II helix	trans	-87.1	130	177.8	-104.6	177.1	179.4	0	0	110.4
296	P	29.4	Very low	30.5	Very low	90 Å²	90	88.9 Å²	88.9	58%	0.584	53%	0.525	S	S	*	.	P	Polyproline II helix	trans	-72.8	140.6	170.7	24.8	-24	0	0	0	111.3
297	S	27.9	Very low	30.6	Very low	96 Å²	96	87.5 Å²	87.5	67%	0.671	52%	0.524	S	S	*	.	P	Polyproline II helix	trans	-76.6	136.2	179.2	49.9	0	0	0	0	112.7
298	G	25.8	Very low	30.8	Very low	52 Å²	52	88.7 Å²	88.7	54%	0.536	53%	0.528	S	S	.	.			trans	104.7	81.6	155.8	0	0	0	0	0	116.5
299	I	29.4	Very low	31	Very low	94 Å²	94	89.9 Å²	89.9	48%	0.482	53%	0.53	S	S	.	.			trans	-150.1	130.6	154.6	-46.8	177.1	0	0	0	109
300	S	27.2	Very low	31.2	Very low	113 Å²	113	88.9 Å²	88.9	79%	0.79	52%	0.524	S	S	*	.	P	Polyproline II helix	trans	-67.3	121.8	165.8	2	0	0	0	0	109.7
301	Q	32.2	Very low	31.5	Very low	92 Å²	92	89.7 Å²	89.7	43%	0.43	51%	0.514	S	S	.	.	P	Polyproline II helix	trans	-98.7	142.6	177.9	-61.4	-136.3	-32.5	0	0	111.1	P325	Q301-P325 WeakPolarHBondContact O-CG 3.36Å
302	P	30.9	Very low	31.8	Very low	83 Å²	83	88.1 Å²	88.1	54%	0.539	49%	0.493	S	S	.	.	P	Polyproline II helix	trans	-71.3	162.3	161.3	30.7	-30.4	0	0	0	110.5	K304	P302-K304 PolarHBondContact O-N 2.78Å
303	D	30	Very low	31.7	Very low	108 Å²	108	84.5 Å²	84.5	58%	0.578	49%	0.485	S	S	*	.	P	Polyproline II helix	trans	-52.8	131.9	-178.7	-63.3	-33.2	0	0	0	111.5
304	K	35.3	Very low	31.7	Very low	105 Å²	105	81.5 Å²	81.5	46%	0.457	48%	0.484	S	S	.	.			trans	-124.5	115.5	177.6	-85	-179.8	179.2	163.6	0	109.7	P302	P302-K304 PolarHBondContact O-N 2.78Å
305	T	29.8	Very low	31.8	Very low	100 Å²	100	80.3 Å²	80.3	61%	0.613	47%	0.473	S	S	*	.			trans	-78.5	118.1	155	22	0	0	0	0	108
306	T	34.2	Very low	31.8	Very low	42 Å²	42	78.9 Å²	78.9	26%	0.258	46%	0.464	S	S	.	.			trans	-145.3	119.1	177.1	-39.4	0	0	0	0	110.6	K308	T306-K308 HydrophobicContact CG2-CG 4.13Å; T306-K308 PolarHBondContact O-N 2.89Å
307	D	32.8	Very low	31.9	Very low	96 Å²	96	80.6 Å²	80.6	51%	0.513	47%	0.474	S	S	.	.			trans	-80.9	95.8	166.1	-75.4	-11.1	0	0	0	108.5
308	K	37.5	Very low	32	Very low	67 Å²	67	82.1 Å²	82.1	29%	0.291	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	117.4	178.9	-110.1	-171.4	173.1	-157.8	0	110.6	T306 E310	T306-K308 HydrophobicContact CG2-CG 4.13Å; T306-K308 PolarHBondContact O-N 2.89Å; K308-E310 IonicContact NZ-OE1 3.22Å; K308-E310 PolarHBondContact NZ-OE1 3.12Å
309	K	34.5	Very low	32.2	Very low	110 Å²	110	83.3 Å²	83.3	48%	0.478	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	93.4	163.9	-152.2	176	-168.9	172	0	108.5
310	E	37.2	Very low	32.1	Very low	19 Å²	19	83 Å²	83	9%	0.089	47%	0.472	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	120.8	-179.2	-122.9	168	-158.4	0	0	109.3	K308 L312	K308-E310 IonicContact NZ-OE1 3.22Å; K308-E310 PolarHBondContact NZ-OE1 3.12Å; E310-L312 HydrophobicContact CB-CD1 4.2Å; E310-L312 HydrophobicContact CB-CG 4.2Å; E310-L312 HydrophobicContact CG-CD1 4.03Å; E310-L312 HydrophobicContact CG-CD2 4.22Å; E310-L312 HydrophobicContact CG-CG 3.93Å; E310-L312 WeakPolarHBondContact OE2-CD1 3.39Å
311	N	33	Very low	32.1	Very low	76 Å²	76	80 Å²	80	41%	0.406	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	110.9	159.7	-80	-32.1	0	0	0	106.3	N288 N334	N288-N311 PolarHBondContact OD1-ND2 3.18Å; N311-N334 PolarHBondContact OD1-ND2 2.87Å
312	L	37.3	Very low	31.9	Very low	22 Å²	22	79.1 Å²	79.1	12%	0.115	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	113.1	179.8	-69.6	162.7	0	0	0	108.1	L289 E310 L335	L289-L312 HydrophobicContact CB-CD2 4.33Å; E310-L312 HydrophobicContact CB-CD1 4.2Å; E310-L312 HydrophobicContact CB-CG 4.2Å; E310-L312 HydrophobicContact CG-CD1 4.03Å; E310-L312 HydrophobicContact CG-CD2 4.22Å; E310-L312 HydrophobicContact CG-CG 3.93Å; E310-L312 WeakPolarHBondContact OE2-CD1 3.39Å; L312-L335 HydrophobicContact CB-CD2 4.23Å; L312-L335 HydrophobicContact CD1-CD2 4.31Å
313	G	28.3	Very low	31.7	Very low	48 Å²	48	80.3 Å²	80.3	50%	0.495	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	125.5	163.1	0	0	0	0	0	107.7
314	G	32.4	Very low	31.8	Very low	43 Å²	43	78.6 Å²	78.6	44%	0.443	46%	0.456	S	S	.	.	S	Bend	trans	141.6	144.4	-178.4	0	0	0	0	0	111.9
315	D	31	Very low	31.6	Very low	112 Å²	112	76.3 Å²	76.3	60%	0.599	45%	0.452	S	S	*	.			trans	-62.9	136.3	179	-68.5	-30.1	0	0	0	110.2
316	K	32.7	Very low	31.7	Very low	88 Å²	88	76.1 Å²	76.1	38%	0.383	45%	0.447	S	S	.	.			trans	-121.2	118.6	177.5	-77.6	-170.7	-179.9	-174.6	0	110.8
317	T	29.7	Very low	31.8	Very low	127 Å²	127	77.2 Å²	77.2	78%	0.779	45%	0.448	S	S	*	.	P	Polyproline II helix	trans	-102.5	117.4	162.7	5.7	0	0	0	0	108.7
318	K	31.6	Very low	31.7	Very low	128 Å²	128	76.7 Å²	76.7	56%	0.557	45%	0.448	S	S	*	.	P	Polyproline II helix	trans	-102.5	132.1	176.3	-90.2	-173	172.6	-174.4	0	111.3
319	P	28.6	Very low	31.6	Very low	76 Å²	76	74.8 Å²	74.8	49%	0.494	44%	0.443	S	S	.	.	P	Polyproline II helix	trans	-70.4	143.4	166	-9.6	25.2	0	0	0	111.1
320	S	28.4	Very low	31.5	Very low	88 Å²	88	74 Å²	74	62%	0.615	44%	0.444	S	S	*	.	S	Bend	trans	-73.7	141.3	176.1	48.8	0	0	0	0	112.8
321	G	25.6	Very low	31.5	Very low	51 Å²	51	76.1 Å²	76.1	53%	0.526	45%	0.453	S	S	.	.			trans	109.2	79.9	158.5	0	0	0	0	0	116.3
322	I	28.8	Very low	31.6	Very low	73 Å²	73	77.5 Å²	77.5	37%	0.374	46%	0.455	S	S	.	.			trans	-149.7	128.8	157	-49	178.6	0	0	0	109.1
323	S	27.3	Very low	31.5	Very low	107 Å²	107	77.3 Å²	77.3	75%	0.748	45%	0.453	S	S	*	.	P	Polyproline II helix	trans	-68.8	119.8	165.7	-36	0	0	0	0	109.2
324	Q	32.5	Very low	31.8	Very low	72 Å²	72	78.5 Å²	78.5	34%	0.336	45%	0.448	S	S	.	.	P	Polyproline II helix	trans	-89.1	149.4	176.2	-57	-130.8	-60.3	0	0	110	P348	Q324-P348 WeakPolarHBondContact O-CG 3.22Å
325	P	31.1	Very low	32	Very low	57 Å²	57	77.5 Å²	77.5	37%	0.37	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-78	167.3	155.1	16.6	-2.6	0	0	0	110.5	Q301 K327	Q301-P325 WeakPolarHBondContact O-CG 3.36Å; P325-K327 PolarHBondContact O-N 3.04Å
326	D	31.4	Very low	31.8	Very low	97 Å²	97	74.5 Å²	74.5	52%	0.519	43%	0.428	S	S	.	.	P	Polyproline II helix	trans	-53.1	134.9	179.5	-66	-31.9	0	0	0	111.3	P348	D326-P348 VanDerWaalsContact OD1-CB 3.26Å; D326-P348 WeakPolarHBondContact OD1-CB 3.24Å
327	K	35.6	Very low	31.7	Very low	64 Å²	64	72.4 Å²	72.4	28%	0.278	43%	0.432	S	S	.	.			trans	-124	114	178.9	-91.2	-179.4	-179.9	161.7	0	109.5	P325	P325-K327 PolarHBondContact O-N 3.04Å
328	T	31.6	Very low	31.8	Very low	85 Å²	85	71.8 Å²	71.8	52%	0.521	42%	0.424	S	S	.	.			trans	-79.6	117.1	153.7	23.2	0	0	0	0	107.8
329	T	33.9	Very low	31.8	Very low	28 Å²	28	69.9 Å²	69.9	17%	0.172	42%	0.416	C	S	.	.			trans	-141.4	117.9	177.8	-41.2	0	0	0	0	110.3	K331	T329-K331 HydrophobicContact CG2-CB 4.44Å; T329-K331 HydrophobicContact CG2-CD 4.34Å; T329-K331 HydrophobicContact CG2-CG 3.86Å; T329-K331 PolarHBondContact O-N 3.15Å
330	D	33.7	Very low	31.9	Very low	93 Å²	93	72.1 Å²	72.1	50%	0.497	43%	0.428	S	S	.	.			trans	-82.6	98.5	164.5	-78	-3.5	0	0	0	108.2
331	K	37.5	Very low	32	Very low	64 Å²	64	73.9 Å²	73.9	28%	0.278	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	117.6	-177.6	-111	-176.6	176.9	-153.1	0	110.6	T329 E333	T329-K331 HydrophobicContact CG2-CB 4.44Å; T329-K331 HydrophobicContact CG2-CD 4.34Å; T329-K331 HydrophobicContact CG2-CG 3.86Å; T329-K331 PolarHBondContact O-N 3.15Å; K331-E333 IonicContact NZ-OE1 3.65Å; K331-E333 PolarHBondContact NZ-OE1 3.18Å
332	K	35	Very low	32.1	Very low	105 Å²	105	75.1 Å²	75.1	46%	0.457	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	89.9	161.7	-153.8	174.7	-170.9	175.9	0	108.5
333	E	35.8	Very low	32.1	Very low	17 Å²	17	75.7 Å²	75.7	8%	0.079	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	121.1	178.3	-113.4	169.6	-172.5	0	0	109.2	K331 L335	K331-E333 IonicContact NZ-OE1 3.65Å; K331-E333 PolarHBondContact NZ-OE1 3.18Å; E333-L335 HydrophobicContact CB-CD1 4.28Å; E333-L335 HydrophobicContact CB-CG 4.17Å; E333-L335 HydrophobicContact CG-CD1 4.18Å; E333-L335 HydrophobicContact CG-CD2 4.31Å; E333-L335 HydrophobicContact CG-CG 4.04Å
334	N	33.4	Very low	32	Very low	73 Å²	73	72.7 Å²	72.7	39%	0.39	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	109.5	157.2	-78.1	-32.1	0	0	0	106.2	N311	N311-N334 PolarHBondContact OD1-ND2 2.87Å
335	L	36	Very low	31.9	Very low	22 Å²	22	72.5 Å²	72.5	12%	0.115	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	115.4	178.2	-68.3	165.8	0	0	0	108	L312 E333 L358	L312-L335 HydrophobicContact CB-CD2 4.23Å; L312-L335 HydrophobicContact CD1-CD2 4.31Å; E333-L335 HydrophobicContact CB-CD1 4.28Å; E333-L335 HydrophobicContact CB-CG 4.17Å; E333-L335 HydrophobicContact CG-CD1 4.18Å; E333-L335 HydrophobicContact CG-CD2 4.31Å; E333-L335 HydrophobicContact CG-CG 4.04Å; L335-L358 HydrophobicContact CB-CD2 4.1Å; L335-L358 HydrophobicContact CD1-CD2 4.06Å
336	G	27.8	Very low	31.8	Very low	49 Å²	49	74.7 Å²	74.7	51%	0.505	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	123.9	162.1	0	0	0	0	0	107.5
337	G	30.9	Very low	31.8	Very low	44 Å²	44	73.1 Å²	73.1	45%	0.454	43%	0.428	S	S	.	.	S	Bend	trans	141.9	144.7	-178.1	0	0	0	0	0	111.7
338	D	31.2	Very low	31.6	Very low	114 Å²	114	72 Å²	72	61%	0.61	43%	0.428	S	S	*	.			trans	-65.6	132.1	-179.7	-66.8	-29.2	0	0	0	110
339	K	32.5	Very low	31.6	Very low	89 Å²	89	72.5 Å²	72.5	39%	0.387	43%	0.427	S	S	.	.	B	Isolated β-bridge	trans	-111.6	128.3	176.9	-86.7	-173.7	177.8	-179.2	0	110.3
340	T	30.3	Very low	31.6	Very low	122 Å²	122	74 Å²	74	75%	0.748	43%	0.431	S	S	*	.			trans	-116.6	111.3	164.2	-34.6	0	0	0	0	107.7
341	E	30.2	Very low	31.5	Very low	126 Å²	126	73.5 Å²	73.5	59%	0.589	43%	0.432	S	S	*	.	P	Polyproline II helix	trans	-99.4	130.2	176.4	-91.6	-174.8	172	0	0	110.8
342	P	27.8	Very low	31.3	Very low	77 Å²	77	71.7 Å²	71.7	50%	0.5	43%	0.426	S	S	.	.	P	Polyproline II helix	trans	-77.6	140.1	169.6	29	-29.5	0	0	0	111.5
343	S	28.7	Very low	31.2	Very low	85 Å²	85	71.1 Å²	71.1	59%	0.594	43%	0.428	S	S	*	.	S	Bend	trans	-65.4	136.9	176.9	51.6	0	0	0	0	113.2
344	G	26.2	Very low	31.2	Very low	44 Å²	44	73.2 Å²	73.2	45%	0.454	44%	0.437	S	S	.	.			trans	120.1	76.2	156.9	0	0	0	0	0	116.1
345	I	29	Very low	31.2	Very low	67 Å²	67	75.3 Å²	75.3	34%	0.344	44%	0.442	S	S	.	.			trans	-149.5	127.3	160.9	-49.1	177.9	0	0	0	110	Q347	I345-Q347 PolarHBondContact O-N 3.31Å
346	S	28.6	Very low	31.1	Very low	103 Å²	103	74.9 Å²	74.9	72%	0.72	44%	0.44	S	S	*	.	P	Polyproline II helix	trans	-66.8	120.6	166.7	-40.1	0	0	0	0	109.7
347	Q	32.5	Very low	31.3	Very low	65 Å²	65	76.4 Å²	76.4	30%	0.304	44%	0.436	S	S	.	.	P	Polyproline II helix	trans	-89.3	140.7	177.7	-62.3	-96.4	-77.6	0	0	109.7	I345 P371	I345-Q347 PolarHBondContact O-N 3.31Å; Q347-P371 WeakPolarHBondContact O-CG 3.43Å
348	P	30.8	Very low	31.3	Very low	41 Å²	41	75.7 Å²	75.7	27%	0.266	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-72.1	168.2	155.8	-1.8	18.6	0	0	0	110.6	Q324 D326 K350	Q324-P348 WeakPolarHBondContact O-CG 3.22Å; D326-P348 VanDerWaalsContact OD1-CB 3.26Å; D326-P348 WeakPolarHBondContact OD1-CB 3.24Å; P348-K350 PolarHBondContact O-N 3.41Å
349	D	32	Very low	31.1	Very low	95 Å²	95	72.7 Å²	72.7	51%	0.508	42%	0.418	S	S	.	.	P	Polyproline II helix	trans	-55.8	132	176.9	-69.3	-33.2	0	0	0	110.9	P371	D349-P371 WeakPolarHBondContact OD1-CB 3.31Å
350	K	34.1	Very low	31	Very low	60 Å²	60	71 Å²	71	26%	0.261	43%	0.426	S	S	.	.			trans	-119.7	112.7	180	-90.9	-178.5	176.9	169.1	0	109.3	P348	P348-K350 PolarHBondContact O-N 3.41Å
351	T	30.8	Very low	30.9	Very low	82 Å²	82	71.2 Å²	71.2	50%	0.503	42%	0.422	S	S	.	.			trans	-81.3	111.4	155	24.4	0	0	0	0	107.9
352	T	33.5	Very low	30.9	Very low	25 Å²	25	71.1 Å²	71.1	15%	0.153	42%	0.42	C	S	.	.			trans	-133.7	115.5	179.3	-45.8	0	0	0	0	110.4	K354	T352-K354 HydrophobicContact CG2-CB 4.17Å; T352-K354 HydrophobicContact CG2-CD 4.33Å; T352-K354 HydrophobicContact CG2-CG 3.84Å; T352-K354 PolarHBondContact O-N 3.39Å
353	D	32.9	Very low	31	Very low	93 Å²	93	73.5 Å²	73.5	50%	0.497	43%	0.433	S	S	.	.			trans	-83.2	97.1	162.8	-80.4	-5.9	0	0	0	108.2
354	K	35.7	Very low	31.1	Very low	62 Å²	62	77 Å²	77	27%	0.27	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	116.2	-176	-122.4	-176.3	-180	-154.7	0	110.1	T352 E356	T352-K354 HydrophobicContact CG2-CB 4.17Å; T352-K354 HydrophobicContact CG2-CD 4.33Å; T352-K354 HydrophobicContact CG2-CG 3.84Å; T352-K354 PolarHBondContact O-N 3.39Å; K354-E356 VanDerWaalsContact NZ-CD 3.29Å; K354-E356 IonicContact NZ-OE1 3.99Å; K354-E356 PolarHBondContact NZ-OE1 3.1Å; K354-E356 IonicContact NZ-OE2 2.75Å; K354-E356 PolarHBondContact NZ-OE2 3.16Å
355	K	33.8	Very low	31.2	Very low	116 Å²	116	79 Å²	79	50%	0.504	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	88.7	163.3	-149.4	174	-170	172.1	0	108.3
356	E	33.5	Very low	31.2	Very low	13 Å²	13	81.3 Å²	81.3	6%	0.061	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	122.6	-178.6	-123	170.4	177.9	0	0	109.6	K354 L358	K354-E356 VanDerWaalsContact NZ-CD 3.29Å; K354-E356 IonicContact NZ-OE1 3.99Å; K354-E356 PolarHBondContact NZ-OE1 3.1Å; K354-E356 IonicContact NZ-OE2 2.75Å; K354-E356 PolarHBondContact NZ-OE2 3.16Å; E356-L358 HydrophobicContact CB-CG 4.26Å; E356-L358 HydrophobicContact CG-CD1 4.13Å; E356-L358 HydrophobicContact CG-CD2 4.09Å; E356-L358 HydrophobicContact CG-CG 3.87Å
357	N	32	Very low	31.1	Very low	82 Å²	82	79.1 Å²	79.1	44%	0.439	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	104.7	158.9	-80.2	-26.7	0	0	0	106.4
358	L	32.1	Very low	30.8	Very low	29 Å²	29	80.1 Å²	80.1	15%	0.152	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	117.4	177.8	-67.3	171.5	0	0	0	108.5	L335 E356 L381	L335-L358 HydrophobicContact CB-CD2 4.1Å; L335-L358 HydrophobicContact CD1-CD2 4.06Å; E356-L358 HydrophobicContact CB-CG 4.26Å; E356-L358 HydrophobicContact CG-CD1 4.13Å; E356-L358 HydrophobicContact CG-CD2 4.09Å; E356-L358 HydrophobicContact CG-CG 3.87Å; L358-L381 HydrophobicContact CB-CD2 4.42Å; L358-L381 HydrophobicContact CD1-CD2 4.48Å
359	G	26.8	Very low	30.8	Very low	51 Å²	51	83.7 Å²	83.7	53%	0.526	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	118.4	161.5	0	0	0	0	0	107.6
360	G	29.6	Very low	30.7	Very low	53 Å²	53	84.9 Å²	84.9	55%	0.546	50%	0.496	S	S	.	.	S	Bend	trans	146.9	145.8	-178.4	0	0	0	0	0	111.8
361	D	28.9	Very low	30.5	Very low	127 Å²	127	84.6 Å²	84.6	68%	0.679	50%	0.5	S	S	*	.			trans	-68.3	136.4	-178.8	-69.5	-31.8	0	0	0	110.6
362	K	30.5	Very low	30.5	Very low	124 Å²	124	86.1 Å²	86.1	54%	0.539	51%	0.505	S	S	.	.	B	Isolated β-bridge	trans	-112.5	132.9	176.6	-87.3	-173.6	177	179.9	0	110.5
363	T	28.7	Very low	30.5	Very low	126 Å²	126	89.9 Å²	89.9	77%	0.773	52%	0.519	S	S	*	.			trans	-122.4	112.8	164.7	-32.6	0	0	0	0	107.7
364	E	30.8	Very low	30.3	Very low	160 Å²	160	89.9 Å²	89.9	75%	0.748	52%	0.523	S	S	*	.	P	Polyproline II helix	trans	-99.8	128.7	177.9	-90.7	-179.1	-179.4	0	0	110.7
365	P	28.3	Very low	30	Very low	84 Å²	84	89.8 Å²	89.8	55%	0.545	53%	0.528	S	S	.	.	P	Polyproline II helix	trans	-82.1	140.8	164.7	11.7	2.1	0	0	0	111.8
366	S	28.5	Very low	29.8	Very low	116 Å²	116	89.9 Å²	89.9	81%	0.811	53%	0.534	S	S	*	.	P	Polyproline II helix	trans	-68.5	138.7	-177.8	52.6	0	0	0	0	114.7
367	G	26.5	Very low	29.7	Very low	58 Å²	58	94.6 Å²	94.6	60%	0.598	55%	0.554	S	S	*	*			trans	115.2	101.1	157.9	0	0	0	0	0	114.7
368	I	27.8	Very low	29.7	Very low	86 Å²	86	98.1 Å²	98.1	44%	0.441	57%	0.566	S	S	.	*			trans	-172.3	134.8	147.4	-79.1	133.8	0	0	0	107
369	S	29.8	Very low	29.6	Very low	115 Å²	115	100 Å²	100	80%	0.804	57%	0.573	S	S	*	*	P	Polyproline II helix	trans	-64.3	126.4	170.1	-35.4	0	0	0	0	111.1
370	Q	30.8	Very low	29.7	Very low	120 Å²	120	103.5 Å²	103.5	56%	0.561	58%	0.58	S	S	*	*	P	Polyproline II helix	trans	-98.2	137.2	176.9	-64.1	-157.3	-16.7	0	0	111.2	K373	Q370-K373 VanDerWaalsContact CD-NZ 3.29Å; Q370-K373 VanDerWaalsContact NE2-NZ 3.13Å; Q370-K373 VanDerWaalsContact OE1-CE 3.31Å
371	P	29.7	Very low	29.8	Very low	54 Å²	54	105.2 Å²	105.2	35%	0.351	58%	0.576	S	S	.	*	P	Polyproline II helix	trans	-77.9	167.3	159.6	29.7	-22.4	0	0	0	110.8	Q347 D349 K373	Q347-P371 WeakPolarHBondContact O-CG 3.43Å; D349-P371 WeakPolarHBondContact OD1-CB 3.31Å; P371-K373 PolarHBondContact O-N 3.23Å
372	D	31	Very low	29.7	Very low	115 Å²	115	102.3 Å²	102.3	62%	0.615	58%	0.576	S	S	*	*	P	Polyproline II helix	trans	-57.1	121.6	-166.4	-72.2	-36.9	0	0	0	112.6
373	K	31.7	Very low	29.6	Very low	103 Å²	103	99.3 Å²	99.3	45%	0.448	58%	0.58	S	S	.	*			trans	-99.5	111.6	175.6	-86	179.7	178.4	163.1	0	110.4	Q370 P371	Q370-K373 VanDerWaalsContact CD-NZ 3.29Å; Q370-K373 VanDerWaalsContact NE2-NZ 3.13Å; Q370-K373 VanDerWaalsContact OE1-CE 3.31Å; P371-K373 PolarHBondContact O-N 3.23Å
374	T	29.1	Very low	29.6	Very low	94 Å²	94	101.1 Å²	101.1	58%	0.577	59%	0.585	S	S	*	*			trans	-81.2	112.4	153	34.6	0	0	0	0	108
375	T	29.4	Very low	29.4	Very low	59 Å²	59	100.9 Å²	100.9	36%	0.362	58%	0.582	S	S	.	*			trans	-131.3	111.5	179.6	-46.3	0	0	0	0	109.6	K377	T375-K377 VanDerWaalsContact C-N 3.34Å; T375-K377 HydrophobicContact CG2-CB 4.07Å; T375-K377 HydrophobicContact CG2-CD 4.42Å; T375-K377 HydrophobicContact CG2-CG 3.95Å; T375-K377 PolarHBondContact O-N 2.77Å; T375-K377 VanDerWaalsContact O-N 3.12Å
376	D	30.4	Very low	29.4	Very low	119 Å²	119	103.5 Å²	103.5	64%	0.636	60%	0.596	S	S	*	*			trans	-81	88.1	163.2	-82.7	-25.2	0	0	0	108.6
377	K	30.4	Very low	29.4	Very low	112 Å²	112	106.1 Å²	106.1	49%	0.487	60%	0.596	S	S	.	*	B	Isolated β-bridge	trans	-90	116.4	-176.6	-131.5	-179.3	-178.9	-155.9	0	110.2	T375 E379	T375-K377 VanDerWaalsContact C-N 3.34Å; T375-K377 HydrophobicContact CG2-CB 4.07Å; T375-K377 HydrophobicContact CG2-CD 4.42Å; T375-K377 HydrophobicContact CG2-CG 3.95Å; T375-K377 PolarHBondContact O-N 2.77Å; T375-K377 VanDerWaalsContact O-N 3.12Å; K377-E379 WeakPolarHBondContact CD-OE2 3.4Å; K377-E379 VanDerWaalsContact CE-CD 3.48Å; K377-E379 WeakPolarHBondContact CE-OE1 3.42Å; K377-E379 WeakPolarHBondContact CE-OE2 2.95Å; K377-E379 IonicContact NZ-OE1 2.87Å; K377-E379 PolarHBondContact NZ-OE1 2.91Å; K377-E379 IonicContact NZ-OE2 2.59Å; K377-E379 PolarHBondContact NZ-OE2 2.78Å
378	K	32.7	Very low	29.4	Very low	156 Å²	156	109.3 Å²	109.3	68%	0.678	61%	0.606	S	S	*	*			trans	-108.1	86.5	162.7	-144.9	173.8	-168.1	168.8	0	108.4
379	E	29.5	Very low	29.5	Very low	67 Å²	67	111.2 Å²	111.2	31%	0.313	63%	0.627	S	S	.	*			trans	-96.4	125.1	-175.7	-131.7	174	-177.8	0	0	110.4	K377 L381	K377-E379 WeakPolarHBondContact CD-OE2 3.4Å; K377-E379 VanDerWaalsContact CE-CD 3.48Å; K377-E379 WeakPolarHBondContact CE-OE1 3.42Å; K377-E379 WeakPolarHBondContact CE-OE2 2.95Å; K377-E379 IonicContact NZ-OE1 2.87Å; K377-E379 PolarHBondContact NZ-OE1 2.91Å; K377-E379 IonicContact NZ-OE2 2.59Å; K377-E379 PolarHBondContact NZ-OE2 2.78Å; E379-L381 HydrophobicContact CB-CG 4.4Å; E379-L381 HydrophobicContact CG-CD1 4.18Å; E379-L381 HydrophobicContact CG-CD2 4.05Å; E379-L381 HydrophobicContact CG-CG 3.82Å
380	N	30.3	Very low	29.3	Very low	125 Å²	125	108.8 Å²	108.8	67%	0.668	62%	0.62	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-106	101.2	161.5	-83.2	-22.4	0	0	0	106.7
381	L	30.3	Very low	29.2	Very low	90 Å²	90	111 Å²	111	47%	0.471	63%	0.634	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-102.6	121.7	177.6	-67.5	172.8	0	0	0	109.6	L358 E379	L358-L381 HydrophobicContact CB-CD2 4.42Å; L358-L381 HydrophobicContact CD1-CD2 4.48Å; E379-L381 HydrophobicContact CB-CG 4.4Å; E379-L381 HydrophobicContact CG-CD1 4.18Å; E379-L381 HydrophobicContact CG-CD2 4.05Å; E379-L381 HydrophobicContact CG-CG 3.82Å
382	G	26.5	Very low	29.2	Very low	65 Å²	65	113.8 Å²	113.8	67%	0.67	66%	0.655	S	S	*	*			trans	-124.2	111.1	162.4	0	0	0	0	0	108.3
383	G	28.4	Very low	29	Very low	61 Å²	61	115.7 Å²	115.7	63%	0.629	66%	0.66	S	S	*	*	S	Bend	trans	153.1	137.9	-178.9	0	0	0	0	0	111.3
384	D	28.8	Very low	28.8	Very low	164 Å²	164	115.5 Å²	115.5	88%	0.877	67%	0.669	S	S	*	*			trans	-68.1	136.6	-173.4	-76.7	-36.6	0	0	0	112.3
385	K	28.1	Very low	28.9	Very low	156 Å²	156	118.3 Å²	118.3	68%	0.678	68%	0.681	S	S	*	*			trans	-101.5	136.9	176.4	-80.7	-175.2	177.2	-178.9	0	110.9
386	T	27.8	Very low	28.8	Very low	138 Å²	138	123 Å²	123	85%	0.847	70%	0.696	S	S	*	*			trans	-127.5	114.2	162.8	-32.3	0	0	0	0	108.5
387	E	28.1	Very low	28.7	Very low	171 Å²	171	123.4 Å²	123.4	80%	0.799	70%	0.703	S	S	*	*			trans	-102.4	140.1	176.5	-85.2	179.8	176.6	0	0	110.7
388	P	26.9	Very low	28.5	Very low	126 Å²	126	123.5 Å²	123.5	82%	0.818	71%	0.713	S	S	*	*			trans	-114.6	138.8	150.7	1.7	19.4	0	0	0	112.9
389	S	29.4	Very low	28.3	Very low	126 Å²	126	123.3 Å²	123.3	88%	0.881	72%	0.72	S	S	*	*			trans	-59.8	138.6	-174	51	0	0	0	0	116.7
390	G	27.2	Very low	28.3	Very low	64 Å²	64	129.6 Å²	129.6	66%	0.66	75%	0.746	S	S	*	*			trans	177.5	86.2	166.6	0	0	0	0	0	116.6
391	I	27.3	Very low	28.2	Very low	167 Å²	167	133.3 Å²	133.3	86%	0.856	76%	0.756	S	S	*	*			trans	83.6	104.1	142.6	-53	174.2	0	0	0	119.7
392	S	30.4	Very low	28.3	Very low	112 Å²	112	138.2 Å²	138.2	78%	0.783	78%	0.777	S	S	*	*			trans	49.8	119.7	146.5	50.8	0	0	0	0	123.1
393	Q	26.3	Very low	28.3	Very low	155 Å²	155	142.6 Å²	142.6	72%	0.724	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-100.8	151.9	169.8	-68.2	-171.7	-33.5	0	0	112.4
394	P	27.4	Very low	28.3	Very low	99 Å²	99	147.5 Å²	147.5	64%	0.643	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-97.5	163.6	145.7	2.5	18.7	0	0	0	111.7
395	D	31.1	Very low	28.4	Very low	153 Å²	153	147.7 Å²	147.7	82%	0.818	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-53.4	129.3	-157.4	-68.8	-52.2	0	0	0	118.1
396	K	27.5	Very low	28.4	Very low	157 Å²	157	143.9 Å²	143.9	68%	0.683	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-88.6	116.9	164.5	-83.3	-179.9	177.1	177.5	0	110.8
397	T	27.9	Very low	28.6	Very low	128 Å²	128	145.8 Å²	145.8	79%	0.785	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-89.1	119.7	156.5	31.4	0	0	0	0	109.3
398	T	26.8	Very low	28.9	Very low	114 Å²	114	142.6 Å²	142.6	70%	0.699	80%	0.799	S	S	*	*			trans	-116	97.4	174.5	-54.3	0	0	0	0	108	K400	T398-K400 PolarHBondContact O-N 2.85Å
399	D	29	Very low	29.1	Very low	152 Å²	152	141.6 Å²	141.6	81%	0.813	80%	0.795	S	S	*	*			trans	-93.2	96.5	171.9	-83.3	-30.8	0	0	0	109.9
400	K	28.2	Very low	29.4	Very low	198 Å²	198	142.8 Å²	142.8	86%	0.861	79%	0.79	S	S	*	*			trans	-87.5	101.2	171.5	-161.6	-178.9	-169.1	179.7	0	107.4	T398	T398-K400 PolarHBondContact O-N 2.85Å
401	K	29.8	Very low	29.8	Very low	204 Å²	204	145.8 Å²	145.8	89%	0.887	79%	0.79	S	S	*	*			trans	-144.4	125.4	170.5	-129.2	175.5	-175.8	178.6	0	114.7
402	E	30.8	Very low	30.1	Very low	192 Å²	192	149.1 Å²	149.1	90%	0.897	79%	0.792	S	S	*	*			trans	-71.8	141.5	179.7	-62	170.5	149.1	0	0	111
403	N	27.6	Very low	30.5	Very low	158 Å²	158	150.3 Å²	150.3	85%	0.845	79%	0.787	S	S	*	*			trans	-3.4	129.1	171.1	-95.1	-16.2	0	0	0	118.8
404	L	29.1	Very low	31.3	Very low	163 Å²	163	147.7 Å²	147.7	85%	0.853	79%	0.786	S	S	*	*			trans	-173.4	110.1	133.6	-97.1	156.3	0	0	0	111.8
405	L	29.1	Very low	32	Very low	169 Å²	169	152 Å²	152	89%	0.885	80%	0.798	S	S	*	*			trans	25.7	124.7	146.1	-59	167.5	0	0	0	121.1
406	G	28.8	Very low	32.2	Very low	76 Å²	76	151.7 Å²	151.7	78%	0.784	80%	0.796	S	S	*	*			trans	117.6	94.9	134	0	0	0	0	0	120.2
407	L	32.2	Very low	32.7	Very low	177 Å²	177	152.7 Å²	152.7	93%	0.927	80%	0.803	S	S	*	*			trans	57.4	152.8	143.9	-70	169.4	0	0	0	123.2
408	P	33.4	Very low	33.5	Very low	104 Å²	104	154 Å²	154	68%	0.675	81%	0.805	S	S	*	*			trans	-119.1	172	-151.4	41.8	-27.8	0	0	0	114.9
409	S	32.8	Very low	34	Very low	106 Å²	106	155.2 Å²	155.2	74%	0.741	81%	0.806	S	S	*	*				156.4	155.1	127.4	-67.3	0	0	0	0	114.1
410	I	34.4	Very low	34.3	Very low	150 Å²	150	157 Å²	157	77%	0.769	81%	0.807	S	S	*	*			trans	105.1	90.9	151	-45.8	-175.9	0	0	0	119
411	I	35.1	Very low	34.6	Very low	127 Å²	127	154.2 Å²	154.2	65%	0.651	80%	0.801	S	S	*	*				42	134.5	119.3	-50.9	164.2	0	0	0	120.1	I413	I411-I413 HydrophobicContact CG2-CD1 4.05Å; I411-I413 HydrophobicContact CG2-CG1 3.71Å
412	R	34.3	Very low	35	Very low	238 Å²	238	152.8 Å²	152.8	90%	0.898	80%	0.803	S	S	*	*			trans	-137.7	126.6	132.5	-72	-161.2	-176	-141.3	1.1	112.6
413	I	38.6	Very low	35	Very low	136 Å²	136	153.4 Å²	153.4	70%	0.697	80%	0.798	S	S	*	*			trans	-90.3	86.2	175.5	-63.2	159.6	0	0	0	107.5	I411 L416	I411-I413 HydrophobicContact CG2-CD1 4.05Å; I411-I413 HydrophobicContact CG2-CG1 3.71Å; I413-L416 HydrophobicContact CG2-CD1 3.91Å
414	S	43.3	Very low	35.4	Very low	100 Å²	100	150.9 Å²	150.9	70%	0.699	80%	0.799	S	S	*	*			trans	-126.4	10.7	-179.4	45.7	0	0	0	0	115.2
415	E	41.6	Very low	35.6	Very low	189 Å²	189	145.6 Å²	145.6	88%	0.883	79%	0.785	S	S	*	*			trans	-128.7	22.8	-177.3	-64.9	-173.1	159.6	0	0	114.7	E417	E415-E417 PolarHBondContact O-N 3Å; E415-E417 VanDerWaalsContact O-N 3.11Å
416	L	35.5	Very low	36	Very low	148 Å²	148	146.9 Å²	146.9	78%	0.775	79%	0.785	S	S	*	*			trans	-70.7	93.5	159.2	-92.9	159	0	0	0	109.1	I413	I413-L416 HydrophobicContact CG2-CD1 3.91Å
417	E	39.3	Very low	36.2	Very low	178 Å²	178	149 Å²	149	83%	0.832	79%	0.787	S	S	*	*			trans	-172.9	73.9	158.3	-109.4	168.9	-154	0	0	111.6	E415	E415-E417 PolarHBondContact O-N 3Å; E415-E417 VanDerWaalsContact O-N 3.11Å
418	N	43.5	Very low	36.4	Very low	154 Å²	154	148.2 Å²	148.2	82%	0.824	78%	0.782	S	S	*	*			trans	-167.7	87.2	155.4	-90.4	-43.7	0	0	0	108.2
419	L	37.3	Very low	36.3	Very low	141 Å²	141	153.5 Å²	153.5	74%	0.738	79%	0.79	S	S	*	*				76	113.6	97.6	-96.9	98.2	0	0	0	115.7
420	K	34.8	Very low	36.5	Very low	188 Å²	188	151.6 Å²	151.6	82%	0.817	78%	0.781	S	S	*	*			trans	87.8	80.1	150	-69.1	-178.5	176	177.2	0	119.3
421	L	35.2	Very low	36.6	Very low	140 Å²	140	149.5 Å²	149.5	73%	0.733	78%	0.78	S	S	*	*			trans	-20.2	128.9	136.2	-80.2	133.6	0	0	0	116.2	Y423	L421-Y423 HydrophobicContact CD2-CD2 3.58Å; L421-Y423 HydrophobicContact CD2-CE2 4.22Å; L421-Y423 HydrophobicContact CD2-CG 4.3Å
422	N	37.6	Very low	36.5	Very low	175 Å²	175	152 Å²	152	94%	0.936	79%	0.786	S	S	*	*			trans	-132.7	110.8	137	-115.1	-9.6	0	0	0	107.5
423	Y	31.8	Very low	37	Very low	205 Å²	205	147 Å²	147	80%	0.804	78%	0.784	S	S	*	*			trans	-104.1	127.3	-173.4	-135.7	-103.3	0	0	0	108.4	L421	L421-Y423 HydrophobicContact CD2-CD2 3.58Å; L421-Y423 HydrophobicContact CD2-CE2 4.22Å; L421-Y423 HydrophobicContact CD2-CG 4.3Å
424	A	35.4	Very low	37.3	Very low	104 Å²	104	146.2 Å²	146.2	86%	0.86	79%	0.791	S	S	*	*			trans	-150.5	95.6	155.7	0	0	0	0	0	109
425	G	34.2	Very low	37.1	Very low	53 Å²	53	144.9 Å²	144.9	55%	0.546	79%	0.793	S	S	.	*			trans	31.4	114.1	158.2	0	0	0	0	0	119.5
426	H	36.6	Very low	37.1	Very low	195 Å²	195	147.1 Å²	147.1	90%	0.903	79%	0.793	S	S	*	*				-157.8	128.1	111	-101.9	68.9	0	0	0	108.3
427	C	33.1	Very low	37.4	Very low	121 Å²	121	144 Å²	144	82%	0.818	78%	0.784	S	S	*	*			trans	-66.3	132.2	-175.7	-63.2	0	0	0	0	111.5	Y429	C427-Y429 PolarHBondContact O-N 2.6Å
428	I	35.7	Very low	37.5	Very low	160 Å²	160	142.4 Å²	142.4	82%	0.821	78%	0.782	S	S	*	*			trans	-75.9	115.1	164	-59.9	173.7	0	0	0	107.2	A430	I428-A430 PolarHBondContact O-N 3.23Å
429	Y	33.2	Very low	37.6	Very low	215 Å²	215	142.5 Å²	142.5	84%	0.843	78%	0.782	S	S	*	*			trans	-85.2	100.8	162.1	-108.1	-90.3	0	0	0	108.1	C427	C427-Y429 PolarHBondContact O-N 2.6Å
430	A	35.5	Very low	38.2	Very low	67 Å²	67	148.8 Å²	148.8	55%	0.554	81%	0.808	S	S	*	*			trans	-92.2	103.8	162.8	0	0	0	0	0	107.9	I428 F432	I428-A430 PolarHBondContact O-N 3.23Å; A430-F432 HydrophobicContact CB-CE2 4.17Å
431	S	36.5	Very low	38.3	Very low	106 Å²	106	146.9 Å²	146.9	74%	0.741	81%	0.807	S	S	*	*			trans	-85.3	107	171.7	-53.3	0	0	0	0	108.7
432	F	34.2	Very low	38.5	Very low	180 Å²	180	147.2 Å²	147.2	79%	0.789	81%	0.811	S	S	*	*			trans	-85.6	136	165.4	-70.6	-88	0	0	0	109.3	A430 S434	A430-F432 HydrophobicContact CB-CE2 4.17Å; F432-S434 PolarHBondContact O-N 2.86Å; F432-S434 VanDerWaalsContact O-N 3.13Å
433	P	44.2	Very low	38.5	Very low	132 Å²	132	145.7 Å²	145.7	86%	0.857	80%	0.804	S	S	*	*			trans	-69.2	108.9	164.9	-8.7	24.2	0	0	0	108.8
434	S	44.4	Very low	38.9	Very low	119 Å²	119	142.2 Å²	142.2	83%	0.832	80%	0.804	S	S	*	*			trans	-78.9	140.6	167	52.4	0	0	0	0	111.1	F432	F432-S434 PolarHBondContact O-N 2.86Å; F432-S434 VanDerWaalsContact O-N 3.13Å
435	G	40.1	Very low	39.2	Very low	73 Å²	73	144.6 Å²	144.6	75%	0.753	80%	0.801	S	S	*	*			trans	118.6	92.8	161.3	0	0	0	0	0	112.6
436	R	42.1	Very low	39.5	Very low	235 Å²	235	150.7 Å²	150.7	89%	0.887	82%	0.818	S	S	*	*				93.7	130.6	57.9	-172.5	-178.6	-173.6	139.1	5.1	111.6
437	S	41.3	Very low	39.7	Very low	84 Å²	84	147.5 Å²	147.5	59%	0.587	81%	0.812	S	S	*	*			trans	64.4	108.5	161.2	48.6	0	0	0	0	116
438	D	40.4	Very low	40.2	Very low	144 Å²	144	149.5 Å²	149.5	77%	0.77	81%	0.811	S	S	*	*				59.7	108.2	73.8	-56.9	-37.7	0	0	0	110.6
439	D	46.8	Very low	40.6	Very low	156 Å²	156	148.7 Å²	148.7	83%	0.834	81%	0.81	S	S	*	*				166.4	130.4	118.1	-79.3	-30.8	0	0	0	110
440	E	48.4	Very low	41.3	Very low	273 Å²	273	142.6 Å²	142.6	100%	1.276	81%	0.807	S	S	*	*			trans	42.1	0	163.5	-77.4	-177.7	134.7	0	0	122.3

Retrieved 440 of 440 residues in 266.7 ms (Link to these results)

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