A0A096NBB4_PAPAN Loading...

Ras-related GTP-binding protein

Guanine nucleotide-binding protein that plays a crucial role in the cellular response to amino acid availability through regulation of the mTORC1 signaling cascade.

AlphaFold DB (G7NRK0), UniProt , Accession A0A096NBB4, Species PAPAN (Papio anubis, Olive baboon), Gene RRAGB, Length 374 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.8	Very low	30	Very low	235 Å²	235	155.2 Å²	155.2	100%	1.158	79%	0.791	S	S	*	*				0	135.4	0	-85.2	170.2	156.3	0	0	106.9
2	E	29.2	Very low	30.2	Very low	157 Å²	157	155.3 Å²	155.3	73%	0.734	78%	0.782	S	S	*	*			trans	-70.6	168.2	-172.5	-64.6	88.7	148.9	0	0	112.3
3	E	28.7	Very low	30.1	Very low	186 Å²	186	158.5 Å²	158.5	87%	0.869	79%	0.793	S	S	*	*			trans	29.7	145.8	131.2	-57.4	170	163.8	0	0	119.2
4	S	29.4	Very low	30.4	Very low	101 Å²	101	158.4 Å²	158.4	71%	0.706	80%	0.796	S	S	*	*			cis	-136.2	-151.3	24.1	56.2	0	0	0	0	110.6
5	D	29.5	Very low	30.5	Very low	139 Å²	139	157.7 Å²	157.7	74%	0.743	80%	0.803	S	S	*	*			cis	-154.7	-156.4	12.6	-144.4	-75.2	0	0	0	112.6
6	S	31.3	Very low	30.6	Very low	86 Å²	86	151.8 Å²	151.8	60%	0.601	79%	0.793	S	S	*	*			trans	-97.2	153.5	-161.1	50.8	0	0	0	0	117.7
7	E	30.4	Very low	30.9	Very low	176 Å²	176	150.6 Å²	150.6	82%	0.822	80%	0.797	S	S	*	*			trans	45.8	132.3	139.3	-62.3	-170.6	139.3	0	0	123.7
8	K	33.5	Very low	31.1	Very low	209 Å²	209	155.2 Å²	155.2	91%	0.909	80%	0.802	S	S	*	*			trans	-150.9	163	132.9	-125.3	165.8	-172.3	169.1	0	112.8
9	T	28.1	Very low	31.2	Very low	115 Å²	115	156.7 Å²	156.7	71%	0.706	81%	0.807	S	S	*	*			trans	-121.6	165.8	-153.8	30.4	0	0	0	0	115.5
10	M	29.1	Very low	31.6	Very low	162 Å²	162	156.4 Å²	156.4	80%	0.798	81%	0.807	S	S	*	*			trans	79.3	123.4	154.5	-80.7	176.8	160.6	0	0	121.2
11	E	28.6	Very low	31.7	Very low	141 Å²	141	154.7 Å²	154.7	66%	0.659	81%	0.806	S	S	*	*			trans	61.6	147.6	137.2	-57.8	-160.1	159.9	0	0	119.9
12	K	31.4	Very low	31.9	Very low	157 Å²	157	149.7 Å²	149.7	68%	0.683	79%	0.791	S	S	*	*			cis	-164	155.9	-9.5	-113	168.6	-170.4	146.8	0	106.8
13	E	29.3	Very low	32.4	Very low	196 Å²	196	150.6 Å²	150.6	92%	0.916	80%	0.8	S	S	*	*				162.9	162.6	126.7	-88.6	-169.5	156.5	0	0	113.4
14	N	34.3	Very low	32.5	Very low	158 Å²	158	145.1 Å²	145.1	85%	0.845	79%	0.793	S	S	*	*			trans	-93	155.5	178.6	-80	-50.9	0	0	0	111.6
15	V	32.1	Very low	32.5	Very low	147 Å²	147	149.4 Å²	149.4	89%	0.891	80%	0.802	S	S	*	*				173.3	151.2	123.4	153.9	0	0	0	0	108.7
16	G	31.4	Very low	32.8	Very low	63 Å²	63	148.1 Å²	148.1	65%	0.649	80%	0.802	S	S	*	*			trans	-79.6	-159.8	178.6	0	0	0	0	0	114.1
17	P	36.9	Very low	33	Very low	133 Å²	133	153.4 Å²	153.4	86%	0.864	82%	0.817	S	S	*	*			cis	-128	-166.2	24.4	42.2	-26.6	0	0	0	114.7
18	R	34.3	Very low	33	Very low	232 Å²	232	148.1 Å²	148.1	88%	0.875	81%	0.809	S	S	*	*			trans	-65.3	154.7	174.9	-66.1	175.3	173.8	164.6	-4.3	112.8
19	M	31.7	Very low	32.9	Very low	185 Å²	185	143.5 Å²	143.5	91%	0.911	80%	0.804	S	S	*	*			trans	-130.3	141.7	153.7	-74.3	-169.2	174.3	0	0	109.7
20	D	40.4	Very low	33	Very low	150 Å²	150	145 Å²	145	80%	0.802	81%	0.806	S	S	*	*			trans	-96.9	140.6	174.3	-57.2	-60.9	0	0	0	110.8
21	P	34.3	Very low	33	Very low	120 Å²	120	140.3 Å²	140.3	78%	0.779	80%	0.8	S	S	*	*			trans	-89.5	164.2	164.7	2.7	17	0	0	0	112.4
22	P	37	Very low	33	Very low	130 Å²	130	144.3 Å²	144.3	84%	0.844	81%	0.809	S	S	*	*			trans	-95.1	174.8	-151.8	37	-38.8	0	0	0	117.2
23	L	38.5	Very low	33	Very low	177 Å²	177	143.4 Å²	143.4	93%	0.927	82%	0.816	S	S	*	*			trans	-65.4	127.7	177.7	-72.8	152.8	0	0	0	114.2
24	G	31.6	Very low	33.2	Very low	71 Å²	71	141 Å²	141	73%	0.732	81%	0.809	S	S	*	*				79.1	115	119.1	0	0	0	0	0	120.5
25	E	29.7	Very low	33.5	Very low	191 Å²	191	138.6 Å²	138.6	89%	0.893	80%	0.802	S	S	*	*				-150.8	171.4	127.2	-111.4	-159.1	-161.1	0	0	109.2
26	P	35.3	Very low	34.3	Very low	112 Å²	112	135.7 Å²	135.7	73%	0.727	78%	0.782	S	S	*	*			trans	-84.1	168.2	-135.9	32.5	-39.1	0	0	0	117.3	G28	P26-G28 PolarHBondContact O-N 3.46Å
27	E	35.7	Very low	35.5	Very low	196 Å²	196	137.3 Å²	137.3	92%	0.916	78%	0.779	S	S	*	*			trans	-58.2	94.7	180	-62.3	-177	125.3	0	0	113.2	S29	E27-S29 PolarHBondContact O-N 3.13Å
28	G	29.2	Very low	36.8	Very low	65 Å²	65	132.1 Å²	132.1	67%	0.67	75%	0.748	S	S	*	*			trans	-64.1	96.3	160.7	0	0	0	0	0	109.5	P26 L30	P26-G28 PolarHBondContact O-N 3.46Å; G28-L30 PolarHBondContact O-N 3.45Å
29	S	32	Very low	38.9	Very low	113 Å²	113	124.6 Å²	124.6	79%	0.79	72%	0.723	S	S	*	*			trans	-56.9	111.1	-176.1	51.2	0	0	0	0	111.2	E27 G31	E27-S29 PolarHBondContact O-N 3.13Å; S29-G31 VanDerWaalsContact C-N 3.3Å; S29-G31 PolarHBondContact O-N 3.13Å
30	L	31.2	Very low	41.5	Very low	145 Å²	145	123.2 Å²	123.2	76%	0.759	71%	0.712	S	S	*	*			trans	-64.3	96	170	-94.2	78.7	0	0	0	108.2	G28 W32	G28-L30 PolarHBondContact O-N 3.45Å; L30-W32 VanDerWaalsContact C-N 3.28Å; L30-W32 VanDerWaalsContact O-CD1 3.3Å; L30-W32 PolarHBondContact O-N 2.9Å
31	G	27.6	Very low	44	Very low	65 Å²	65	118.4 Å²	118.4	67%	0.67	68%	0.684	S	S	*	*			trans	-62.2	92.6	167.4	0	0	0	0	0	108.9	S29 V33	S29-G31 VanDerWaalsContact C-N 3.3Å; S29-G31 PolarHBondContact O-N 3.13Å; G31-V33 VanDerWaalsContact C-N 3.26Å; G31-V33 PolarHBondContact O-N 3.04Å
32	W	30	Very low	46.9	Very low	225 Å²	225	113.7 Å²	113.7	85%	0.852	65%	0.651	S	S	*	*			trans	-59.7	93.5	166.9	-70.3	91.3	0	0	0	107.8	L30 L34	L30-W32 VanDerWaalsContact C-N 3.28Å; L30-W32 VanDerWaalsContact O-CD1 3.3Å; L30-W32 PolarHBondContact O-N 2.9Å; W32-L34 PolarHBondContact O-N 3.48Å
33	V	30.6	Very low	49.7	Very low	137 Å²	137	107.7 Å²	107.7	83%	0.83	61%	0.612	S	S	*	*			trans	-66.3	88.5	171.6	-177.2	0	0	0	0	106.4	G31	G31-V33 VanDerWaalsContact C-N 3.26Å; G31-V33 PolarHBondContact O-N 3.04Å
34	L	33.7	Very low	52.5	Low	145 Å²	145	99.3 Å²	99.3	76%	0.759	57%	0.568	S	S	*	*			trans	-51.8	125.5	174.7	-71.4	172.1	0	0	0	107.7	W32 N36	W32-L34 PolarHBondContact O-N 3.48Å; L34-N36 PolarHBondContact O-N 3.39Å
35	P	41	Very low	55.6	Low	108 Å²	108	95.9 Å²	95.9	70%	0.701	53%	0.533	S	S	*	.			trans	-61.1	117.8	-177.6	24.7	-33.1	0	0	0	108	T37	P35-T37 PolarHBondContact O-N 2.66Å
36	N	47.7	Very low	58.7	Low	87 Å²	87	86.8 Å²	86.8	47%	0.465	49%	0.491	S	S	.	.			trans	-48.2	111	-172.9	-170.9	7.8	0	0	0	109.7	L34 A38	L34-N36 PolarHBondContact O-N 3.39Å; N36-A38 PolarHBondContact O-N 2.94Å
37	T	57.3	Low	61.5	Low	97 Å²	97	81.5 Å²	81.5	60%	0.595	46%	0.457	S	S	*	.			trans	-75.2	75.9	-164.7	38.4	0	0	0	0	110.8	P35 M39	P35-T37 PolarHBondContact O-N 2.66Å; T37-M39 PolarHBondContact O-N 2.9Å
38	A	64.1	Low	64.2	Low	24 Å²	24	74 Å²	74	20%	0.198	42%	0.421	C	S	.	.			trans	-56.6	124	-175.2	0	0	0	0	0	110.8	N36 K40 N116 V118	N36-A38 PolarHBondContact O-N 2.94Å; A38-K40 PolarHBondContact O-N 3.29Å; A38-N116 CarbonylContact C-O 3.59Å; A38-N116 WeakPolarHBondContact CA-O 3.32Å; A38-N116 VanDerWaalsContact CB-O 3.28Å; A38-N116 WeakPolarHBondContact CB-O 3.29Å; A38-V118 HydrophobicContact CB-CG2 3.87Å
39	M	78.3	Confident	67.2	Low	73 Å²	73	73.3 Å²	73.3	36%	0.36	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	116.5	-174.8	-77.5	-179.1	-90	0	0	109.8	T37 N116 V118 P243 D365	T37-M39 PolarHBondContact O-N 2.9Å; M39-N116 PolarHBondContact N-O 3.44Å; M39-V118 PolarHBondContact O-N 3.35Å; M39-P243 HydrophobicContact CE-CB 3.83Å; M39-P243 HydrophobicContact CE-CG 3.69Å; M39-D365 HydrophobicContact CE-CB 4.29Å
40	K	87.1	Confident	69.9	Low	156 Å²	156	70.3 Å²	70.3	68%	0.678	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.8	111.7	179.7	-73.5	178	-176.9	178.7	0	109.6	A38 V118	A38-K40 PolarHBondContact O-N 3.29Å; K40-V118 WeakPolarHBondContact CA-O 3.43Å; K40-V118 HydrophobicContact CG-CB 4.28Å; K40-V118 HydrophobicContact CG-CG1 4.47Å
41	K	92.4	Very high	72.8	Confident	49 Å²	49	63.4 Å²	63.4	21%	0.213	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	126.6	175.8	-66	-67.7	-175	177.4	0	109.6	L117 V118 L119 N120 E147 L241	K41-L117 HydrophobicContact CB-CD1 4.19Å; K41-L117 HydrophobicContact CG-CD1 3.57Å; K41-V118 PolarHBondContact N-O 3.23Å; K41-L119 HydrophobicContact CB-CD2 4.3Å; K41-N120 PolarHBondContact O-N 2.62Å; K41-E147 HydrophobicContact CB-CB 4.47Å; K41-E147 HydrophobicContact CB-CG 4.35Å; K41-E147 HydrophobicContact CD-CB 4.13Å; K41-E147 HydrophobicContact CD-CG 3.58Å; K41-E147 WeakPolarHBondContact CD-OE1 3.37Å; K41-E147 WeakPolarHBondContact CD-OE2 3.27Å; K41-E147 WeakPolarHBondContact CE-OE1 3.15Å; K41-E147 WeakPolarHBondContact CE-OE2 3.49Å; K41-E147 IonicContact NZ-OE1 2.67Å; K41-E147 PolarHBondContact NZ-OE1 3.23Å; K41-E147 IonicContact NZ-OE2 2.64Å; K41-E147 PolarHBondContact NZ-OE2 2.9Å; K41-L241 HydrophobicContact CB-CD2 4.14Å; K41-L241 HydrophobicContact CD-CD2 4.23Å; K41-L241 HydrophobicContact CG-CD2 4.15Å
42	K	94.8	Very high	76	Confident	22 Å²	22	60.9 Å²	60.9	10%	0.096	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	121.9	179.6	-176.6	178.3	171.8	-176	0	110	W122 N141 I142 R144 N145 V146 E147 V148	K42-W122 HydrophobicContact CD-CZ2 4.46Å; K42-N141 PolarHBondContact NZ-O 3.17Å; K42-I142 VanDerWaalsContact CE-O 3.25Å; K42-I142 WeakPolarHBondContact CE-O 3.11Å; K42-I142 PolarHBondContact NZ-O 2.87Å; K42-R144 PolarHBondContact NZ-O 3.11Å; K42-N145 VanDerWaalsContact CB-O 3.3Å; K42-N145 WeakPolarHBondContact CB-O 3.28Å; K42-V146 HydrophobicContact CD-CG2 4.18Å; K42-E147 PolarHBondContact O-N 3.24Å; K42-V148 PolarHBondContact O-N 2.92Å
43	V	96.1	Very high	79	Confident	4 Å²	4	50.5 Å²	50.5	2%	0.024	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	113.3	-179.2	-177	0	0	0	0	108	L119 N120 L121 W122 V148 I150 L241	V43-L119 HydrophobicContact CG2-CD2 4.4Å; V43-N120 PolarHBondContact N-O 2.88Å; V43-L121 WeakPolarHBondContact O-CA 3.44Å; V43-W122 PolarHBondContact O-N 2.93Å; V43-V148 WeakPolarHBondContact CA-O 3.28Å; V43-V148 HydrophobicContact CG1-CB 4.22Å; V43-V148 HydrophobicContact CG1-CG1 4.02Å; V43-V148 HydrophobicContact CG2-CB 4.35Å; V43-I150 HydrophobicContact CG1-CD1 3.63Å; V43-I150 HydrophobicContact CG1-CG1 4.02Å; V43-L241 HydrophobicContact CG2-CD1 3.82Å
44	L	96.7	Very high	81.8	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	136.5	171.2	-64.9	-172.3	0	0	0	109.8	M46 W122 I142 F143 V146 V148 L149 I150 I174	L44-M46 HydrophobicContact CB-CG 4.22Å; L44-M46 HydrophobicContact CD1-SD 4.07Å; L44-W122 HydrophobicContact CD2-CB 3.82Å; L44-W122 HydrophobicContact CD2-CD2 4.28Å; L44-W122 HydrophobicContact CD2-CE3 4.2Å; L44-W122 HydrophobicContact CD2-CG 4.15Å; L44-I142 HydrophobicContact CD1-CG2 3.93Å; L44-I142 HydrophobicContact CD2-CG2 4.23Å; L44-F143 HydrophobicContact CD1-CD1 3.87Å; L44-F143 HydrophobicContact CD1-CE1 4.06Å; L44-V146 HydrophobicContact CD1-CG1 4.17Å; L44-V146 HydrophobicContact CD1-CG2 3.67Å; L44-V146 HydrophobicContact CD2-CG2 4.43Å; L44-V146 HydrophobicContact CG-CG1 3.95Å; L44-V146 HydrophobicContact CG-CG2 3.81Å; L44-V148 PolarHBondContact N-O 3.35Å; L44-L149 HydrophobicContact CB-CD1 3.79Å; L44-L149 HydrophobicContact CD1-CD1 4.44Å; L44-I150 PolarHBondContact O-N 3.23Å; L44-I174 HydrophobicContact CD1-CD1 4.45Å
45	L	96.3	Very high	84.7	Confident	0 Å²	0	39 Å²	39	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	100.3	172.5	-178.4	64	0	0	0	108.2	K53 R57 L121 W122 D123 C124 I150 V152 W234	L45-K53 HydrophobicContact CD2-CB 3.95Å; L45-K53 HydrophobicContact CG-CB 3.95Å; L45-K53 HydrophobicContact CG-CD 4.24Å; L45-K53 HydrophobicContact CG-CG 4.4Å; L45-K53 WeakPolarHBondContact O-CE 3.29Å; L45-R57 HydrophobicContact CD2-CB 4.27Å; L45-L121 HydrophobicContact CB-CD2 4.36Å; L45-L121 HydrophobicContact CD2-CD2 4.21Å; L45-W122 PolarHBondContact N-O 2.91Å; L45-D123 HydrophobicContact CD2-CB 4.4Å; L45-C124 PolarHBondContact O-N 3.33Å; L45-I150 WeakPolarHBondContact CA-O 3.43Å; L45-I150 HydrophobicContact CD1-CB 3.81Å; L45-I150 HydrophobicContact CD1-CD1 4.42Å; L45-I150 HydrophobicContact CD1-CG2 3.71Å; L45-V152 HydrophobicContact CD1-CG2 3.72Å; L45-W234 HydrophobicContact CD1-CZ2 4.48Å
46	M	95.9	Very high	87.2	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	172.1	-170.2	-61	-166.2	79.8	0	0	112.2	L44 K53 C124 M131 Y134 I142 F143 L149 I150 Y151 V152 C170	L44-M46 HydrophobicContact CB-CG 4.22Å; L44-M46 HydrophobicContact CD1-SD 4.07Å; M46-K53 VanDerWaalsContact O-CD 3.25Å; M46-K53 WeakPolarHBondContact O-CD 3.29Å; M46-C124 HydrophobicContact CE-CB 4.33Å; M46-C124 HydrophobicContact CG-CB 4.11Å; M46-M131 HydrophobicContact CE-CE 4.44Å; M46-M131 HydrophobicContact CE-SD 4.31Å; M46-Y134 HydrophobicContact CE-CD2 3.56Å; M46-Y134 HydrophobicContact CE-CE2 4.15Å; M46-Y134 HydrophobicContact CE-CG 4.31Å; M46-I142 HydrophobicContact SD-CG2 4.48Å; M46-F143 HydrophobicContact CE-CE1 4.38Å; M46-F143 HydrophobicContact CE-CZ 3.93Å; M46-F143 HydrophobicContact SD-CE1 3.71Å; M46-F143 HydrophobicContact SD-CZ 3.89Å; M46-L149 HydrophobicContact CB-CD1 4.1Å; M46-L149 HydrophobicContact CG-CD1 3.98Å; M46-L149 HydrophobicContact SD-CD1 4.1Å; M46-I150 PolarHBondContact N-O 2.92Å; M46-Y151 HydrophobicContact CB-CD2 3.95Å; M46-Y151 HydrophobicContact CB-CE2 4.33Å; M46-Y151 CarbonylContact O-C 3.17Å; M46-Y151 WeakPolarHBondContact O-CA 3.47Å; M46-V152 PolarHBondContact O-N 2.92Å; M46-C170 VanDerWaalsContact SD-SG 3.68Å
47	G	94.3	Very high	89.3	Confident	1 Å²	1	30.6 Å²	30.6	1%	0.01	18%	0.176	C	C	.	.			trans	121.2	165.3	-172.1	0	0	0	0	0	111.7	K53 G126	G47-K53 PolarHBondContact O-NZ 3.08Å; G47-G126 WeakPolarHBondContact O-CA 3.2Å
48	K	92.4	Very high	90.9	Very high	39 Å²	39	26.2 Å²	26.2	17%	0.17	15%	0.149	C	C	.	.			trans	-60.1	159.5	-168.4	-175.1	162.2	170.1	-175.8	0	114.9	S51 G126 S157 E159 D163	K48-S51 VanDerWaalsContact O-CB 3.3Å; K48-S51 WeakPolarHBondContact O-CB 3.46Å; K48-S51 PolarHBondContact O-N 2.91Å; K48-S51 PolarHBondContact O-OG 2.86Å; K48-G126 CarbonylContact C-O 3.59Å; K48-S157 PolarHBondContact NZ-OG 2.74Å; K48-E159 VanDerWaalsContact CE-OE2 3.28Å; K48-E159 WeakPolarHBondContact CE-OE2 3.5Å; K48-E159 IonicContact NZ-OE2 2.81Å; K48-E159 PolarHBondContact NZ-OE2 2.93Å; K48-D163 WeakPolarHBondContact CD-OD1 3.33Å; K48-D163 IonicContact NZ-OD1 2.84Å; K48-D163 PolarHBondContact NZ-OD1 3.28Å; K48-D163 IonicContact NZ-OD2 2.69Å
49	S	90.9	Very high	92.2	Very high	49 Å²	49	25.2 Å²	25.2	34%	0.343	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	141.6	172.4	-167.4	0	0	0	0	110.4	S51 G126	S49-S51 PolarHBondContact O-N 2.69Å; S49-G126 WeakPolarHBondContact CB-O 3.43Å; S49-G126 PolarHBondContact N-O 2.69Å
50	G	89.3	Confident	92.8	Very high	50 Å²	50	21.8 Å²	21.8	52%	0.515	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.4	-9.2	-178.7	0	0	0	0	0	116.5	G52 K189	G50-G52 PolarHBondContact O-N 3.43Å; G50-G52 VanDerWaalsContact O-N 3.1Å; G50-K189 WeakPolarHBondContact O-CE 3.39Å; G50-K189 PolarHBondContact O-NZ 3.25Å
51	S	93.2	Very high	93	Very high	1 Å²	1	16.1 Å²	16.1	1%	0.007	10%	0.099	C	C	.	.	S	Bend	trans	-67.3	-7	-177.6	62.2	0	0	0	0	115.9	K48 S49 K53 V152 H188	K48-S51 VanDerWaalsContact O-CB 3.3Å; K48-S51 WeakPolarHBondContact O-CB 3.46Å; K48-S51 PolarHBondContact O-N 2.91Å; K48-S51 PolarHBondContact O-OG 2.86Å; S49-S51 PolarHBondContact O-N 2.69Å; S51-K53 WeakPolarHBondContact OG-CG 3.28Å; S51-V152 WeakPolarHBondContact O-CG1 3.28Å; S51-H188 PolarHBondContact O-CD2 3.3Å
52	G	92.9	Very high	92.7	Very high	11 Å²	11	16.2 Å²	16.2	11%	0.113	11%	0.109	C	C	.	.	S	Bend	trans	100.3	3.2	172.5	0	0	0	0	0	116.6	G50 T54 S55 M56	G50-G52 PolarHBondContact O-N 3.43Å; G50-G52 VanDerWaalsContact O-N 3.1Å; G52-T54 PolarHBondContact O-N 3.11Å; G52-S55 WeakPolarHBondContact O-CA 3.16Å; G52-S55 VanDerWaalsContact O-CB 3.28Å; G52-S55 WeakPolarHBondContact O-CB 3.45Å; G52-S55 PolarHBondContact O-N 3.47Å; G52-S55 VanDerWaalsContact O-N 3.09Å; G52-M56 PolarHBondContact O-N 3.31Å
53	K	93.1	Very high	92.4	Very high	8 Å²	8	18.7 Å²	18.7	4%	0.035	12%	0.123	C	C	.	.	H	α-helix	trans	-44.2	-62.1	-179.9	-51.9	-160.2	-51.5	-78.5	0	114.2	L45 M46 G47 S51 S55 M56 R57 D123 C124 V152	L45-K53 HydrophobicContact CD2-CB 3.95Å; L45-K53 HydrophobicContact CG-CB 3.95Å; L45-K53 HydrophobicContact CG-CD 4.24Å; L45-K53 HydrophobicContact CG-CG 4.4Å; L45-K53 WeakPolarHBondContact O-CE 3.29Å; M46-K53 VanDerWaalsContact O-CD 3.25Å; M46-K53 WeakPolarHBondContact O-CD 3.29Å; G47-K53 PolarHBondContact O-NZ 3.08Å; S51-K53 WeakPolarHBondContact OG-CG 3.28Å; K53-S55 VanDerWaalsContact C-N 3.29Å; K53-S55 PolarHBondContact O-N 2.92Å; K53-M56 PolarHBondContact O-N 3.46Å; K53-R57 PolarHBondContact O-N 3.49Å; K53-D123 VanDerWaalsContact CB-OD1 3.31Å; K53-D123 WeakPolarHBondContact CB-OD1 3.28Å; K53-D123 VanDerWaalsContact CE-OD1 3.31Å; K53-D123 WeakPolarHBondContact CE-OD1 3.49Å; K53-C124 WeakPolarHBondContact CE-O 3.47Å; K53-C124 PolarHBondContact NZ-O 2.97Å; K53-V152 HydrophobicContact CD-CB 4.39Å; K53-V152 HydrophobicContact CD-CG2 4.31Å; K53-V152 HydrophobicContact CG-CB 3.97Å; K53-V152 HydrophobicContact CG-CG1 4.44Å; K53-V152 HydrophobicContact CG-CG2 3.92Å
54	T	90.9	Very high	92	Very high	15 Å²	15	22.9 Å²	22.9	9%	0.092	14%	0.139	C	C	.	.	H	α-helix	trans	-62.3	-35.3	-179.5	-47.1	0	0	0	0	112	G52 S58 L72 T75 D123	G52-T54 PolarHBondContact O-N 3.11Å; T54-S58 VanDerWaalsContact O-CB 3.3Å; T54-S58 WeakPolarHBondContact O-CB 3.41Å; T54-S58 PolarHBondContact O-N 2.83Å; T54-S58 PolarHBondContact O-OG 3.13Å; T54-S58 VanDerWaalsContact O-OG 3.06Å; T54-L72 HydrophobicContact CG2-CD1 4.34Å; T54-T75 PolarHBondContact OG1-OG1 3.07Å; T54-D123 WeakPolarHBondContact CA-OD2 3.49Å; T54-D123 VanDerWaalsContact CB-OD2 3.31Å; T54-D123 WeakPolarHBondContact CB-OD2 3.43Å; T54-D123 PolarHBondContact N-OD2 3.37Å; T54-D123 PolarHBondContact OG1-OD2 3.41Å
55	S	93	Very high	91.6	Very high	24 Å²	24	24.8 Å²	24.8	17%	0.168	15%	0.149	C	C	.	.	H	α-helix	trans	-62.1	-49.4	174.2	-50.2	0	0	0	0	111.9	G52 K53 S58 I59	G52-S55 WeakPolarHBondContact O-CA 3.16Å; G52-S55 VanDerWaalsContact O-CB 3.28Å; G52-S55 WeakPolarHBondContact O-CB 3.45Å; G52-S55 PolarHBondContact O-N 3.47Å; G52-S55 VanDerWaalsContact O-N 3.09Å; K53-S55 VanDerWaalsContact C-N 3.29Å; K53-S55 PolarHBondContact O-N 2.92Å; S55-S58 PolarHBondContact O-N 3.04Å; S55-I59 WeakPolarHBondContact O-CD1 3.5Å; S55-I59 WeakPolarHBondContact O-CG1 3.45Å; S55-I59 PolarHBondContact O-N 3.49Å
56	M	93.9	Very high	91.2	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-60.6	-48.7	177.6	-72.2	-169.1	-80.7	0	0	111.8	G52 K53 S58 I59 I60 V152 L186 H188 I225 L230	G52-M56 PolarHBondContact O-N 3.31Å; K53-M56 PolarHBondContact O-N 3.46Å; M56-S58 VanDerWaalsContact C-N 3.31Å; M56-S58 PolarHBondContact O-N 2.95Å; M56-I59 PolarHBondContact O-N 2.81Å; M56-I60 PolarHBondContact O-N 3.33Å; M56-I60 VanDerWaalsContact O-N 3.17Å; M56-V152 HydrophobicContact CE-CB 4.18Å; M56-V152 HydrophobicContact CE-CG1 3.46Å; M56-V152 VanDerWaalsContact CE-CG1 3.46Å; M56-V152 HydrophobicContact CE-CG2 3.58Å; M56-L186 HydrophobicContact CE-CD1 4.05Å; M56-L186 HydrophobicContact SD-CD1 3.9Å; M56-H188 PolarHBondContact SD-CE1 2.94Å; M56-H188 PolarHBondContact SD-ND1 3.07Å; M56-H188 VanDerWaalsContact SD-ND1 3.43Å; M56-I225 HydrophobicContact CG-CG2 4.3Å; M56-L230 HydrophobicContact CB-CD1 3.9Å; M56-L230 HydrophobicContact CB-CD2 4.45Å; M56-L230 HydrophobicContact CG-CD1 3.47Å; M56-L230 VanDerWaalsContact CG-CD1 3.47Å; M56-L230 HydrophobicContact CG-CD2 4.26Å; M56-L230 HydrophobicContact SD-CD1 3.37Å; M56-L230 WeakPolarHBondContact SD-CD1 3.49Å
57	R	92.8	Very high	90.8	Very high	20 Å²	20	34.2 Å²	34.2	8%	0.075	19%	0.187	C	C	.	.	H	α-helix	trans	-54.4	-47.6	176.5	-174.6	-161.7	75.9	-168.2	19.8	111.3	L45 K53 F61 E107 L121 D123	L45-R57 HydrophobicContact CD2-CB 4.27Å; K53-R57 PolarHBondContact O-N 3.49Å; R57-F61 HydrophobicContact CG-CD2 4.26Å; R57-F61 WeakPolarHBondContact O-CB 3.14Å; R57-F61 WeakPolarHBondContact O-CD2 3.49Å; R57-F61 PolarHBondContact O-N 3.12Å; R57-E107 IonicContact CZ-OE1 2.7Å; R57-E107 IonicContact CZ-OE2 3.65Å; R57-E107 IonicContact NH1-OE1 3.59Å; R57-E107 IonicContact NH1-OE2 3.11Å; R57-E107 PolarHBondContact NH1-OE2 3.2Å; R57-E107 IonicContact NH2-OE1 2.87Å; R57-E107 PolarHBondContact NH2-OE1 3.39Å; R57-E107 IonicContact NH2-OE2 3Å; R57-E107 PolarHBondContact NH2-OE2 3.02Å; R57-L121 HydrophobicContact CG-CD1 4.12Å; R57-L121 HydrophobicContact CG-CD2 3.87Å; R57-D123 IonicContact CZ-OD2 2.62Å; R57-D123 IonicContact NE-OD2 2.8Å; R57-D123 IonicContact NH1-OD2 3.49Å; R57-D123 PolarHBondContact NH1-OD2 3.01Å
58	S	90.5	Very high	90.4	Very high	4 Å²	4	36.5 Å²	36.5	3%	0.028	20%	0.2	C	C	.	.	H	α-helix	trans	-70.9	-31.3	-176.9	-68.5	0	0	0	0	113.7	T54 S55 M56 A62 N63 Y64	T54-S58 VanDerWaalsContact O-CB 3.3Å; T54-S58 WeakPolarHBondContact O-CB 3.41Å; T54-S58 PolarHBondContact O-N 2.83Å; T54-S58 PolarHBondContact O-OG 3.13Å; T54-S58 VanDerWaalsContact O-OG 3.06Å; S55-S58 PolarHBondContact O-N 3.04Å; M56-S58 VanDerWaalsContact C-N 3.31Å; M56-S58 PolarHBondContact O-N 2.95Å; S58-A62 CarbonylContact O-C 3.35Å; S58-A62 VanDerWaalsContact O-CA 3.26Å; S58-A62 WeakPolarHBondContact O-CA 3.42Å; S58-A62 WeakPolarHBondContact O-CB 3.48Å; S58-A62 PolarHBondContact O-N 2.78Å; S58-N63 PolarHBondContact O-N 3.36Å; S58-N63 VanDerWaalsContact O-N 3.09Å; S58-Y64 PolarHBondContact O-N 2.9Å
59	I	90.5	Very high	90.1	Very high	4 Å²	4	35 Å²	35	2%	0.021	19%	0.194	C	C	.	.	H	α-helix	trans	-67.4	-52.6	174.4	-70	162.5	0	0	0	110.8	S55 M56 Y64 A66 T69 I225 L230	S55-I59 WeakPolarHBondContact O-CD1 3.5Å; S55-I59 WeakPolarHBondContact O-CG1 3.45Å; S55-I59 PolarHBondContact O-N 3.49Å; M56-I59 PolarHBondContact O-N 2.81Å; I59-Y64 WeakPolarHBondContact CA-O 3.38Å; I59-A66 HydrophobicContact CD1-CB 4.41Å; I59-T69 HydrophobicContact CD1-CG2 3.91Å; I59-T69 HydrophobicContact CG1-CG2 3.81Å; I59-I225 HydrophobicContact CD1-CB 3.59Å; I59-I225 HydrophobicContact CD1-CG2 3.54Å; I59-L230 HydrophobicContact CB-CD2 4.39Å; I59-L230 HydrophobicContact CD1-CD2 4.41Å; I59-L230 HydrophobicContact CG2-CD2 4.17Å
60	I	92.1	Very high	89.6	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-67.2	-54.3	-176.2	-60.8	-57.9	0	0	0	110.8	M56 L230 Y231 W234 T271 L273 K297	M56-I60 PolarHBondContact O-N 3.33Å; M56-I60 VanDerWaalsContact O-N 3.17Å; I60-L230 HydrophobicContact CD1-CD2 4.16Å; I60-L230 HydrophobicContact CD1-CG 4.13Å; I60-L230 HydrophobicContact CG1-CD2 4.27Å; I60-L230 HydrophobicContact CG1-CG 4.34Å; I60-Y231 HydrophobicContact CD1-CD1 3.86Å; I60-Y231 HydrophobicContact CD1-CE1 3.68Å; I60-Y231 HydrophobicContact CD1-CE2 4.42Å; I60-Y231 HydrophobicContact CD1-CG 4.29Å; I60-W234 HydrophobicContact CG1-CB 4.47Å; I60-W234 HydrophobicContact CG1-CG 4.04Å; I60-T271 HydrophobicContact CG2-CG2 4.06Å; I60-L273 HydrophobicContact CD1-CD2 4.35Å; I60-L273 HydrophobicContact CG2-CD1 3.93Å; I60-L273 HydrophobicContact CG2-CD2 4.4Å; I60-L273 HydrophobicContact CG2-CG 4.25Å; I60-K297 PolarHBondContact O-NZ 3.24Å
61	F	90.2	Very high	89.1	Confident	37 Å²	37	49.1 Å²	49.1	16%	0.162	22%	0.224	C	C	.	.	H	α-helix	trans	-99.1	-29.6	-167.7	-55.7	-67.9	0	0	0	114.7	R57 V111 L121 W234 T271	R57-F61 HydrophobicContact CG-CD2 4.26Å; R57-F61 WeakPolarHBondContact O-CB 3.14Å; R57-F61 WeakPolarHBondContact O-CD2 3.49Å; R57-F61 PolarHBondContact O-N 3.12Å; F61-V111 HydrophobicContact CB-CG2 4.09Å; F61-V111 HydrophobicContact CD1-CB 4.31Å; F61-V111 HydrophobicContact CD1-CG1 3.68Å; F61-V111 HydrophobicContact CD1-CG2 3.87Å; F61-V111 HydrophobicContact CE1-CG1 4.05Å; F61-V111 HydrophobicContact CE1-CG2 4.48Å; F61-V111 HydrophobicContact CG-CG2 3.94Å; F61-L121 HydrophobicContact CD2-CD1 4.08Å; F61-L121 HydrophobicContact CE2-CD1 3.67Å; F61-L121 HydrophobicContact CZ-CD1 4.47Å; F61-W234 HydrophobicContact CE2-CD2 4.39Å; F61-W234 AromaticContact CE2-CE3 3.86Å; F61-W234 HydrophobicContact CE2-CE3 3.86Å; F61-W234 AromaticContact CE2-CH2 3.95Å; F61-W234 HydrophobicContact CE2-CH2 3.95Å; F61-W234 HydrophobicContact CE2-CZ2 4.46Å; F61-W234 AromaticContact CE2-CZ3 3.62Å; F61-W234 HydrophobicContact CE2-CZ3 3.62Å; F61-W234 AromaticContact CZ-CE3 3.75Å; F61-W234 HydrophobicContact CZ-CE3 3.75Å; F61-W234 AromaticContact CZ-CZ3 3.77Å; F61-W234 HydrophobicContact CZ-CZ3 3.77Å; F61-T271 HydrophobicContact CD1-CG2 3.58Å; F61-T271 HydrophobicContact CE1-CG2 3.79Å
62	A	87.1	Confident	88.1	Confident	51 Å²	51	50.2 Å²	50.2	42%	0.421	23%	0.229	S	C	.	.	H	α-helix	trans	-104.2	8.8	-177.1	0	0	0	0	0	114.5	S58 Y64	S58-A62 CarbonylContact O-C 3.35Å; S58-A62 VanDerWaalsContact O-CA 3.26Å; S58-A62 WeakPolarHBondContact O-CA 3.42Å; S58-A62 WeakPolarHBondContact O-CB 3.48Å; S58-A62 PolarHBondContact O-N 2.78Å; A62-Y64 VanDerWaalsContact C-N 3.3Å; A62-Y64 HydrophobicContact CB-CD2 3.98Å; A62-Y64 HydrophobicContact CB-CE2 4.2Å; A62-Y64 PolarHBondContact O-N 2.94Å
63	N	88.8	Confident	86.5	Confident	75 Å²	75	50.8 Å²	50.8	40%	0.401	24%	0.236	S	C	.	.			trans	64.1	24.2	175.7	-61.8	-55.2	0	0	0	115.5	S58 K297 L301	S58-N63 PolarHBondContact O-N 3.36Å; S58-N63 VanDerWaalsContact O-N 3.09Å; N63-K297 WeakPolarHBondContact OD1-CE 3.42Å; N63-K297 PolarHBondContact OD1-NZ 3Å; N63-L301 HydrophobicContact CB-CD2 3.61Å; N63-L301 WeakPolarHBondContact O-CD2 3.45Å
64	Y	87	Confident	84.8	Confident	91 Å²	91	52.5 Å²	52.5	36%	0.357	25%	0.251	S	S	.	.			trans	-71.3	150.2	172.8	-82.1	-120.7	0	0	0	111.8	S58 I59 A62 D68 T69 L72	S58-Y64 PolarHBondContact O-N 2.9Å; I59-Y64 WeakPolarHBondContact CA-O 3.38Å; A62-Y64 VanDerWaalsContact C-N 3.3Å; A62-Y64 HydrophobicContact CB-CD2 3.98Å; A62-Y64 HydrophobicContact CB-CE2 4.2Å; A62-Y64 PolarHBondContact O-N 2.94Å; Y64-D68 HydrophobicContact CD1-CB 4.01Å; Y64-T69 HydrophobicContact CD1-CG2 4.33Å; Y64-L72 HydrophobicContact CE1-CD2 3.85Å; Y64-L72 HydrophobicContact CE1-CG 4.27Å
65	I	88.9	Confident	82.9	Confident	40 Å²	40	53.4 Å²	53.4	21%	0.205	26%	0.257	C	S	.	.			trans	-92.2	153	161.2	59.3	170.1	0	0	0	110.2	R67 D68 T69 L301	I65-R67 HydrophobicContact CD1-CB 4.27Å; I65-R67 HydrophobicContact CG1-CB 4.5Å; I65-R67 PolarHBondContact O-N 2.92Å; I65-R67 VanDerWaalsContact O-N 3.07Å; I65-D68 HydrophobicContact CG1-CB 4.01Å; I65-D68 VanDerWaalsContact CG1-OD2 3.26Å; I65-D68 WeakPolarHBondContact CG1-OD2 3.33Å; I65-D68 PolarHBondContact O-N 3.01Å; I65-T69 PolarHBondContact O-N 3.09Å; I65-L301 HydrophobicContact CG2-CD1 3.71Å
66	A	88	Confident	80.6	Confident	14 Å²	14	56.1 Å²	56.1	12%	0.116	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-29.5	-178	0	0	0	0	0	114.8	I59 T69 I225 W226	I59-A66 HydrophobicContact CD1-CB 4.41Å; A66-T69 PolarHBondContact O-OG1 2.8Å; A66-I225 HydrophobicContact CB-CB 4.14Å; A66-I225 HydrophobicContact CB-CD1 4.07Å; A66-I225 HydrophobicContact CB-CG1 4.06Å; A66-I225 VanDerWaalsContact CB-O 3.29Å; A66-I225 WeakPolarHBondContact CB-O 3.49Å; A66-W226 HydrophobicContact CB-CD2 4.09Å; A66-W226 HydrophobicContact CB-CE3 3.72Å; A66-W226 HydrophobicContact CB-CH2 4.25Å; A66-W226 HydrophobicContact CB-CZ3 3.82Å
67	R	87.6	Confident	77.9	Confident	184 Å²	184	61.6 Å²	61.6	69%	0.694	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-36.3	174.6	-176.5	177.1	178.1	178.1	0.2	112.6	I65 R70	I65-R67 HydrophobicContact CD1-CB 4.27Å; I65-R67 HydrophobicContact CG1-CB 4.5Å; I65-R67 PolarHBondContact O-N 2.92Å; I65-R67 VanDerWaalsContact O-N 3.07Å; R67-R70 WeakPolarHBondContact O-CB 3.35Å; R67-R70 WeakPolarHBondContact O-CG 3.27Å; R67-R70 PolarHBondContact O-N 3.42Å
68	D	86.3	Confident	75.3	Confident	50 Å²	50	64 Å²	64	27%	0.267	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-81	-21.5	-172.9	-69.3	-17.2	0	0	0	112	Y64 I65 R70 R71	Y64-D68 HydrophobicContact CD1-CB 4.01Å; I65-D68 HydrophobicContact CG1-CB 4.01Å; I65-D68 VanDerWaalsContact CG1-OD2 3.26Å; I65-D68 WeakPolarHBondContact CG1-OD2 3.33Å; I65-D68 PolarHBondContact O-N 3.01Å; D68-R70 PolarHBondContact O-N 3.05Å; D68-R70 VanDerWaalsContact O-N 3.11Å; D68-R71 WeakPolarHBondContact O-CB 3.47Å; D68-R71 PolarHBondContact O-N 3.19Å
69	T	86	Confident	73	Confident	8 Å²	8	71.9 Å²	71.9	5%	0.049	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-64	-14.7	173.3	68.3	0	0	0	0	113.1	I59 Y64 I65 A66 R71 L72	I59-T69 HydrophobicContact CD1-CG2 3.91Å; I59-T69 HydrophobicContact CG1-CG2 3.81Å; Y64-T69 HydrophobicContact CD1-CG2 4.33Å; I65-T69 PolarHBondContact O-N 3.09Å; A66-T69 PolarHBondContact O-OG1 2.8Å; T69-R71 PolarHBondContact O-N 3.08Å; T69-L72 HydrophobicContact CG2-CD1 4.11Å; T69-L72 WeakPolarHBondContact O-CB 3.43Å; T69-L72 PolarHBondContact O-N 3.21Å
70	R	80.3	Confident	70.4	Confident	190 Å²	190	78.5 Å²	78.5	72%	0.717	38%	0.375	S	S	*	.	G	3₁₀ helix	trans	-65.9	-11.9	170.1	-60.2	-177.5	-176.8	-165.3	1.1	113.8	R67 D68	R67-R70 WeakPolarHBondContact O-CB 3.35Å; R67-R70 WeakPolarHBondContact O-CG 3.27Å; R67-R70 PolarHBondContact O-N 3.42Å; D68-R70 PolarHBondContact O-N 3.05Å; D68-R70 VanDerWaalsContact O-N 3.11Å
71	R	77.6	Confident	67.7	Low	204 Å²	204	87.3 Å²	87.3	77%	0.77	42%	0.415	S	S	*	.	G	3₁₀ helix	trans	-93.7	-17	174.9	-64.3	177.7	172.7	157	-3.8	113.5	D68 T69 G73	D68-R71 WeakPolarHBondContact O-CB 3.47Å; D68-R71 PolarHBondContact O-N 3.19Å; T69-R71 PolarHBondContact O-N 3.08Å; R71-G73 PolarHBondContact O-N 2.69Å
72	L	73.3	Confident	65.1	Low	24 Å²	24	89.3 Å²	89.3	13%	0.126	43%	0.434	C	S	.	.	P	Polyproline II helix	trans	-68.8	125.4	172.8	-57.1	171.6	0	0	0	107.2	T54 Y64 T69 D78	T54-L72 HydrophobicContact CG2-CD1 4.34Å; Y64-L72 HydrophobicContact CE1-CD2 3.85Å; Y64-L72 HydrophobicContact CE1-CG 4.27Å; T69-L72 HydrophobicContact CG2-CD1 4.11Å; T69-L72 WeakPolarHBondContact O-CB 3.43Å; T69-L72 PolarHBondContact O-N 3.21Å; L72-D78 WeakPolarHBondContact CD2-OD2 3.44Å
73	G	59.8	Low	62.7	Low	24 Å²	24	93.6 Å²	93.6	25%	0.247	45%	0.449	C	S	.	.	P	Polyproline II helix	trans	-67	173.8	170.7	0	0	0	0	0	111.6	R71 D78	R71-G73 PolarHBondContact O-N 2.69Å; G73-D78 PolarHBondContact N-OD1 2.93Å
74	A	56.7	Low	60	Low	44 Å²	44	99.2 Å²	99.2	36%	0.364	47%	0.473	S	S	.	.	S	Bend	trans	-56.9	143.5	150.3	0	0	0	0	0	108	I76 L77	A74-I76 PolarHBondContact O-N 3.31Å; A74-L77 PolarHBondContact O-N 3.37Å
75	T	51.5	Low	57.6	Low	33 Å²	33	101.9 Å²	101.9	20%	0.202	49%	0.492	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-4	-158.2	-37.9	0	0	0	0	117	T54	T54-T75 PolarHBondContact OG1-OG1 3.07Å
76	I	43.8	Very low	54.8	Low	82 Å²	82	107.1 Å²	107.1	42%	0.421	52%	0.52	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-31.6	172.9	-59.6	-175.7	0	0	0	113.4	A74 Q127 F130	A74-I76 PolarHBondContact O-N 3.31Å; I76-Q127 VanDerWaalsContact CD1-NE2 3.34Å; I76-F130 HydrophobicContact CD1-CE2 3.59Å; I76-F130 HydrophobicContact CD1-CZ 3.57Å; I76-F130 HydrophobicContact CG1-CE2 3.71Å; I76-F130 HydrophobicContact CG1-CZ 3.96Å
77	L	37.1	Very low	52.2	Low	114 Å²	114	112.2 Å²	112.2	60%	0.597	56%	0.555	S	S	*	*	S	Bend	trans	-88.7	-17.9	-161	-78	168.3	0	0	0	116.8	A74 R79 I80	A74-L77 PolarHBondContact O-N 3.37Å; L77-R79 PolarHBondContact O-N 3.48Å; L77-I80 PolarHBondContact O-N 2.83Å
78	D	39	Very low	49.6	Very low	70 Å²	70	108.9 Å²	108.9	37%	0.374	56%	0.56	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.7	8.9	-163.1	-90.7	27.9	0	0	0	116.7	L72 G73 S82	L72-D78 WeakPolarHBondContact CD2-OD2 3.44Å; G73-D78 PolarHBondContact N-OD1 2.93Å; D78-S82 PolarHBondContact O-OG 3.14Å
79	R	41.6	Very low	46.9	Very low	170 Å²	170	114.5 Å²	114.5	64%	0.642	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.7	-8.7	175.1	-77.9	-165.5	179.4	-130.5	2.4	116.1	L77	L77-R79 PolarHBondContact O-N 3.48Å
80	I	36.8	Very low	44	Very low	143 Å²	143	118.9 Å²	118.9	73%	0.733	62%	0.62	S	S	*	*	S	Bend	trans	-83.2	-30.9	178.3	-63	-178.9	0	0	0	112	L77	L77-I80 PolarHBondContact O-N 2.83Å
81	H	33.7	Very low	41.4	Very low	185 Å²	185	115.8 Å²	115.8	86%	0.856	62%	0.622	S	S	*	*	S	Bend	trans	-105.4	-0.7	-171.7	-145.8	-56.2	0	0	0	115.1
82	S	36	Very low	39	Very low	79 Å²	79	115.3 Å²	115.3	55%	0.552	62%	0.622	S	S	*	*			trans	-88.1	-8.7	179.9	34.6	0	0	0	0	114	D78 Q84	D78-S82 PolarHBondContact O-OG 3.14Å; S82-Q84 PolarHBondContact O-N 3.39Å
83	L	37.1	Very low	37	Very low	141 Å²	141	119.1 Å²	119.1	74%	0.738	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.8	68.6	178	-75.8	171.1	0	0	0	113.5
84	Q	33.2	Very low	35.7	Very low	194 Å²	194	124 Å²	124	91%	0.907	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-161.3	-4.6	155.8	-122.9	171.5	15.6	0	0	118.2	S82	S82-Q84 PolarHBondContact O-N 3.39Å
85	I	35.7	Very low	34.5	Very low	147 Å²	147	127.7 Å²	127.7	75%	0.754	69%	0.688	S	S	*	*	S	Bend	trans	-117.7	129	-177.1	-60.2	-177.8	0	0	0	110.8
86	N	30.4	Very low	33.5	Very low	149 Å²	149	130.6 Å²	130.6	80%	0.797	70%	0.703	S	S	*	*			trans	75.2	94.7	179	-57.4	-22.4	0	0	0	117	S88	N86-S88 PolarHBondContact O-N 3.43Å
87	S	33.5	Very low	33	Very low	122 Å²	122	133 Å²	133	85%	0.853	73%	0.727	S	S	*	*			trans	-73.9	100.7	165.3	52.8	0	0	0	0	112
88	S	32.2	Very low	33	Very low	114 Å²	114	133.9 Å²	133.9	80%	0.797	74%	0.737	S	S	*	*			trans	178.3	31	156.1	38.8	0	0	0	0	115.1	N86	N86-S88 PolarHBondContact O-N 3.43Å
89	L	30.4	Very low	32.7	Very low	167 Å²	167	133.7 Å²	133.7	87%	0.874	75%	0.751	S	S	*	*	S	Bend	trans	-125.6	131.5	169.1	-76.5	170.1	0	0	0	110.5	T91	L89-T91 PolarHBondContact O-N 2.99Å
90	S	24.7	Very low	32.2	Very low	101 Å²	101	132.2 Å²	132.2	71%	0.706	76%	0.756	S	S	*	*			trans	-74.8	120.7	-175.3	41.7	0	0	0	0	111.8	Y92	S90-Y92 PolarHBondContact O-N 2.92Å
91	T	25.9	Very low	31.9	Very low	124 Å²	124	131.1 Å²	131.1	76%	0.761	76%	0.756	S	S	*	*			trans	-77.3	83.5	178.8	49.4	0	0	0	0	111.7	L89 S93	L89-T91 PolarHBondContact O-N 2.99Å; T91-S93 PolarHBondContact O-N 2.93Å
92	Y	27	Very low	31.8	Very low	195 Å²	195	127.6 Å²	127.6	77%	0.765	74%	0.738	S	S	*	*			trans	-94.1	81.5	163.1	-82.7	-77	0	0	0	111.1	S90 L94	S90-Y92 PolarHBondContact O-N 2.92Å; Y92-L94 VanDerWaalsContact C-N 3.31Å; Y92-L94 PolarHBondContact O-N 3.19Å
93	S	31.4	Very low	31.9	Very low	104 Å²	104	128.1 Å²	128.1	73%	0.727	74%	0.738	S	S	*	*			trans	-70.3	88	161.9	50.5	0	0	0	0	109.6	T91 V95	T91-S93 PolarHBondContact O-N 2.93Å; S93-V95 VanDerWaalsContact C-N 3.26Å; S93-V95 PolarHBondContact O-N 3.07Å
94	L	31.5	Very low	32.6	Very low	126 Å²	126	127 Å²	127	66%	0.66	73%	0.727	S	S	*	*			trans	-70.4	81.8	172.7	-75.2	170.9	0	0	0	110.9	Y92 D96 K102	Y92-L94 VanDerWaalsContact C-N 3.31Å; Y92-L94 PolarHBondContact O-N 3.19Å; L94-D96 PolarHBondContact O-N 3.28Å; L94-K102 PolarHBondContact O-NZ 3.48Å; L94-K102 VanDerWaalsContact O-NZ 3.09Å
95	V	32.1	Very low	34.1	Very low	121 Å²	121	118.6 Å²	118.6	73%	0.733	69%	0.689	S	S	*	*			trans	-67.9	114.7	158.2	-82.6	0	0	0	0	108.7	S93	S93-V95 VanDerWaalsContact C-N 3.26Å; S93-V95 PolarHBondContact O-N 3.07Å
96	D	30.3	Very low	35.9	Very low	95 Å²	95	112.4 Å²	112.4	51%	0.508	66%	0.657	S	S	.	*			trans	-74.9	151.2	166.4	-59.9	-51.4	0	0	0	109	L94 V98 G99 K102	L94-D96 PolarHBondContact O-N 3.28Å; D96-V98 PolarHBondContact O-N 2.92Å; D96-G99 PolarHBondContact O-N 3.23Å; D96-K102 IonicContact OD1-NZ 3.18Å; D96-K102 WeakPolarHBondContact OD2-CE 3.31Å; D96-K102 IonicContact OD2-NZ 3.85Å; D96-K102 PolarHBondContact OD2-NZ 3.16Å
97	S	33.6	Very low	38.2	Very low	133 Å²	133	109 Å²	109	93%	0.93	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.6	10.4	-165.8	-41.2	0	0	0	0	117
98	V	37.8	Very low	40.6	Very low	132 Å²	132	107.8 Å²	107.8	80%	0.8	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.1	-4.6	-175	-169.3	0	0	0	0	111.8	D96 N100	D96-V98 PolarHBondContact O-N 2.92Å; V98-N100 VanDerWaalsContact C-N 3.33Å; V98-N100 PolarHBondContact O-N 3.06Å
99	G	31.5	Very low	43	Very low	65 Å²	65	103.7 Å²	103.7	67%	0.67	59%	0.589	S	S	*	*			trans	80.3	1.9	170.5	0	0	0	0	0	116.3	D96 T101	D96-G99 PolarHBondContact O-N 3.23Å; G99-T101 PolarHBondContact O-N 3.25Å
100	N	30.7	Very low	45.7	Very low	139 Å²	139	102.3 Å²	102.3	74%	0.743	58%	0.578	S	S	*	*			trans	-65.3	126.6	170.3	-95.5	1.4	0	0	0	110.8	V98	V98-N100 VanDerWaalsContact C-N 3.33Å; V98-N100 PolarHBondContact O-N 3.06Å
101	T	31.6	Very low	48.5	Very low	120 Å²	120	98.8 Å²	98.8	74%	0.736	55%	0.552	S	S	*	*			trans	-66.6	130.1	164.9	39.9	0	0	0	0	109.5	G99 T103	G99-T101 PolarHBondContact O-N 3.25Å; T101-T103 VanDerWaalsContact C-N 3.33Å; T101-T103 PolarHBondContact O-N 2.98Å
102	K	30.9	Very low	51.2	Low	112 Å²	112	100.2 Å²	100.2	49%	0.487	54%	0.543	S	S	.	.			trans	-70.5	92.6	167.4	-80.1	171.8	179.4	134.4	0	108.6	L94 D96 F104	L94-K102 PolarHBondContact O-NZ 3.48Å; L94-K102 VanDerWaalsContact O-NZ 3.09Å; D96-K102 IonicContact OD1-NZ 3.18Å; D96-K102 WeakPolarHBondContact OD2-CE 3.31Å; D96-K102 IonicContact OD2-NZ 3.85Å; D96-K102 PolarHBondContact OD2-NZ 3.16Å; K102-F104 WeakPolarHBondContact O-CD2 3.5Å; K102-F104 PolarHBondContact O-N 3.47Å
103	T	39.4	Very low	53.8	Low	89 Å²	89	91 Å²	91	55%	0.546	51%	0.507	S	S	.	.			trans	-58.6	117.8	168.9	21.9	0	0	0	0	109.2	T101 D105 F130	T101-T103 VanDerWaalsContact C-N 3.33Å; T101-T103 PolarHBondContact O-N 2.98Å; T103-D105 VanDerWaalsContact C-N 3.28Å; T103-D105 PolarHBondContact O-N 2.85Å; T103-F130 HydrophobicContact CG2-CZ 4.47Å
104	F	51.3	Low	56.1	Low	117 Å²	117	86.7 Å²	86.7	51%	0.513	48%	0.476	S	S	.	.			trans	-77.5	85.5	175.3	-71.9	-81.5	0	0	0	109.1	K102	K102-F104 WeakPolarHBondContact O-CD2 3.5Å; K102-F104 PolarHBondContact O-N 3.47Å
105	D	64	Low	58.1	Low	19 Å²	19	81.5 Å²	81.5	10%	0.102	45%	0.453	C	S	.	.			trans	-66.1	-42.5	-175.4	-166.6	-2.4	0	0	0	112.3	T103 G125 F130 Y134 Q138	T103-D105 VanDerWaalsContact C-N 3.28Å; T103-D105 PolarHBondContact O-N 2.85Å; D105-G125 PolarHBondContact O-N 2.96Å; D105-F130 WeakPolarHBondContact OD1-CB 3.46Å; D105-F130 VanDerWaalsContact OD1-CG 3.29Å; D105-F130 WeakPolarHBondContact OD1-CG 3.3Å; D105-Y134 VanDerWaalsContact CG-CE1 3.48Å; D105-Y134 PolarHBondContact O-OH 2.86Å; D105-Y134 WeakPolarHBondContact OD1-CE1 3.32Å; D105-Y134 PolarHBondContact OD1-OH 2.86Å; D105-Q138 PolarHBondContact OD2-NE2 2.91Å
106	V	74.3	Confident	60.3	Low	16 Å²	16	76.2 Å²	76.2	10%	0.097	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	134.5	176.6	-177	0	0	0	0	109.5	W122 C124 Y134 I142	V106-W122 HydrophobicContact CG1-CB 3.84Å; V106-W122 HydrophobicContact CG1-CD2 4.45Å; V106-W122 HydrophobicContact CG1-CE3 4.17Å; V106-W122 HydrophobicContact CG1-CG 4.37Å; V106-C124 HydrophobicContact CG2-CB 4.44Å; V106-Y134 HydrophobicContact CG2-CE1 3.71Å; V106-I142 HydrophobicContact CG2-CD1 4.04Å
107	E	79.5	Confident	62.8	Low	78 Å²	78	71.8 Å²	71.8	36%	0.364	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	122.3	171.5	-163	-171.8	155.6	0	0	110.5	R57 D123	R57-E107 IonicContact CZ-OE1 2.7Å; R57-E107 IonicContact CZ-OE2 3.65Å; R57-E107 IonicContact NH1-OE1 3.59Å; R57-E107 IonicContact NH1-OE2 3.11Å; R57-E107 PolarHBondContact NH1-OE2 3.2Å; R57-E107 IonicContact NH2-OE1 2.87Å; R57-E107 PolarHBondContact NH2-OE1 3.39Å; R57-E107 IonicContact NH2-OE2 3Å; R57-E107 PolarHBondContact NH2-OE2 3.02Å; E107-D123 PolarHBondContact N-O 3.08Å; E107-D123 PolarHBondContact O-N 3.29Å
108	H	82.6	Confident	65.4	Low	96 Å²	96	66.2 Å²	66.2	44%	0.444	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	123.7	179.9	-54.8	-62	0	0	0	111.4	W122	H108-W122 AromaticContact CE1-CD2 3.5Å; H108-W122 AromaticContact CE1-CE2 3.65Å; H108-W122 AromaticContact CE1-CE3 3.59Å; H108-W122 AromaticContact CE1-CH2 3.96Å; H108-W122 AromaticContact CE1-CZ2 3.89Å; H108-W122 AromaticContact CE1-CZ3 3.82Å; H108-W122 AromaticContact ND1-CD1 3.7Å; H108-W122 AromaticContact ND1-CD2 3.44Å; H108-W122 AromaticContact ND1-CE2 3.51Å; H108-W122 AromaticContact ND1-CG 3.56Å; H108-W122 AromaticContact ND1-NE1 3.65Å
109	S	83.7	Confident	67.9	Low	29 Å²	29	60.1 Å²	60.1	20%	0.203	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	126	173.5	-74.4	0	0	0	0	110.7	L121	S109-L121 PolarHBondContact N-O 3.37Å; S109-L121 PolarHBondContact O-N 2.89Å
110	H	85.8	Confident	70.8	Confident	138 Å²	138	58.2 Å²	58.2	64%	0.639	30%	0.295	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.5	94.1	174.8	-65.4	-68.9	0	0	0	110.3	N120	H110-N120 PolarHBondContact CE1-OD1 3.3Å; H110-N120 PolarHBondContact ND1-OD1 2.97Å
111	V	83.8	Confident	73.7	Confident	27 Å²	27	51.8 Å²	51.8	16%	0.164	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	116.9	179.2	-178.6	0	0	0	0	109.4	F61 V118 L119	F61-V111 HydrophobicContact CB-CG2 4.09Å; F61-V111 HydrophobicContact CD1-CB 4.31Å; F61-V111 HydrophobicContact CD1-CG1 3.68Å; F61-V111 HydrophobicContact CD1-CG2 3.87Å; F61-V111 HydrophobicContact CE1-CG1 4.05Å; F61-V111 HydrophobicContact CE1-CG2 4.48Å; F61-V111 HydrophobicContact CG-CG2 3.94Å; V111-V118 WeakPolarHBondContact O-CA 3.23Å; V111-L119 HydrophobicContact CB-CB 4.32Å; V111-L119 PolarHBondContact N-O 2.7Å; V111-L119 PolarHBondContact O-N 2.65Å
112	R	83.4	Confident	76.6	Confident	153 Å²	153	47.8 Å²	47.8	58%	0.577	23%	0.232	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-77.5	127.5	166.7	-172.9	-178.8	-64.2	-84.2	1.9	108.8	G115 L117	R112-G115 WeakPolarHBondContact CD-O 3.15Å; R112-G115 WeakPolarHBondContact CG-O 3.39Å; R112-G115 PolarHBondContact NH1-O 3.17Å; R112-L117 WeakPolarHBondContact CA-O 3.37Å
113	F	80.8	Confident	79.5	Confident	2 Å²	2	42.5 Å²	42.5	1%	0.009	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	138.8	180	-159.1	-88.3	0	0	0	108	G115 L117 L119 V238 I242 E268 T271 L273 I275	F113-G115 PolarHBondContact O-N 2.99Å; F113-L117 HydrophobicContact CB-CB 4.35Å; F113-L117 HydrophobicContact CB-CD2 4.29Å; F113-L117 HydrophobicContact CB-CG 4.36Å; F113-L117 HydrophobicContact CD1-CD2 4.31Å; F113-L117 PolarHBondContact N-O 2.88Å; F113-L117 WeakPolarHBondContact O-CB 3.42Å; F113-L117 PolarHBondContact O-N 3.46Å; F113-L117 VanDerWaalsContact O-N 3.07Å; F113-L119 HydrophobicContact CB-CD1 4.45Å; F113-L119 HydrophobicContact CB-CG 4.49Å; F113-V238 HydrophobicContact CD1-CG1 3.84Å; F113-V238 HydrophobicContact CD2-CG1 4.24Å; F113-V238 HydrophobicContact CE1-CG1 3.48Å; F113-V238 VanDerWaalsContact CE1-CG1 3.48Å; F113-V238 HydrophobicContact CE2-CG1 3.91Å; F113-V238 HydrophobicContact CG-CG1 4.21Å; F113-V238 HydrophobicContact CZ-CB 4.49Å; F113-V238 HydrophobicContact CZ-CG1 3.51Å; F113-I242 HydrophobicContact CE1-CD1 3.94Å; F113-I242 HydrophobicContact CE1-CG1 4.46Å; F113-E268 HydrophobicContact CD1-CG 4.12Å; F113-E268 HydrophobicContact CD2-CB 4.33Å; F113-E268 HydrophobicContact CD2-CG 3.74Å; F113-E268 HydrophobicContact CE1-CB 3.85Å; F113-E268 HydrophobicContact CE1-CG 3.9Å; F113-E268 HydrophobicContact CE2-CB 3.59Å; F113-E268 HydrophobicContact CE2-CG 3.51Å; F113-E268 HydrophobicContact CG-CG 4.04Å; F113-E268 HydrophobicContact CZ-CB 3.3Å; F113-E268 HydrophobicContact CZ-CG 3.59Å; F113-T271 HydrophobicContact CE2-CG2 4.33Å; F113-L273 HydrophobicContact CE2-CD1 4.21Å; F113-L273 HydrophobicContact CZ-CB 4.44Å; F113-I275 HydrophobicContact CE1-CG1 4.2Å; F113-I275 HydrophobicContact CZ-CG1 4.45Å
114	L	80.1	Confident	81.9	Confident	13 Å²	13	38.3 Å²	38.3	7%	0.068	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.5	20.9	-178.1	-76.5	174.9	0	0	0	116.1	N116 I242 I275 T331	L114-N116 PolarHBondContact O-N 2.9Å; L114-I242 HydrophobicContact CD1-CD1 3.9Å; L114-I242 HydrophobicContact CD1-CG1 4.1Å; L114-I242 HydrophobicContact CD1-CG2 4.08Å; L114-I275 HydrophobicContact CD1-CD1 4.35Å; L114-I275 HydrophobicContact CD1-CG1 4.42Å; L114-I275 HydrophobicContact CD1-CG2 4.2Å; L114-I275 HydrophobicContact CD2-CD1 3.65Å; L114-I275 HydrophobicContact CG-CD1 4.2Å; L114-T331 HydrophobicContact CD2-CG2 3.44Å; L114-T331 VanDerWaalsContact CD2-CG2 3.44Å
115	G	74	Confident	83.7	Confident	18 Å²	18	32.8 Å²	32.8	19%	0.186	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.1	-51.2	-176.1	0	0	0	0	0	114.3	R112 F113 N330	R112-G115 WeakPolarHBondContact CD-O 3.15Å; R112-G115 WeakPolarHBondContact CG-O 3.39Å; R112-G115 PolarHBondContact NH1-O 3.17Å; F113-G115 PolarHBondContact O-N 2.99Å; G115-N330 PolarHBondContact N-OD1 3.15Å
116	N	77.3	Confident	84.8	Confident	10 Å²	10	32.1 Å²	32.1	5%	0.053	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93	-19.2	-173.3	72.9	-19.3	0	0	0	115.1	A38 M39 L114 D365	A38-N116 CarbonylContact C-O 3.59Å; A38-N116 WeakPolarHBondContact CA-O 3.32Å; A38-N116 VanDerWaalsContact CB-O 3.28Å; A38-N116 WeakPolarHBondContact CB-O 3.29Å; M39-N116 PolarHBondContact N-O 3.44Å; L114-N116 PolarHBondContact O-N 2.9Å; N116-D365 PolarHBondContact ND2-OD2 3.48Å
117	L	83.7	Confident	85.4	Confident	2 Å²	2	34.4 Å²	34.4	1%	0.01	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	136.7	176.8	177.5	62.6	0	0	0	109.7	K41 R112 F113 L119 L241 I242	K41-L117 HydrophobicContact CB-CD1 4.19Å; K41-L117 HydrophobicContact CG-CD1 3.57Å; R112-L117 WeakPolarHBondContact CA-O 3.37Å; F113-L117 HydrophobicContact CB-CB 4.35Å; F113-L117 HydrophobicContact CB-CD2 4.29Å; F113-L117 HydrophobicContact CB-CG 4.36Å; F113-L117 HydrophobicContact CD1-CD2 4.31Å; F113-L117 PolarHBondContact N-O 2.88Å; F113-L117 WeakPolarHBondContact O-CB 3.42Å; F113-L117 PolarHBondContact O-N 3.46Å; F113-L117 VanDerWaalsContact O-N 3.07Å; L117-L119 HydrophobicContact CD1-CD2 4.22Å; L117-L119 HydrophobicContact CD2-CD2 4Å; L117-L119 HydrophobicContact CG-CD2 4.02Å; L117-L119 HydrophobicContact CG-CG 4.47Å; L117-L241 HydrophobicContact CD2-CB 4.48Å; L117-I242 HydrophobicContact CD2-CG1 4.33Å
118	V	88.1	Confident	85.7	Confident	16 Å²	16	33.8 Å²	33.8	10%	0.097	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	109.3	172.6	177.2	0	0	0	0	108.7	A38 M39 K40 K41 V111 N120	A38-V118 HydrophobicContact CB-CG2 3.87Å; M39-V118 PolarHBondContact O-N 3.35Å; K40-V118 WeakPolarHBondContact CA-O 3.43Å; K40-V118 HydrophobicContact CG-CB 4.28Å; K40-V118 HydrophobicContact CG-CG1 4.47Å; K41-V118 PolarHBondContact N-O 3.23Å; V111-V118 WeakPolarHBondContact O-CA 3.23Å; V118-N120 PolarHBondContact O-N 3.44Å
119	L	89.3	Confident	85.9	Confident	4 Å²	4	33 Å²	33	2%	0.021	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	111.5	173	-55.5	179.9	0	0	0	108.3	K41 V43 V111 F113 L117 L121 V238 L241	K41-L119 HydrophobicContact CB-CD2 4.3Å; V43-L119 HydrophobicContact CG2-CD2 4.4Å; V111-L119 HydrophobicContact CB-CB 4.32Å; V111-L119 PolarHBondContact N-O 2.7Å; V111-L119 PolarHBondContact O-N 2.65Å; F113-L119 HydrophobicContact CB-CD1 4.45Å; F113-L119 HydrophobicContact CB-CG 4.49Å; L117-L119 HydrophobicContact CD1-CD2 4.22Å; L117-L119 HydrophobicContact CD2-CD2 4Å; L117-L119 HydrophobicContact CG-CD2 4.02Å; L117-L119 HydrophobicContact CG-CG 4.47Å; L119-L121 PolarHBondContact O-N 2.73Å; L119-V238 HydrophobicContact CD1-CG2 4.13Å; L119-L241 HydrophobicContact CD2-CD1 3.7Å
120	N	92.3	Very high	86.1	Confident	25 Å²	25	32.4 Å²	32.4	13%	0.134	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	89.5	168.5	-60.4	-30.5	0	0	0	107.2	K41 V43 H110 V118	K41-N120 PolarHBondContact O-N 2.62Å; V43-N120 PolarHBondContact N-O 2.88Å; H110-N120 PolarHBondContact CE1-OD1 3.3Å; H110-N120 PolarHBondContact ND1-OD1 2.97Å; V118-N120 PolarHBondContact O-N 3.44Å
121	L	91.4	Very high	86.2	Confident	3 Å²	3	26 Å²	26	2%	0.016	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	125	-178.9	-172	160.4	0	0	0	109.5	V43 L45 R57 F61 S109 L119 D123 W234	V43-L121 WeakPolarHBondContact O-CA 3.44Å; L45-L121 HydrophobicContact CB-CD2 4.36Å; L45-L121 HydrophobicContact CD2-CD2 4.21Å; R57-L121 HydrophobicContact CG-CD1 4.12Å; R57-L121 HydrophobicContact CG-CD2 3.87Å; F61-L121 HydrophobicContact CD2-CD1 4.08Å; F61-L121 HydrophobicContact CE2-CD1 3.67Å; F61-L121 HydrophobicContact CZ-CD1 4.47Å; S109-L121 PolarHBondContact N-O 3.37Å; S109-L121 PolarHBondContact O-N 2.89Å; L119-L121 PolarHBondContact O-N 2.73Å; L121-D123 HydrophobicContact CD2-CB 4.19Å; L121-W234 HydrophobicContact CD1-CH2 3.73Å; L121-W234 HydrophobicContact CD1-CZ3 4.08Å
122	W	94.1	Very high	86.4	Confident	37 Å²	37	29.7 Å²	29.7	14%	0.14	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	103.6	-179.1	-70.4	38.8	0	0	0	108	K42 V43 L44 L45 V106 H108 I142	K42-W122 HydrophobicContact CD-CZ2 4.46Å; V43-W122 PolarHBondContact O-N 2.93Å; L44-W122 HydrophobicContact CD2-CB 3.82Å; L44-W122 HydrophobicContact CD2-CD2 4.28Å; L44-W122 HydrophobicContact CD2-CE3 4.2Å; L44-W122 HydrophobicContact CD2-CG 4.15Å; L45-W122 PolarHBondContact N-O 2.91Å; V106-W122 HydrophobicContact CG1-CB 3.84Å; V106-W122 HydrophobicContact CG1-CD2 4.45Å; V106-W122 HydrophobicContact CG1-CE3 4.17Å; V106-W122 HydrophobicContact CG1-CG 4.37Å; H108-W122 AromaticContact CE1-CD2 3.5Å; H108-W122 AromaticContact CE1-CE2 3.65Å; H108-W122 AromaticContact CE1-CE3 3.59Å; H108-W122 AromaticContact CE1-CH2 3.96Å; H108-W122 AromaticContact CE1-CZ2 3.89Å; H108-W122 AromaticContact CE1-CZ3 3.82Å; H108-W122 AromaticContact ND1-CD1 3.7Å; H108-W122 AromaticContact ND1-CD2 3.44Å; H108-W122 AromaticContact ND1-CE2 3.51Å; H108-W122 AromaticContact ND1-CG 3.56Å; H108-W122 AromaticContact ND1-NE1 3.65Å; W122-I142 HydrophobicContact CE3-CD1 4.2Å; W122-I142 HydrophobicContact CZ3-CD1 3.96Å
123	D	91.3	Very high	86.6	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	105.3	176.9	-170.5	7.6	0	0	0	109	L45 K53 T54 R57 E107 L121	L45-D123 HydrophobicContact CD2-CB 4.4Å; K53-D123 VanDerWaalsContact CB-OD1 3.31Å; K53-D123 WeakPolarHBondContact CB-OD1 3.28Å; K53-D123 VanDerWaalsContact CE-OD1 3.31Å; K53-D123 WeakPolarHBondContact CE-OD1 3.49Å; T54-D123 WeakPolarHBondContact CA-OD2 3.49Å; T54-D123 VanDerWaalsContact CB-OD2 3.31Å; T54-D123 WeakPolarHBondContact CB-OD2 3.43Å; T54-D123 PolarHBondContact N-OD2 3.37Å; T54-D123 PolarHBondContact OG1-OD2 3.41Å; R57-D123 IonicContact CZ-OD2 2.62Å; R57-D123 IonicContact NE-OD2 2.8Å; R57-D123 IonicContact NH1-OD2 3.49Å; R57-D123 PolarHBondContact NH1-OD2 3.01Å; E107-D123 PolarHBondContact N-O 3.08Å; E107-D123 PolarHBondContact O-N 3.29Å; L121-D123 HydrophobicContact CD2-CB 4.19Å
124	C	90.3	Very high	87	Confident	1 Å²	1	25.4 Å²	25.4	1%	0.007	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	132.6	-172.5	-65.7	0	0	0	0	111.4	L45 M46 K53 V106 G126 Y134	L45-C124 PolarHBondContact O-N 3.33Å; M46-C124 HydrophobicContact CE-CB 4.33Å; M46-C124 HydrophobicContact CG-CB 4.11Å; K53-C124 WeakPolarHBondContact CE-O 3.47Å; K53-C124 PolarHBondContact NZ-O 2.97Å; V106-C124 HydrophobicContact CG2-CB 4.44Å; C124-G126 PolarHBondContact O-N 3.46Å; C124-G126 VanDerWaalsContact O-N 3.15Å; C124-Y134 HydrophobicContact CB-CE2 3.66Å
125	G	87.8	Confident	87.4	Confident	2 Å²	2	26.1 Å²	26.1	2%	0.021	14%	0.138	C	C	.	.			trans	-58.9	115.7	173.9	0	0	0	0	0	111.6	D105 Q127 F130 Y134	D105-G125 PolarHBondContact O-N 2.96Å; G125-Q127 PolarHBondContact O-N 2.82Å; G125-Q127 VanDerWaalsContact O-N 3.11Å; G125-F130 VanDerWaalsContact O-CB 3.31Å; G125-F130 WeakPolarHBondContact O-CB 3.3Å; G125-Y134 PolarHBondContact N-OH 2.85Å; G125-Y134 PolarHBondContact O-OH 2.87Å
126	G	87.1	Confident	88	Confident	4 Å²	4	30 Å²	30	4%	0.041	16%	0.159	C	C	.	.			trans	-83.5	23.1	-171.4	0	0	0	0	0	115.5	G47 K48 S49 C124	G47-G126 WeakPolarHBondContact O-CA 3.2Å; K48-G126 CarbonylContact C-O 3.59Å; S49-G126 WeakPolarHBondContact CB-O 3.43Å; S49-G126 PolarHBondContact N-O 2.69Å; C124-G126 PolarHBondContact O-N 3.46Å; C124-G126 VanDerWaalsContact O-N 3.15Å
127	Q	86.7	Confident	88.4	Confident	65 Å²	65	34.2 Å²	34.2	30%	0.304	19%	0.189	S	C	.	.	S	Bend	trans	-85.2	146.5	179.5	-60.4	-168.9	6.4	0	0	109.9	I76 G125 T129 F130 M131	I76-Q127 VanDerWaalsContact CD1-NE2 3.34Å; G125-Q127 PolarHBondContact O-N 2.82Å; G125-Q127 VanDerWaalsContact O-N 3.11Å; Q127-T129 VanDerWaalsContact C-N 3.28Å; Q127-T129 PolarHBondContact O-N 2.83Å; Q127-F130 HydrophobicContact CB-CD2 4.09Å; Q127-F130 HydrophobicContact CB-CG 4.43Å; Q127-F130 HydrophobicContact CG-CD2 4.43Å; Q127-F130 WeakPolarHBondContact O-CA 3.44Å; Q127-F130 WeakPolarHBondContact O-CB 3.36Å; Q127-F130 PolarHBondContact O-N 2.96Å; Q127-M131 WeakPolarHBondContact O-CG 2.95Å; Q127-M131 PolarHBondContact O-N 3.34Å
128	D	86.7	Confident	88.4	Confident	64 Å²	64	36.8 Å²	36.8	34%	0.342	20%	0.201	S	C	.	.	H	α-helix	trans	-50.3	-46.9	-174	-60.4	-19.6	0	0	0	112.6	F130 M131 E132 K162 Y166	D128-F130 VanDerWaalsContact C-N 3.31Å; D128-F130 PolarHBondContact O-N 2.85Å; D128-M131 PolarHBondContact O-N 3.4Å; D128-E132 WeakPolarHBondContact O-CB 3.48Å; D128-E132 WeakPolarHBondContact O-CG 3.37Å; D128-E132 PolarHBondContact O-N 2.87Å; D128-K162 IonicContact OD1-NZ 3.59Å; D128-K162 PolarHBondContact OD1-NZ 2.74Å; D128-K162 IonicContact OD2-NZ 2.69Å; D128-K162 PolarHBondContact OD2-NZ 2.65Å; D128-Y166 WeakPolarHBondContact CB-OH 3.31Å; D128-Y166 PolarHBondContact OD1-OH 2.7Å
129	T	86.8	Confident	88.4	Confident	80 Å²	80	38.6 Å²	38.6	49%	0.491	21%	0.206	S	C	.	.	H	α-helix	trans	-62.8	-32.1	178.3	50.9	0	0	0	0	113.9	Q127 N133	Q127-T129 VanDerWaalsContact C-N 3.28Å; Q127-T129 PolarHBondContact O-N 2.83Å; T129-N133 PolarHBondContact O-N 2.89Å; T129-N133 PolarHBondContact O-ND2 2.92Å; T129-N133 VanDerWaalsContact O-ND2 3.08Å
130	F	87.7	Confident	88.3	Confident	17 Å²	17	43.6 Å²	43.6	8%	0.075	23%	0.233	C	C	.	.	H	α-helix	trans	-77.7	-41.9	174.8	-66.9	-17.7	0	0	0	111.2	I76 T103 D105 G125 Q127 D128 E132 N133 Y134	I76-F130 HydrophobicContact CD1-CE2 3.59Å; I76-F130 HydrophobicContact CD1-CZ 3.57Å; I76-F130 HydrophobicContact CG1-CE2 3.71Å; I76-F130 HydrophobicContact CG1-CZ 3.96Å; T103-F130 HydrophobicContact CG2-CZ 4.47Å; D105-F130 WeakPolarHBondContact OD1-CB 3.46Å; D105-F130 VanDerWaalsContact OD1-CG 3.29Å; D105-F130 WeakPolarHBondContact OD1-CG 3.3Å; G125-F130 VanDerWaalsContact O-CB 3.31Å; G125-F130 WeakPolarHBondContact O-CB 3.3Å; Q127-F130 HydrophobicContact CB-CD2 4.09Å; Q127-F130 HydrophobicContact CB-CG 4.43Å; Q127-F130 HydrophobicContact CG-CD2 4.43Å; Q127-F130 WeakPolarHBondContact O-CA 3.44Å; Q127-F130 WeakPolarHBondContact O-CB 3.36Å; Q127-F130 PolarHBondContact O-N 2.96Å; D128-F130 VanDerWaalsContact C-N 3.31Å; D128-F130 PolarHBondContact O-N 2.85Å; F130-E132 VanDerWaalsContact C-N 3.34Å; F130-E132 PolarHBondContact O-N 2.53Å; F130-N133 WeakPolarHBondContact O-CB 3.47Å; F130-N133 PolarHBondContact O-N 3.2Å; F130-N133 VanDerWaalsContact O-N 3.13Å; F130-Y134 HydrophobicContact CB-CE2 4.28Å; F130-Y134 WeakPolarHBondContact O-CD1 3.38Å; F130-Y134 WeakPolarHBondContact O-CD2 3.5Å; F130-Y134 VanDerWaalsContact O-CG 3.24Å; F130-Y134 PolarHBondContact O-N 3.2Å
131	M	87.4	Confident	88.1	Confident	2 Å²	2	47 Å²	47	1%	0.01	25%	0.251	C	S	.	.	H	α-helix	trans	-58.3	-46.2	174.2	-65.1	-66.2	-69.4	0	0	111.1	M46 Q127 D128 N133 Y134 F135 Y166	M46-M131 HydrophobicContact CE-CE 4.44Å; M46-M131 HydrophobicContact CE-SD 4.31Å; Q127-M131 WeakPolarHBondContact O-CG 2.95Å; Q127-M131 PolarHBondContact O-N 3.34Å; D128-M131 PolarHBondContact O-N 3.4Å; M131-N133 VanDerWaalsContact C-N 3.35Å; M131-N133 PolarHBondContact O-N 3.03Å; M131-Y134 WeakPolarHBondContact O-CB 3.43Å; M131-Y134 PolarHBondContact O-N 3.18Å; M131-Y134 HydrophobicContact SD-CD2 3.97Å; M131-Y134 HydrophobicContact SD-CE2 4.01Å; M131-F135 HydrophobicContact CB-CE2 4.15Å; M131-F135 HydrophobicContact CE-CE2 4.03Å; M131-F135 HydrophobicContact CE-CZ 3.89Å; M131-F135 WeakPolarHBondContact O-CD2 3.49Å; M131-F135 WeakPolarHBondContact O-CE2 3.19Å; M131-F135 PolarHBondContact O-N 2.9Å; M131-F135 VanDerWaalsContact O-N 3.15Å; M131-Y166 HydrophobicContact CB-CD1 4.28Å; M131-Y166 HydrophobicContact CB-CE1 4.05Å; M131-Y166 HydrophobicContact CE-CD1 4.48Å; M131-Y166 HydrophobicContact CE-CG 4.14Å
132	E	87.8	Confident	88.2	Confident	106 Å²	106	46.9 Å²	46.9	50%	0.495	25%	0.25	S	S	.	.	H	α-helix	trans	-59.5	-41.6	173.9	-73.7	167.5	-164.5	0	0	112.5	D128 F130 Y134 F135 T136	D128-E132 WeakPolarHBondContact O-CB 3.48Å; D128-E132 WeakPolarHBondContact O-CG 3.37Å; D128-E132 PolarHBondContact O-N 2.87Å; F130-E132 VanDerWaalsContact C-N 3.34Å; F130-E132 PolarHBondContact O-N 2.53Å; E132-Y134 VanDerWaalsContact C-N 3.35Å; E132-Y134 PolarHBondContact O-N 2.93Å; E132-F135 PolarHBondContact O-N 2.86Å; E132-T136 WeakPolarHBondContact O-CB 3.49Å; E132-T136 WeakPolarHBondContact O-CG2 3.3Å; E132-T136 PolarHBondContact O-N 2.66Å; E132-T136 VanDerWaalsContact O-N 3.08Å; E132-T136 PolarHBondContact O-OG1 2.83Å
133	N	87.6	Confident	88.2	Confident	65 Å²	65	45.1 Å²	45.1	35%	0.348	24%	0.244	S	C	.	.	H	α-helix	trans	-64.3	-34.8	174.8	-75.4	-27.2	0	0	0	113	T129 F130 M131 S137 Q138	T129-N133 PolarHBondContact O-N 2.89Å; T129-N133 PolarHBondContact O-ND2 2.92Å; T129-N133 VanDerWaalsContact O-ND2 3.08Å; F130-N133 WeakPolarHBondContact O-CB 3.47Å; F130-N133 PolarHBondContact O-N 3.2Å; F130-N133 VanDerWaalsContact O-N 3.13Å; M131-N133 VanDerWaalsContact C-N 3.35Å; M131-N133 PolarHBondContact O-N 3.03Å; N133-S137 PolarHBondContact O-N 2.7Å; N133-Q138 PolarHBondContact O-N 3.27Å
134	Y	89.4	Confident	88.3	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-66.4	-40.5	174.6	-55.9	-32.9	0	0	0	112.5	M46 D105 V106 C124 G125 F130 M131 E132 R139 I142	M46-Y134 HydrophobicContact CE-CD2 3.56Å; M46-Y134 HydrophobicContact CE-CE2 4.15Å; M46-Y134 HydrophobicContact CE-CG 4.31Å; D105-Y134 VanDerWaalsContact CG-CE1 3.48Å; D105-Y134 PolarHBondContact O-OH 2.86Å; D105-Y134 WeakPolarHBondContact OD1-CE1 3.32Å; D105-Y134 PolarHBondContact OD1-OH 2.86Å; V106-Y134 HydrophobicContact CG2-CE1 3.71Å; C124-Y134 HydrophobicContact CB-CE2 3.66Å; G125-Y134 PolarHBondContact N-OH 2.85Å; G125-Y134 PolarHBondContact O-OH 2.87Å; F130-Y134 HydrophobicContact CB-CE2 4.28Å; F130-Y134 WeakPolarHBondContact O-CD1 3.38Å; F130-Y134 WeakPolarHBondContact O-CD2 3.5Å; F130-Y134 VanDerWaalsContact O-CG 3.24Å; F130-Y134 PolarHBondContact O-N 3.2Å; M131-Y134 WeakPolarHBondContact O-CB 3.43Å; M131-Y134 PolarHBondContact O-N 3.18Å; M131-Y134 HydrophobicContact SD-CD2 3.97Å; M131-Y134 HydrophobicContact SD-CE2 4.01Å; E132-Y134 VanDerWaalsContact C-N 3.35Å; E132-Y134 PolarHBondContact O-N 2.93Å; Y134-R139 WeakPolarHBondContact O-CA 3.38Å; Y134-R139 PolarHBondContact O-N 3.24Å; Y134-R139 VanDerWaalsContact O-N 3.08Å; Y134-I142 HydrophobicContact CD1-CD1 4.05Å; Y134-I142 HydrophobicContact CD1-CG1 3.84Å; Y134-I142 HydrophobicContact CE1-CD1 4.41Å; Y134-I142 HydrophobicContact CG-CG1 4.26Å
135	F	88.8	Confident	88.5	Confident	27 Å²	27	58 Å²	58	12%	0.118	30%	0.301	C	S	.	.	H	α-helix	trans	-79.9	-23.3	-177.3	-58.9	-52.4	0	0	0	113.8	M131 E132 R139 F143 Y166 S169 C170	M131-F135 HydrophobicContact CB-CE2 4.15Å; M131-F135 HydrophobicContact CE-CE2 4.03Å; M131-F135 HydrophobicContact CE-CZ 3.89Å; M131-F135 WeakPolarHBondContact O-CD2 3.49Å; M131-F135 WeakPolarHBondContact O-CE2 3.19Å; M131-F135 PolarHBondContact O-N 2.9Å; M131-F135 VanDerWaalsContact O-N 3.15Å; E132-F135 PolarHBondContact O-N 2.86Å; F135-R139 PolarHBondContact O-NH1 3.24Å; F135-R139 VanDerWaalsContact O-NH1 3.12Å; F135-F143 HydrophobicContact CD1-CE2 4.01Å; F135-F143 HydrophobicContact CD1-CZ 4.11Å; F135-F143 HydrophobicContact CE1-CE2 4.13Å; F135-F143 AromaticContact CE1-CZ 3.73Å; F135-F143 HydrophobicContact CE1-CZ 3.73Å; F135-Y166 AromaticContact CE2-CD1 3.81Å; F135-Y166 HydrophobicContact CE2-CD1 3.81Å; F135-Y166 HydrophobicContact CE2-CE1 4.47Å; F135-S169 VanDerWaalsContact CE1-C 3.45Å; F135-C170 HydrophobicContact CE1-CB 4.35Å; F135-C170 VanDerWaalsContact CE1-SG 3.59Å; F135-C170 VanDerWaalsContact CZ-SG 3.56Å
136	T	87.3	Confident	88.9	Confident	100 Å²	100	58.3 Å²	58.3	61%	0.613	30%	0.303	S	S	*	.	H	α-helix	trans	-101.5	-71.2	-178.5	57.9	0	0	0	0	112.8	E132	E132-T136 WeakPolarHBondContact O-CB 3.49Å; E132-T136 WeakPolarHBondContact O-CG2 3.3Å; E132-T136 PolarHBondContact O-N 2.66Å; E132-T136 VanDerWaalsContact O-N 3.08Å; E132-T136 PolarHBondContact O-OG1 2.83Å
137	S	84.3	Confident	89.3	Confident	99 Å²	99	61.5 Å²	61.5	69%	0.692	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-24.7	-164.3	-59.9	0	0	0	0	113.8	N133	N133-S137 PolarHBondContact O-N 2.7Å
138	Q	84.2	Confident	89.8	Confident	56 Å²	56	58.4 Å²	58.4	26%	0.262	30%	0.302	S	S	.	.	S	Bend	trans	-115.6	7.9	-176.8	-61.1	-176.8	52.4	0	0	114	D105 N133 D140 N141 I142	D105-Q138 PolarHBondContact OD2-NE2 2.91Å; N133-Q138 PolarHBondContact O-N 3.27Å; Q138-D140 PolarHBondContact O-N 3.42Å; Q138-N141 WeakPolarHBondContact O-CA 3.25Å; Q138-N141 WeakPolarHBondContact O-CB 3.38Å; Q138-N141 PolarHBondContact O-N 3.21Å; Q138-I142 HydrophobicContact CB-CD1 4.42Å; Q138-I142 HydrophobicContact CB-CG1 3.91Å; Q138-I142 WeakPolarHBondContact O-CG1 2.98Å; Q138-I142 PolarHBondContact O-N 2.82Å
139	R	88.3	Confident	90.3	Very high	54 Å²	54	55.4 Å²	55.4	20%	0.204	29%	0.286	C	S	.	.	H	α-helix	trans	-46.7	-54.9	-170.3	-164.3	-175.8	-173.3	94.7	-2.3	112.7	Y134 F135 N141 I142 F143 A173	Y134-R139 WeakPolarHBondContact O-CA 3.38Å; Y134-R139 PolarHBondContact O-N 3.24Å; Y134-R139 VanDerWaalsContact O-N 3.08Å; F135-R139 PolarHBondContact O-NH1 3.24Å; F135-R139 VanDerWaalsContact O-NH1 3.12Å; R139-N141 VanDerWaalsContact C-N 3.27Å; R139-N141 PolarHBondContact O-N 3.25Å; R139-I142 PolarHBondContact O-N 2.88Å; R139-F143 HydrophobicContact CG-CD2 4.16Å; R139-F143 WeakPolarHBondContact O-CD2 3.44Å; R139-F143 PolarHBondContact O-N 3.37Å; R139-A173 HydrophobicContact CG-CB 4.32Å
140	D	86.8	Confident	90.9	Very high	109 Å²	109	51.6 Å²	51.6	58%	0.583	26%	0.262	S	S	*	.	H	α-helix	trans	-69.3	-21.6	-177.3	-57.2	2.5	0	0	0	113.3	Q138 R144	Q138-D140 PolarHBondContact O-N 3.42Å; D140-R144 WeakPolarHBondContact O-CB 3.46Å
141	N	88.8	Confident	91.4	Very high	95 Å²	95	50.9 Å²	50.9	51%	0.508	26%	0.259	S	S	.	.	H	α-helix	trans	-84.4	-43.4	175.8	-177.9	46.8	0	0	0	111.3	K42 Q138 R139	K42-N141 PolarHBondContact NZ-O 3.17Å; Q138-N141 WeakPolarHBondContact O-CA 3.25Å; Q138-N141 WeakPolarHBondContact O-CB 3.38Å; Q138-N141 PolarHBondContact O-N 3.21Å; R139-N141 VanDerWaalsContact C-N 3.27Å; R139-N141 PolarHBondContact O-N 3.25Å
142	I	92.3	Very high	91.9	Very high	1 Å²	1	50.8 Å²	50.8	1%	0.005	26%	0.259	C	S	.	.	H	α-helix	trans	-69.9	-52.5	178.8	-57.1	-52.8	0	0	0	110.8	K42 L44 M46 V106 W122 Y134 Q138 R139	K42-I142 VanDerWaalsContact CE-O 3.25Å; K42-I142 WeakPolarHBondContact CE-O 3.11Å; K42-I142 PolarHBondContact NZ-O 2.87Å; L44-I142 HydrophobicContact CD1-CG2 3.93Å; L44-I142 HydrophobicContact CD2-CG2 4.23Å; M46-I142 HydrophobicContact SD-CG2 4.48Å; V106-I142 HydrophobicContact CG2-CD1 4.04Å; W122-I142 HydrophobicContact CE3-CD1 4.2Å; W122-I142 HydrophobicContact CZ3-CD1 3.96Å; Y134-I142 HydrophobicContact CD1-CD1 4.05Å; Y134-I142 HydrophobicContact CD1-CG1 3.84Å; Y134-I142 HydrophobicContact CE1-CD1 4.41Å; Y134-I142 HydrophobicContact CG-CG1 4.26Å; Q138-I142 HydrophobicContact CB-CD1 4.42Å; Q138-I142 HydrophobicContact CB-CG1 3.91Å; Q138-I142 WeakPolarHBondContact O-CG1 2.98Å; Q138-I142 PolarHBondContact O-N 2.82Å; R139-I142 PolarHBondContact O-N 2.88Å
143	F	95.1	Very high	92.3	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.239	C	C	.	.	S	Bend	trans	-94	-4.6	-165.2	-62.9	-75.9	0	0	0	115.6	L44 M46 F135 R139 V146 C170 A173 I174 N177 S178	L44-F143 HydrophobicContact CD1-CD1 3.87Å; L44-F143 HydrophobicContact CD1-CE1 4.06Å; M46-F143 HydrophobicContact CE-CE1 4.38Å; M46-F143 HydrophobicContact CE-CZ 3.93Å; M46-F143 HydrophobicContact SD-CE1 3.71Å; M46-F143 HydrophobicContact SD-CZ 3.89Å; F135-F143 HydrophobicContact CD1-CE2 4.01Å; F135-F143 HydrophobicContact CD1-CZ 4.11Å; F135-F143 HydrophobicContact CE1-CE2 4.13Å; F135-F143 AromaticContact CE1-CZ 3.73Å; F135-F143 HydrophobicContact CE1-CZ 3.73Å; R139-F143 HydrophobicContact CG-CD2 4.16Å; R139-F143 WeakPolarHBondContact O-CD2 3.44Å; R139-F143 PolarHBondContact O-N 3.37Å; F143-V146 WeakPolarHBondContact O-CG2 3.5Å; F143-C170 HydrophobicContact CE1-CB 4.26Å; F143-A173 HydrophobicContact CB-CB 4.15Å; F143-A173 HydrophobicContact CD1-CB 3.87Å; F143-A173 HydrophobicContact CD2-CB 3.46Å; F143-A173 VanDerWaalsContact CD2-CB 3.46Å; F143-A173 HydrophobicContact CE1-CB 4.11Å; F143-A173 HydrophobicContact CE2-CB 3.73Å; F143-A173 HydrophobicContact CG-CB 3.54Å; F143-A173 HydrophobicContact CZ-CB 4.04Å; F143-I174 HydrophobicContact CD1-CD1 3.86Å; F143-I174 HydrophobicContact CD1-CG1 3.93Å; F143-I174 HydrophobicContact CE1-CG1 4.48Å; F143-N177 HydrophobicContact CB-CB 4.03Å; F143-N177 VanDerWaalsContact O-CB 3.27Å; F143-N177 WeakPolarHBondContact O-CB 3.43Å; F143-S178 PolarHBondContact O-OG 3.48Å; F143-S178 VanDerWaalsContact O-OG 3.09Å
144	R	93.9	Very high	92.8	Very high	155 Å²	155	44.7 Å²	44.7	59%	0.585	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.6	144.7	176	-177.3	173.3	-178.8	174.4	4.2	113.4	K42 D140 V146	K42-R144 PolarHBondContact NZ-O 3.11Å; D140-R144 WeakPolarHBondContact O-CB 3.46Å; R144-V146 PolarHBondContact O-N 3.02Å
145	N	93.8	Very high	93.1	Very high	118 Å²	118	46.2 Å²	46.2	63%	0.631	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.4	38.3	-179.7	-59.8	4.5	0	0	0	112.7	K42 S178	K42-N145 VanDerWaalsContact CB-O 3.3Å; K42-N145 WeakPolarHBondContact CB-O 3.28Å; N145-S178 PolarHBondContact N-OG 2.82Å
146	V	96.3	Very high	93.3	Very high	8 Å²	8	50.1 Å²	50.1	5%	0.048	26%	0.257	C	S	.	.			trans	-83.8	132.5	176.6	179.1	0	0	0	0	108.8	K42 L44 F143 R144 V148 I174 S178 A181	K42-V146 HydrophobicContact CD-CG2 4.18Å; L44-V146 HydrophobicContact CD1-CG1 4.17Å; L44-V146 HydrophobicContact CD1-CG2 3.67Å; L44-V146 HydrophobicContact CD2-CG2 4.43Å; L44-V146 HydrophobicContact CG-CG1 3.95Å; L44-V146 HydrophobicContact CG-CG2 3.81Å; F143-V146 WeakPolarHBondContact O-CG2 3.5Å; R144-V146 PolarHBondContact O-N 3.02Å; V146-V148 VanDerWaalsContact CG1-O 3.3Å; V146-V148 WeakPolarHBondContact CG1-O 3.49Å; V146-I174 HydrophobicContact CB-CD1 3.9Å; V146-I174 HydrophobicContact CG1-CD1 3.82Å; V146-I174 HydrophobicContact CG2-CD1 4.08Å; V146-S178 PolarHBondContact N-OG 3.44Å; V146-A181 HydrophobicContact CB-CB 4.34Å; V146-A181 HydrophobicContact CG1-CB 4.14Å; V146-A181 WeakPolarHBondContact O-CB 3.43Å
147	E	95.8	Very high	93.6	Very high	71 Å²	71	46.1 Å²	46.1	33%	0.332	23%	0.233	S	C	.	.	S	Bend	trans	-101.8	-33.5	179	-66.1	-98.2	-166.4	0	0	110.7	K41 K42 K182 L241	K41-E147 HydrophobicContact CB-CB 4.47Å; K41-E147 HydrophobicContact CB-CG 4.35Å; K41-E147 HydrophobicContact CD-CB 4.13Å; K41-E147 HydrophobicContact CD-CG 3.58Å; K41-E147 WeakPolarHBondContact CD-OE1 3.37Å; K41-E147 WeakPolarHBondContact CD-OE2 3.27Å; K41-E147 WeakPolarHBondContact CE-OE1 3.15Å; K41-E147 WeakPolarHBondContact CE-OE2 3.49Å; K41-E147 IonicContact NZ-OE1 2.67Å; K41-E147 PolarHBondContact NZ-OE1 3.23Å; K41-E147 IonicContact NZ-OE2 2.64Å; K41-E147 PolarHBondContact NZ-OE2 2.9Å; K42-E147 PolarHBondContact O-N 3.24Å; E147-K182 PolarHBondContact O-N 3.11Å; E147-L241 HydrophobicContact CB-CD2 4.13Å
148	V	97.1	Very high	93.9	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	133.4	176.5	167.5	0	0	0	0	110	K42 V43 L44 V146 I150 K182 F184 I237 L241	K42-V148 PolarHBondContact O-N 2.92Å; V43-V148 WeakPolarHBondContact CA-O 3.28Å; V43-V148 HydrophobicContact CG1-CB 4.22Å; V43-V148 HydrophobicContact CG1-CG1 4.02Å; V43-V148 HydrophobicContact CG2-CB 4.35Å; L44-V148 PolarHBondContact N-O 3.35Å; V146-V148 VanDerWaalsContact CG1-O 3.3Å; V146-V148 WeakPolarHBondContact CG1-O 3.49Å; V148-I150 HydrophobicContact CG1-CD1 4.47Å; V148-I150 HydrophobicContact CG1-CG1 3.71Å; V148-K182 CarbonylContact C-O 3.58Å; V148-K182 VanDerWaalsContact CA-O 3.3Å; V148-K182 WeakPolarHBondContact CA-O 3.31Å; V148-K182 HydrophobicContact CG2-CB 4.19Å; V148-F184 HydrophobicContact CG1-CD2 3.75Å; V148-F184 HydrophobicContact CG1-CE2 3.99Å; V148-F184 HydrophobicContact CG2-CE2 4.17Å; V148-I237 HydrophobicContact CG1-CG2 4.11Å; V148-L241 HydrophobicContact CG2-CD1 3.94Å; V148-L241 HydrophobicContact CG2-CD2 3.73Å; V148-L241 HydrophobicContact CG2-CG 3.88Å
149	L	97.8	Very high	94.3	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	122.2	160.6	172.8	61.4	0	0	0	109.2	L44 M46 C170 I174 K182 I183 F184	L44-L149 HydrophobicContact CB-CD1 3.79Å; L44-L149 HydrophobicContact CD1-CD1 4.44Å; M46-L149 HydrophobicContact CB-CD1 4.1Å; M46-L149 HydrophobicContact CG-CD1 3.98Å; M46-L149 HydrophobicContact SD-CD1 4.1Å; L149-C170 HydrophobicContact CD2-CB 4.15Å; L149-I174 HydrophobicContact CB-CD1 4.47Å; L149-I174 HydrophobicContact CD2-CG1 3.99Å; L149-K182 PolarHBondContact N-O 2.74Å; L149-I183 HydrophobicContact CB-CG1 4.3Å; L149-F184 PolarHBondContact O-N 2.77Å
150	I	98.2	Very high	94.4	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	110.1	167.3	-48.1	173.5	0	0	0	107	V43 L44 L45 M46 V148 V152 F184 L186 W234 I237	V43-I150 HydrophobicContact CG1-CD1 3.63Å; V43-I150 HydrophobicContact CG1-CG1 4.02Å; L44-I150 PolarHBondContact O-N 3.23Å; L45-I150 WeakPolarHBondContact CA-O 3.43Å; L45-I150 HydrophobicContact CD1-CB 3.81Å; L45-I150 HydrophobicContact CD1-CD1 4.42Å; L45-I150 HydrophobicContact CD1-CG2 3.71Å; M46-I150 PolarHBondContact N-O 2.92Å; V148-I150 HydrophobicContact CG1-CD1 4.47Å; V148-I150 HydrophobicContact CG1-CG1 3.71Å; I150-V152 HydrophobicContact CG2-CG2 4.41Å; I150-F184 WeakPolarHBondContact CA-O 3.34Å; I150-L186 HydrophobicContact CG2-CD1 3.56Å; I150-L186 HydrophobicContact CG2-CG 3.77Å; I150-W234 HydrophobicContact CD1-CE3 4.36Å; I150-W234 HydrophobicContact CD1-CH2 3.28Å; I150-W234 HydrophobicContact CD1-CZ2 3.91Å; I150-W234 HydrophobicContact CD1-CZ3 3.55Å; I150-I237 HydrophobicContact CD1-CD1 4.06Å; I150-I237 HydrophobicContact CD1-CG2 4.08Å; I150-I237 HydrophobicContact CG1-CD1 4.24Å; I150-I237 HydrophobicContact CG1-CG2 4.44Å; I150-I237 HydrophobicContact CG2-CD1 4.41Å
151	Y	98.1	Very high	94.6	Very high	2 Å²	2	57.7 Å²	57.7	1%	0.008	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	130.8	174.6	-160.1	-82.8	0	0	0	110.3	M46 F153 D163 Y166 Y167 C170 F184 C185 L186	M46-Y151 HydrophobicContact CB-CD2 3.95Å; M46-Y151 HydrophobicContact CB-CE2 4.33Å; M46-Y151 CarbonylContact O-C 3.17Å; M46-Y151 WeakPolarHBondContact O-CA 3.47Å; Y151-F153 HydrophobicContact CD1-CD1 4.35Å; Y151-F153 AromaticContact CD1-CD2 3.94Å; Y151-F153 HydrophobicContact CD1-CD2 3.94Å; Y151-F153 AromaticContact CD1-CE1 3.91Å; Y151-F153 HydrophobicContact CD1-CE1 3.91Å; Y151-F153 AromaticContact CD1-CE2 3.44Å; Y151-F153 HydrophobicContact CD1-CE2 3.44Å; Y151-F153 VanDerWaalsContact CD1-CE2 3.44Å; Y151-F153 HydrophobicContact CD1-CG 4.37Å; Y151-F153 AromaticContact CD1-CZ 3.42Å; Y151-F153 HydrophobicContact CD1-CZ 3.42Å; Y151-F153 VanDerWaalsContact CD1-CZ 3.42Å; Y151-F153 HydrophobicContact CE1-CD1 4.07Å; Y151-F153 HydrophobicContact CE1-CD2 4.47Å; Y151-F153 AromaticContact CE1-CE1 3.56Å; Y151-F153 HydrophobicContact CE1-CE1 3.56Å; Y151-F153 HydrophobicContact CE1-CE2 4.01Å; Y151-F153 HydrophobicContact CE1-CG 4.5Å; Y151-F153 AromaticContact CE1-CZ 3.53Å; Y151-F153 HydrophobicContact CE1-CZ 3.53Å; Y151-F153 HydrophobicContact CG-CE2 4.4Å; Y151-F153 HydrophobicContact CG-CZ 4.48Å; Y151-D163 PolarHBondContact OH-O 3.07Å; Y151-Y166 WeakPolarHBondContact OH-CB 2.95Å; Y151-Y167 AromaticContact CD1-CD2 3.82Å; Y151-Y167 HydrophobicContact CD1-CD2 3.82Å; Y151-Y167 HydrophobicContact CD1-CG 4.42Å; Y151-Y167 AromaticContact CD2-CD2 3.83Å; Y151-Y167 HydrophobicContact CD2-CD2 3.83Å; Y151-Y167 HydrophobicContact CE1-CD2 4.2Å; Y151-Y167 HydrophobicContact CE1-CG 4.43Å; Y151-Y167 HydrophobicContact CE2-CD2 4.23Å; Y151-Y167 AromaticContact CG-CD2 3.59Å; Y151-Y167 HydrophobicContact CG-CD2 3.59Å; Y151-Y167 HydrophobicContact CG-CE2 4.19Å; Y151-Y167 PolarHBondContact OH-N 2.85Å; Y151-C170 HydrophobicContact CD2-CB 4.46Å; Y151-C170 HydrophobicContact CE2-CB 4.43Å; Y151-F184 PolarHBondContact N-O 3.34Å; Y151-C185 WeakPolarHBondContact O-CA 3.05Å; Y151-L186 PolarHBondContact O-N 3.04Å
152	V	98	Very high	94.9	Very high	1 Å²	1	56 Å²	56	1%	0.006	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	116	-171.7	-172.9	0	0	0	0	110.4	L45 M46 S51 K53 M56 I150 L186 H188	L45-V152 HydrophobicContact CD1-CG2 3.72Å; M46-V152 PolarHBondContact O-N 2.92Å; S51-V152 WeakPolarHBondContact O-CG1 3.28Å; K53-V152 HydrophobicContact CD-CB 4.39Å; K53-V152 HydrophobicContact CD-CG2 4.31Å; K53-V152 HydrophobicContact CG-CB 3.97Å; K53-V152 HydrophobicContact CG-CG1 4.44Å; K53-V152 HydrophobicContact CG-CG2 3.92Å; M56-V152 HydrophobicContact CE-CB 4.18Å; M56-V152 HydrophobicContact CE-CG1 3.46Å; M56-V152 VanDerWaalsContact CE-CG1 3.46Å; M56-V152 HydrophobicContact CE-CG2 3.58Å; I150-V152 HydrophobicContact CG2-CG2 4.41Å; V152-L186 HydrophobicContact CG2-CB 4.42Å; V152-L186 HydrophobicContact CG2-CD1 4.41Å; V152-H188 HydrophobicContact CG1-CB 3.82Å
153	F	97.6	Very high	94.9	Very high	18 Å²	18	56.3 Å²	56.3	8%	0.079	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	142.7	173.2	-64	-85.4	0	0	0	110.1	Y151 D163 M164 Y167 C185 L186 H188 L209	Y151-F153 HydrophobicContact CD1-CD1 4.35Å; Y151-F153 AromaticContact CD1-CD2 3.94Å; Y151-F153 HydrophobicContact CD1-CD2 3.94Å; Y151-F153 AromaticContact CD1-CE1 3.91Å; Y151-F153 HydrophobicContact CD1-CE1 3.91Å; Y151-F153 AromaticContact CD1-CE2 3.44Å; Y151-F153 HydrophobicContact CD1-CE2 3.44Å; Y151-F153 VanDerWaalsContact CD1-CE2 3.44Å; Y151-F153 HydrophobicContact CD1-CG 4.37Å; Y151-F153 AromaticContact CD1-CZ 3.42Å; Y151-F153 HydrophobicContact CD1-CZ 3.42Å; Y151-F153 VanDerWaalsContact CD1-CZ 3.42Å; Y151-F153 HydrophobicContact CE1-CD1 4.07Å; Y151-F153 HydrophobicContact CE1-CD2 4.47Å; Y151-F153 AromaticContact CE1-CE1 3.56Å; Y151-F153 HydrophobicContact CE1-CE1 3.56Å; Y151-F153 HydrophobicContact CE1-CE2 4.01Å; Y151-F153 HydrophobicContact CE1-CG 4.5Å; Y151-F153 AromaticContact CE1-CZ 3.53Å; Y151-F153 HydrophobicContact CE1-CZ 3.53Å; Y151-F153 HydrophobicContact CG-CE2 4.4Å; Y151-F153 HydrophobicContact CG-CZ 4.48Å; F153-D163 HydrophobicContact CD1-CB 4.41Å; F153-M164 HydrophobicContact CE1-CE 4.33Å; F153-M164 HydrophobicContact CE1-SD 3.92Å; F153-M164 HydrophobicContact CZ-SD 4.23Å; F153-Y167 HydrophobicContact CE1-CG 4.48Å; F153-Y167 HydrophobicContact CE2-CD2 4.4Å; F153-Y167 HydrophobicContact CE2-CG 4.46Å; F153-Y167 AromaticContact CZ-CD1 3.96Å; F153-Y167 HydrophobicContact CZ-CD1 3.96Å; F153-Y167 AromaticContact CZ-CD2 3.94Å; F153-Y167 HydrophobicContact CZ-CD2 3.94Å; F153-Y167 AromaticContact CZ-CG 3.62Å; F153-Y167 HydrophobicContact CZ-CG 3.62Å; F153-C185 HydrophobicContact CD2-CB 4.45Å; F153-C185 HydrophobicContact CE2-CB 4.13Å; F153-L186 PolarHBondContact N-O 3.13Å; F153-H188 WeakPolarHBondContact O-CB 3.48Å; F153-H188 PolarHBondContact O-N 2.84Å; F153-L209 HydrophobicContact CD2-CD1 4.12Å; F153-L209 HydrophobicContact CD2-CD2 4.29Å; F153-L209 HydrophobicContact CE1-CD2 4.15Å; F153-L209 HydrophobicContact CE2-CD1 3.93Å; F153-L209 HydrophobicContact CE2-CD2 3.4Å; F153-L209 VanDerWaalsContact CE2-CD2 3.4Å; F153-L209 HydrophobicContact CE2-CG 4.33Å; F153-L209 HydrophobicContact CZ-CD2 3.32Å
154	D	96.3	Very high	94.9	Very high	25 Å²	25	57.3 Å²	57.3	13%	0.134	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	121.9	173.4	-167.4	-22.8	0	0	0	109	E156 S157 K189	D154-E156 PolarHBondContact O-N 3.08Å; D154-E156 PolarHBondContact OD1-N 3.22Å; D154-S157 VanDerWaalsContact O-CB 3.27Å; D154-S157 WeakPolarHBondContact O-CB 3.47Å; D154-S157 PolarHBondContact O-N 3.35Å; D154-K189 WeakPolarHBondContact OD1-CD 3.3Å; D154-K189 IonicContact OD1-NZ 3.86Å; D154-K189 VanDerWaalsContact OD2-CE 3.31Å; D154-K189 WeakPolarHBondContact OD2-CE 3.46Å; D154-K189 IonicContact OD2-NZ 2.71Å; D154-K189 PolarHBondContact OD2-NZ 2.93Å
155	V	95.5	Very high	94.9	Very high	31 Å²	31	55.4 Å²	55.4	19%	0.188	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-22.2	-177.8	74.3	0	0	0	0	113.1	S157 V187 H188 K189 M190 V193 I201	V155-S157 VanDerWaalsContact C-N 3.32Å; V155-V187 HydrophobicContact CB-CG1 4.31Å; V155-V187 HydrophobicContact CG2-CG1 4.39Å; V155-H188 WeakPolarHBondContact CB-O 3.44Å; V155-H188 WeakPolarHBondContact CG1-O 3.43Å; V155-H188 PolarHBondContact N-O 3.15Å; V155-H188 VanDerWaalsContact N-O 3.14Å; V155-K189 HydrophobicContact CG1-CB 4.31Å; V155-K189 WeakPolarHBondContact CG1-O 3.25Å; V155-M190 HydrophobicContact CB-SD 3.96Å; V155-M190 HydrophobicContact CG1-SD 4.26Å; V155-M190 HydrophobicContact CG2-SD 3.67Å; V155-V193 HydrophobicContact CB-CG2 4.46Å; V155-V193 HydrophobicContact CG1-CG2 3.88Å; V155-V193 HydrophobicContact CG2-CG2 3.73Å; V155-I201 HydrophobicContact CG2-CG2 4.09Å
156	E	94.1	Very high	94.9	Very high	109 Å²	109	50.7 Å²	50.7	51%	0.509	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	4.1	174.4	-146.6	-153.6	138.1	0	0	113.2	D154 R158 L192	D154-E156 PolarHBondContact O-N 3.08Å; D154-E156 PolarHBondContact OD1-N 3.22Å; E156-R158 PolarHBondContact O-N 3.19Å; E156-R158 IonicContact OE1-NH2 3.7Å; E156-R158 PolarHBondContact OE1-NH2 3.04Å; E156-L192 HydrophobicContact CB-CD1 4.42Å
157	S	93.3	Very high	95	Very high	17 Å²	17	50.3 Å²	50.3	12%	0.119	23%	0.231	C	C	.	.			trans	-65.3	127.8	-177.2	-167.9	0	0	0	0	112.1	K48 D154 V155 L160 D163	K48-S157 PolarHBondContact NZ-OG 2.74Å; D154-S157 VanDerWaalsContact O-CB 3.27Å; D154-S157 WeakPolarHBondContact O-CB 3.47Å; D154-S157 PolarHBondContact O-N 3.35Å; V155-S157 VanDerWaalsContact C-N 3.32Å; S157-L160 WeakPolarHBondContact O-CG 3.43Å; S157-D163 WeakPolarHBondContact CB-OD2 3.46Å; S157-D163 PolarHBondContact OG-OD2 3.19Å
158	R	90.8	Very high	95	Very high	218 Å²	218	50.7 Å²	50.7	82%	0.823	23%	0.232	S	C	*	.	S	Bend	trans	-91.7	-7.5	179.9	-55.4	-177.5	-169.3	-175.9	2.9	113.4	E156	E156-R158 PolarHBondContact O-N 3.19Å; E156-R158 IonicContact OE1-NH2 3.7Å; E156-R158 PolarHBondContact OE1-NH2 3.04Å
159	E	92.9	Very high	94.9	Very high	100 Å²	100	51.7 Å²	51.7	47%	0.467	24%	0.239	S	C	.	.			trans	-114.5	48.5	-177.4	-53.2	174	115.8	0	0	110.5	K48 E161 K162 D163	K48-E159 VanDerWaalsContact CE-OE2 3.28Å; K48-E159 WeakPolarHBondContact CE-OE2 3.5Å; K48-E159 IonicContact NZ-OE2 2.81Å; K48-E159 PolarHBondContact NZ-OE2 2.93Å; E159-E161 PolarHBondContact O-N 2.89Å; E159-K162 HydrophobicContact CB-CB 4.1Å; E159-K162 WeakPolarHBondContact O-CB 3.41Å; E159-K162 PolarHBondContact O-N 3.39Å; E159-D163 PolarHBondContact O-N 2.9Å
160	L	90.1	Very high	94.8	Very high	64 Å²	64	51.7 Å²	51.7	34%	0.335	24%	0.239	S	C	.	.	H	α-helix	trans	-53.1	-40.1	-172.9	-64.3	165.8	0	0	0	113	S157 K162 D163 M164 R205	S157-L160 WeakPolarHBondContact O-CG 3.43Å; L160-K162 VanDerWaalsContact C-N 3.33Å; L160-K162 PolarHBondContact O-N 2.91Å; L160-D163 PolarHBondContact O-N 2.74Å; L160-M164 VanDerWaalsContact O-CG 3.29Å; L160-M164 WeakPolarHBondContact O-CG 3.44Å; L160-M164 PolarHBondContact O-N 3.05Å; L160-R205 VanDerWaalsContact CD1-NH2 3.3Å
161	E	92	Very high	94.7	Very high	179 Å²	179	52.3 Å²	52.3	84%	0.836	24%	0.243	S	C	*	.	H	α-helix	trans	-60.8	-40.5	177.7	-61.5	177.9	169	0	0	112.2	E159 H165	E159-E161 PolarHBondContact O-N 2.89Å; E161-H165 WeakPolarHBondContact O-CB 3.46Å; E161-H165 PolarHBondContact O-N 3.31Å
162	K	93.1	Very high	94.5	Very high	60 Å²	60	57.6 Å²	57.6	26%	0.261	27%	0.267	S	S	.	.	H	α-helix	trans	-69.5	-40.9	177.1	-164.5	-167.5	-169.8	-167.4	0	111.3	D128 E159 L160 M164 H165 Y166	D128-K162 IonicContact OD1-NZ 3.59Å; D128-K162 PolarHBondContact OD1-NZ 2.74Å; D128-K162 IonicContact OD2-NZ 2.69Å; D128-K162 PolarHBondContact OD2-NZ 2.65Å; E159-K162 HydrophobicContact CB-CB 4.1Å; E159-K162 WeakPolarHBondContact O-CB 3.41Å; E159-K162 PolarHBondContact O-N 3.39Å; L160-K162 VanDerWaalsContact C-N 3.33Å; L160-K162 PolarHBondContact O-N 2.91Å; K162-M164 VanDerWaalsContact C-N 3.32Å; K162-M164 PolarHBondContact O-N 3.37Å; K162-H165 PolarHBondContact O-N 3.33Å; K162-Y166 HydrophobicContact CD-CE2 4.13Å; K162-Y166 HydrophobicContact CG-CD2 4.25Å; K162-Y166 HydrophobicContact CG-CE2 3.91Å; K162-Y166 WeakPolarHBondContact O-CD2 3.43Å; K162-Y166 PolarHBondContact O-N 3.43Å
163	D	93.8	Very high	94.4	Very high	7 Å²	7	57.6 Å²	57.6	4%	0.037	27%	0.267	C	S	.	.	H	α-helix	trans	-65.6	-36.8	178.5	-64.2	-2	0	0	0	111.5	K48 Y151 F153 S157 E159 L160 Y167	K48-D163 WeakPolarHBondContact CD-OD1 3.33Å; K48-D163 IonicContact NZ-OD1 2.84Å; K48-D163 PolarHBondContact NZ-OD1 3.28Å; K48-D163 IonicContact NZ-OD2 2.69Å; Y151-D163 PolarHBondContact OH-O 3.07Å; F153-D163 HydrophobicContact CD1-CB 4.41Å; S157-D163 WeakPolarHBondContact CB-OD2 3.46Å; S157-D163 PolarHBondContact OG-OD2 3.19Å; E159-D163 PolarHBondContact O-N 2.9Å; L160-D163 PolarHBondContact O-N 2.74Å; D163-Y167 WeakPolarHBondContact O-CB 3.35Å; D163-Y167 PolarHBondContact O-N 3.39Å
164	M	94	Very high	94.3	Very high	21 Å²	21	56.7 Å²	56.7	10%	0.103	26%	0.263	C	S	.	.	H	α-helix	trans	-71.4	-40.7	172.7	-67.8	-60.1	-179.7	0	0	112.4	F153 L160 K162 Y166 Y167 Q168 L209 L212	F153-M164 HydrophobicContact CE1-CE 4.33Å; F153-M164 HydrophobicContact CE1-SD 3.92Å; F153-M164 HydrophobicContact CZ-SD 4.23Å; L160-M164 VanDerWaalsContact O-CG 3.29Å; L160-M164 WeakPolarHBondContact O-CG 3.44Å; L160-M164 PolarHBondContact O-N 3.05Å; K162-M164 VanDerWaalsContact C-N 3.32Å; K162-M164 PolarHBondContact O-N 3.37Å; M164-Y166 PolarHBondContact O-N 3.19Å; M164-Y167 WeakPolarHBondContact O-CB 3.45Å; M164-Y167 PolarHBondContact O-N 3.27Å; M164-Y167 VanDerWaalsContact O-N 3.11Å; M164-Q168 WeakPolarHBondContact O-CG 3.1Å; M164-Q168 PolarHBondContact O-N 3.32Å; M164-L209 HydrophobicContact CE-CD2 3.85Å; M164-L209 HydrophobicContact CE-CG 4.29Å; M164-L209 HydrophobicContact SD-CD2 3.77Å; M164-L212 HydrophobicContact CB-CD1 4.29Å; M164-L212 HydrophobicContact CE-CD1 4.46Å; M164-L212 HydrophobicContact CG-CD1 4.05Å; M164-L212 HydrophobicContact SD-CD1 3.62Å
165	H	94.3	Very high	94.2	Very high	114 Å²	114	59 Å²	59	53%	0.528	28%	0.275	S	S	.	.	H	α-helix	trans	-59.7	-45.5	174.7	179	-82	0	0	0	112	E161 K162 Y167 Q168 S169	E161-H165 WeakPolarHBondContact O-CB 3.46Å; E161-H165 PolarHBondContact O-N 3.31Å; K162-H165 PolarHBondContact O-N 3.33Å; H165-Y167 VanDerWaalsContact C-N 3.32Å; H165-Y167 PolarHBondContact O-N 2.85Å; H165-Q168 PolarHBondContact O-N 2.84Å; H165-S169 WeakPolarHBondContact O-CB 3.49Å; H165-S169 PolarHBondContact O-N 3.14Å; H165-S169 PolarHBondContact O-OG 3.24Å
166	Y	95	Very high	94.1	Very high	20 Å²	20	63.3 Å²	63.3	8%	0.078	29%	0.293	C	S	.	.	H	α-helix	trans	-65.6	-33.1	173.4	-73	-41.6	0	0	0	112.7	D128 M131 F135 Y151 K162 M164 S169 C170	D128-Y166 WeakPolarHBondContact CB-OH 3.31Å; D128-Y166 PolarHBondContact OD1-OH 2.7Å; M131-Y166 HydrophobicContact CB-CD1 4.28Å; M131-Y166 HydrophobicContact CB-CE1 4.05Å; M131-Y166 HydrophobicContact CE-CD1 4.48Å; M131-Y166 HydrophobicContact CE-CG 4.14Å; F135-Y166 AromaticContact CE2-CD1 3.81Å; F135-Y166 HydrophobicContact CE2-CD1 3.81Å; F135-Y166 HydrophobicContact CE2-CE1 4.47Å; Y151-Y166 WeakPolarHBondContact OH-CB 2.95Å; K162-Y166 HydrophobicContact CD-CE2 4.13Å; K162-Y166 HydrophobicContact CG-CD2 4.25Å; K162-Y166 HydrophobicContact CG-CE2 3.91Å; K162-Y166 WeakPolarHBondContact O-CD2 3.43Å; K162-Y166 PolarHBondContact O-N 3.43Å; M164-Y166 PolarHBondContact O-N 3.19Å; Y166-S169 PolarHBondContact O-N 3.05Å; Y166-C170 PolarHBondContact O-N 3.04Å
167	Y	96.9	Very high	94.2	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-65.5	-47.4	173.8	176.8	-121.6	0	0	0	111.8	Y151 F153 D163 M164 H165 S169 C170 L171 I183 C185 L209 S213	Y151-Y167 AromaticContact CD1-CD2 3.82Å; Y151-Y167 HydrophobicContact CD1-CD2 3.82Å; Y151-Y167 HydrophobicContact CD1-CG 4.42Å; Y151-Y167 AromaticContact CD2-CD2 3.83Å; Y151-Y167 HydrophobicContact CD2-CD2 3.83Å; Y151-Y167 HydrophobicContact CE1-CD2 4.2Å; Y151-Y167 HydrophobicContact CE1-CG 4.43Å; Y151-Y167 HydrophobicContact CE2-CD2 4.23Å; Y151-Y167 AromaticContact CG-CD2 3.59Å; Y151-Y167 HydrophobicContact CG-CD2 3.59Å; Y151-Y167 HydrophobicContact CG-CE2 4.19Å; Y151-Y167 PolarHBondContact OH-N 2.85Å; F153-Y167 HydrophobicContact CE1-CG 4.48Å; F153-Y167 HydrophobicContact CE2-CD2 4.4Å; F153-Y167 HydrophobicContact CE2-CG 4.46Å; F153-Y167 AromaticContact CZ-CD1 3.96Å; F153-Y167 HydrophobicContact CZ-CD1 3.96Å; F153-Y167 AromaticContact CZ-CD2 3.94Å; F153-Y167 HydrophobicContact CZ-CD2 3.94Å; F153-Y167 AromaticContact CZ-CG 3.62Å; F153-Y167 HydrophobicContact CZ-CG 3.62Å; D163-Y167 WeakPolarHBondContact O-CB 3.35Å; D163-Y167 PolarHBondContact O-N 3.39Å; M164-Y167 WeakPolarHBondContact O-CB 3.45Å; M164-Y167 PolarHBondContact O-N 3.27Å; M164-Y167 VanDerWaalsContact O-N 3.11Å; H165-Y167 VanDerWaalsContact C-N 3.32Å; H165-Y167 PolarHBondContact O-N 2.85Å; Y167-S169 VanDerWaalsContact C-N 3.3Å; Y167-S169 PolarHBondContact O-N 2.62Å; Y167-C170 WeakPolarHBondContact O-CB 3.48Å; Y167-C170 PolarHBondContact O-N 2.99Å; Y167-C170 VanDerWaalsContact O-N 3.13Å; Y167-L171 HydrophobicContact CD1-CD1 3.95Å; Y167-L171 HydrophobicContact CD2-CG 4.44Å; Y167-L171 HydrophobicContact CE1-CD1 3.5Å; Y167-L171 VanDerWaalsContact CE1-CD1 3.5Å; Y167-L171 HydrophobicContact CE1-CG 4.25Å; Y167-L171 HydrophobicContact CE2-CD1 4.21Å; Y167-L171 HydrophobicContact CE2-CD2 4.09Å; Y167-L171 HydrophobicContact CE2-CG 4.06Å; Y167-L171 HydrophobicContact CG-CD1 4.46Å; Y167-L171 WeakPolarHBondContact O-CG 3.46Å; Y167-L171 PolarHBondContact O-N 3.44Å; Y167-I183 HydrophobicContact CE2-CG2 4.41Å; Y167-I183 WeakPolarHBondContact OH-CG2 3.49Å; Y167-C185 PolarHBondContact OH-SG 3.1Å; Y167-L209 HydrophobicContact CD1-CD2 3.95Å; Y167-L209 HydrophobicContact CE1-CD2 3.8Å; Y167-S213 PolarHBondContact OH-OG 2.87Å
168	Q	95.6	Very high	94.3	Very high	79 Å²	79	60 Å²	60	37%	0.369	28%	0.278	S	S	.	.	H	α-helix	trans	-60.3	-40.2	174.7	-68.6	178.8	-72.9	0	0	111.7	M164 H165 C170 L171 E172	M164-Q168 WeakPolarHBondContact O-CG 3.1Å; M164-Q168 PolarHBondContact O-N 3.32Å; H165-Q168 PolarHBondContact O-N 2.84Å; Q168-C170 VanDerWaalsContact C-N 3.31Å; Q168-C170 PolarHBondContact O-N 3.44Å; Q168-L171 WeakPolarHBondContact O-CB 3.47Å; Q168-L171 PolarHBondContact O-N 3.43Å; Q168-L171 VanDerWaalsContact O-N 3.08Å; Q168-E172 PolarHBondContact O-N 3.18Å
169	S	94.9	Very high	94.4	Very high	21 Å²	21	52.9 Å²	52.9	15%	0.147	26%	0.261	C	S	.	.	H	α-helix	trans	-59.5	-39.2	174.4	-58.4	0	0	0	0	112.5	F135 H165 Y166 Y167 A173	F135-S169 VanDerWaalsContact CE1-C 3.45Å; H165-S169 WeakPolarHBondContact O-CB 3.49Å; H165-S169 PolarHBondContact O-N 3.14Å; H165-S169 PolarHBondContact O-OG 3.24Å; Y166-S169 PolarHBondContact O-N 3.05Å; Y167-S169 VanDerWaalsContact C-N 3.3Å; Y167-S169 PolarHBondContact O-N 2.62Å; S169-A173 WeakPolarHBondContact O-CB 3.47Å; S169-A173 PolarHBondContact O-N 3.34Å
170	C	95.8	Very high	94.5	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-66.2	-42.1	171.5	-76.6	0	0	0	0	112.5	M46 F135 F143 L149 Y151 Y166 Y167 Q168 A173 I174	M46-C170 VanDerWaalsContact SD-SG 3.68Å; F135-C170 HydrophobicContact CE1-CB 4.35Å; F135-C170 VanDerWaalsContact CE1-SG 3.59Å; F135-C170 VanDerWaalsContact CZ-SG 3.56Å; F143-C170 HydrophobicContact CE1-CB 4.26Å; L149-C170 HydrophobicContact CD2-CB 4.15Å; Y151-C170 HydrophobicContact CD2-CB 4.46Å; Y151-C170 HydrophobicContact CE2-CB 4.43Å; Y166-C170 PolarHBondContact O-N 3.04Å; Y167-C170 WeakPolarHBondContact O-CB 3.48Å; Y167-C170 PolarHBondContact O-N 2.99Å; Y167-C170 VanDerWaalsContact O-N 3.13Å; Q168-C170 VanDerWaalsContact C-N 3.31Å; Q168-C170 PolarHBondContact O-N 3.44Å; C170-A173 PolarHBondContact O-N 2.96Å; C170-I174 WeakPolarHBondContact O-CB 3.47Å; C170-I174 WeakPolarHBondContact O-CG1 3.17Å; C170-I174 PolarHBondContact O-N 3.31Å
171	L	95.9	Very high	94.8	Very high	13 Å²	13	52.7 Å²	52.7	7%	0.068	26%	0.264	C	S	.	.	H	α-helix	trans	-64.2	-43.1	179.9	-69.3	172.1	0	0	0	112.3	Y167 Q168 A173 I174 L175 I183 L216	Y167-L171 HydrophobicContact CD1-CD1 3.95Å; Y167-L171 HydrophobicContact CD2-CG 4.44Å; Y167-L171 HydrophobicContact CE1-CD1 3.5Å; Y167-L171 VanDerWaalsContact CE1-CD1 3.5Å; Y167-L171 HydrophobicContact CE1-CG 4.25Å; Y167-L171 HydrophobicContact CE2-CD1 4.21Å; Y167-L171 HydrophobicContact CE2-CD2 4.09Å; Y167-L171 HydrophobicContact CE2-CG 4.06Å; Y167-L171 HydrophobicContact CG-CD1 4.46Å; Y167-L171 WeakPolarHBondContact O-CG 3.46Å; Y167-L171 PolarHBondContact O-N 3.44Å; Q168-L171 WeakPolarHBondContact O-CB 3.47Å; Q168-L171 PolarHBondContact O-N 3.43Å; Q168-L171 VanDerWaalsContact O-N 3.08Å; L171-A173 VanDerWaalsContact C-N 3.34Å; L171-A173 PolarHBondContact O-N 2.65Å; L171-I174 PolarHBondContact O-N 2.96Å; L171-L175 VanDerWaalsContact O-CB 3.29Å; L171-L175 WeakPolarHBondContact O-CB 3.17Å; L171-L175 PolarHBondContact O-N 2.97Å; L171-I183 HydrophobicContact CD2-CD1 3.44Å; L171-I183 VanDerWaalsContact CD2-CD1 3.44Å; L171-I183 HydrophobicContact CD2-CG1 4.2Å; L171-I183 HydrophobicContact CD2-CG2 4.34Å; L171-L216 HydrophobicContact CD2-CD1 4.4Å
172	E	94.6	Very high	95	Very high	113 Å²	113	48.1 Å²	48.1	53%	0.528	24%	0.241	S	C	.	.	H	α-helix	trans	-61.3	-43	174.3	-71.6	-178.6	-172.7	0	0	111.8	Q168 L175 Q176	Q168-E172 PolarHBondContact O-N 3.18Å; E172-L175 PolarHBondContact O-N 3.22Å; E172-Q176 WeakPolarHBondContact O-CB 3.36Å; E172-Q176 VanDerWaalsContact O-CD 3.3Å; E172-Q176 WeakPolarHBondContact O-CG 3.39Å; E172-Q176 PolarHBondContact O-N 2.86Å; E172-Q176 VanDerWaalsContact O-N 3.13Å
173	A	95.3	Very high	95.2	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-67	-37.6	178.7	0	0	0	0	0	112.3	R139 F143 S169 C170 L171 N177	R139-A173 HydrophobicContact CG-CB 4.32Å; F143-A173 HydrophobicContact CB-CB 4.15Å; F143-A173 HydrophobicContact CD1-CB 3.87Å; F143-A173 HydrophobicContact CD2-CB 3.46Å; F143-A173 VanDerWaalsContact CD2-CB 3.46Å; F143-A173 HydrophobicContact CE1-CB 4.11Å; F143-A173 HydrophobicContact CE2-CB 3.73Å; F143-A173 HydrophobicContact CG-CB 3.54Å; F143-A173 HydrophobicContact CZ-CB 4.04Å; S169-A173 WeakPolarHBondContact O-CB 3.47Å; S169-A173 PolarHBondContact O-N 3.34Å; C170-A173 PolarHBondContact O-N 2.96Å; L171-A173 VanDerWaalsContact C-N 3.34Å; L171-A173 PolarHBondContact O-N 2.65Å; A173-N177 WeakPolarHBondContact O-CB 3.42Å; A173-N177 PolarHBondContact O-N 3.46Å; A173-N177 PolarHBondContact O-ND2 2.87Å
174	I	96.1	Very high	95.4	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-65	-50.9	171.7	-74.4	-67.9	0	0	0	111.2	L44 F143 V146 L149 C170 L171 Q176 N177 S178 A181 L216	L44-I174 HydrophobicContact CD1-CD1 4.45Å; F143-I174 HydrophobicContact CD1-CD1 3.86Å; F143-I174 HydrophobicContact CD1-CG1 3.93Å; F143-I174 HydrophobicContact CE1-CG1 4.48Å; V146-I174 HydrophobicContact CB-CD1 3.9Å; V146-I174 HydrophobicContact CG1-CD1 3.82Å; V146-I174 HydrophobicContact CG2-CD1 4.08Å; L149-I174 HydrophobicContact CB-CD1 4.47Å; L149-I174 HydrophobicContact CD2-CG1 3.99Å; C170-I174 WeakPolarHBondContact O-CB 3.47Å; C170-I174 WeakPolarHBondContact O-CG1 3.17Å; C170-I174 PolarHBondContact O-N 3.31Å; L171-I174 PolarHBondContact O-N 2.96Å; I174-Q176 PolarHBondContact O-N 3.29Å; I174-Q176 VanDerWaalsContact O-N 3.13Å; I174-N177 PolarHBondContact O-N 3.35Å; I174-S178 WeakPolarHBondContact CG2-O 3.38Å; I174-S178 CarbonylContact O-C 3.18Å; I174-S178 WeakPolarHBondContact O-CA 3.25Å; I174-S178 PolarHBondContact O-N 3.47Å; I174-A181 HydrophobicContact CD1-CB 4.35Å; I174-A181 HydrophobicContact CG2-CB 3.92Å; I174-L216 HydrophobicContact CG2-CD1 4.11Å
175	L	94.9	Very high	95.6	Very high	72 Å²	72	44.2 Å²	44.2	38%	0.377	22%	0.224	S	C	.	.	H	α-helix	trans	-57.3	-32	-178.7	-174.9	62.8	0	0	0	112.3	L171 E172 P215 L216	L171-L175 VanDerWaalsContact O-CB 3.29Å; L171-L175 WeakPolarHBondContact O-CB 3.17Å; L171-L175 PolarHBondContact O-N 2.97Å; E172-L175 PolarHBondContact O-N 3.22Å; L175-P215 HydrophobicContact CD1-CG 4.28Å; L175-P215 HydrophobicContact CD2-CG 4.03Å; L175-L216 HydrophobicContact CB-CD1 4.21Å; L175-L216 HydrophobicContact CD1-CD1 4.3Å; L175-L216 HydrophobicContact CD1-CD2 3.92Å; L175-L216 HydrophobicContact CD1-CG 4.16Å
176	Q	93.7	Very high	95.8	Very high	123 Å²	123	38.8 Å²	38.8	58%	0.575	20%	0.199	S	C	*	.	H	α-helix	trans	-80.3	-31.3	176.7	-70.2	164.8	-1.6	0	0	114.3	E172 I174	E172-Q176 WeakPolarHBondContact O-CB 3.36Å; E172-Q176 VanDerWaalsContact O-CD 3.3Å; E172-Q176 WeakPolarHBondContact O-CG 3.39Å; E172-Q176 PolarHBondContact O-N 2.86Å; E172-Q176 VanDerWaalsContact O-N 3.13Å; I174-Q176 PolarHBondContact O-N 3.29Å; I174-Q176 VanDerWaalsContact O-N 3.13Å
177	N	94.7	Very high	96	Very high	44 Å²	44	38 Å²	38	24%	0.235	20%	0.196	C	C	.	.	H	α-helix	trans	-117.8	-18.5	-167.2	-72.7	-85.4	0	0	0	115.6	F143 A173 I174	F143-N177 HydrophobicContact CB-CB 4.03Å; F143-N177 VanDerWaalsContact O-CB 3.27Å; F143-N177 WeakPolarHBondContact O-CB 3.43Å; A173-N177 WeakPolarHBondContact O-CB 3.42Å; A173-N177 PolarHBondContact O-N 3.46Å; A173-N177 PolarHBondContact O-ND2 2.87Å; I174-N177 PolarHBondContact O-N 3.35Å
178	S	96.1	Very high	96	Very high	11 Å²	11	38.2 Å²	38.2	8%	0.077	20%	0.197	C	C	.	.			trans	-161.2	67.5	-178.7	-68	0	0	0	0	109.6	F143 N145 V146 I174 D180 A181	F143-S178 PolarHBondContact O-OG 3.48Å; F143-S178 VanDerWaalsContact O-OG 3.09Å; N145-S178 PolarHBondContact N-OG 2.82Å; V146-S178 PolarHBondContact N-OG 3.44Å; I174-S178 WeakPolarHBondContact CG2-O 3.38Å; I174-S178 CarbonylContact O-C 3.18Å; I174-S178 WeakPolarHBondContact O-CA 3.25Å; I174-S178 PolarHBondContact O-N 3.47Å; S178-D180 PolarHBondContact O-N 2.96Å; S178-A181 WeakPolarHBondContact O-CB 3.39Å; S178-A181 PolarHBondContact O-N 2.79Å
179	P	93.7	Very high	96.1	Very high	69 Å²	69	37 Å²	37	45%	0.448	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-25.6	-174.3	25.9	-35.6	0	0	0	113.7	A181	P179-A181 PolarHBondContact O-N 2.82Å
180	D	94.2	Very high	96.2	Very high	153 Å²	153	36.2 Å²	36.2	82%	0.818	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.6	1.1	176.3	-50.4	-70	0	0	0	113.7	S178 K182	S178-D180 PolarHBondContact O-N 2.96Å; D180-K182 PolarHBondContact O-N 3.49Å
181	A	96.1	Very high	96.2	Very high	7 Å²	7	38.5 Å²	38.5	6%	0.058	20%	0.197	C	C	.	.			trans	-70	129.4	-177.5	0	0	0	0	0	112	V146 I174 S178 P179	V146-A181 HydrophobicContact CB-CB 4.34Å; V146-A181 HydrophobicContact CG1-CB 4.14Å; V146-A181 WeakPolarHBondContact O-CB 3.43Å; I174-A181 HydrophobicContact CD1-CB 4.35Å; I174-A181 HydrophobicContact CG2-CB 3.92Å; S178-A181 WeakPolarHBondContact O-CB 3.39Å; S178-A181 PolarHBondContact O-N 2.79Å; P179-A181 PolarHBondContact O-N 2.82Å
182	K	96.3	Very high	96.2	Very high	83 Å²	83	42.5 Å²	42.5	36%	0.361	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	128.6	-179.6	-61.6	175.2	171.4	-163	0	110.9	E147 V148 L149 D180 F184 Q240	E147-K182 PolarHBondContact O-N 3.11Å; V148-K182 CarbonylContact C-O 3.58Å; V148-K182 VanDerWaalsContact CA-O 3.3Å; V148-K182 WeakPolarHBondContact CA-O 3.31Å; V148-K182 HydrophobicContact CG2-CB 4.19Å; L149-K182 PolarHBondContact N-O 2.74Å; D180-K182 PolarHBondContact O-N 3.49Å; K182-F184 HydrophobicContact CB-CE2 3.97Å; K182-Q240 HydrophobicContact CD-CB 4.23Å; K182-Q240 PolarHBondContact NZ-O 3.47Å; K182-Q240 VanDerWaalsContact NZ-OE1 3.08Å
183	I	97.8	Very high	96.2	Very high	4 Å²	4	38 Å²	38	2%	0.021	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	128.8	-175.7	-68.3	149.1	0	0	0	111.1	L149 Y167 L171 L216 C218 S219	L149-I183 HydrophobicContact CB-CG1 4.3Å; Y167-I183 HydrophobicContact CE2-CG2 4.41Å; Y167-I183 WeakPolarHBondContact OH-CG2 3.49Å; L171-I183 HydrophobicContact CD2-CD1 3.44Å; L171-I183 VanDerWaalsContact CD2-CD1 3.44Å; L171-I183 HydrophobicContact CD2-CG1 4.2Å; L171-I183 HydrophobicContact CD2-CG2 4.34Å; I183-L216 HydrophobicContact CD1-CB 3.69Å; I183-L216 HydrophobicContact CD1-CD1 3.54Å; I183-L216 HydrophobicContact CD1-CG 4.2Å; I183-C218 HydrophobicContact CB-CB 4.42Å; I183-C218 HydrophobicContact CG2-CB 3.85Å; I183-C218 WeakPolarHBondContact O-CA 3.27Å; I183-S219 PolarHBondContact O-N 3.3Å
184	F	98.3	Very high	96.2	Very high	2 Å²	2	44.2 Å²	44.2	1%	0.009	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	132.2	173.8	-62.5	-91.4	0	0	0	110.5	V148 L149 I150 Y151 K182 S219 F221 I237 Q240	V148-F184 HydrophobicContact CG1-CD2 3.75Å; V148-F184 HydrophobicContact CG1-CE2 3.99Å; V148-F184 HydrophobicContact CG2-CE2 4.17Å; L149-F184 PolarHBondContact O-N 2.77Å; I150-F184 WeakPolarHBondContact CA-O 3.34Å; Y151-F184 PolarHBondContact N-O 3.34Å; K182-F184 HydrophobicContact CB-CE2 3.97Å; F184-S219 CarbonylContact C-O 3.59Å; F184-S219 VanDerWaalsContact CA-O 3.28Å; F184-S219 WeakPolarHBondContact CA-O 3.43Å; F184-F221 HydrophobicContact CD1-CD2 4.38Å; F184-F221 AromaticContact CD1-CE2 3.74Å; F184-F221 HydrophobicContact CD1-CE2 3.74Å; F184-F221 HydrophobicContact CE1-CE2 4.12Å; F184-I237 HydrophobicContact CB-CD1 4.22Å; F184-I237 HydrophobicContact CB-CG1 4.21Å; F184-I237 HydrophobicContact CD1-CD1 4.4Å; F184-I237 HydrophobicContact CD1-CG1 3.6Å; F184-I237 HydrophobicContact CD2-CG1 3.9Å; F184-I237 HydrophobicContact CD2-CG2 4.45Å; F184-I237 HydrophobicContact CE1-CG1 3.8Å; F184-I237 HydrophobicContact CE2-CB 4.46Å; F184-I237 HydrophobicContact CE2-CG1 4.08Å; F184-I237 HydrophobicContact CE2-CG2 4.31Å; F184-I237 HydrophobicContact CG-CD1 4.19Å; F184-I237 HydrophobicContact CG-CG1 3.64Å; F184-I237 HydrophobicContact CZ-CB 4.42Å; F184-I237 HydrophobicContact CZ-CG1 4.02Å; F184-Q240 HydrophobicContact CZ-CB 4.33Å; F184-Q240 HydrophobicContact CZ-CG 4.39Å
185	C	98.1	Very high	96.1	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	115.1	177.5	-57.1	0	0	0	0	109.4	Y151 F153 Y167 L209 S219 C220 F221	Y151-C185 WeakPolarHBondContact O-CA 3.05Å; F153-C185 HydrophobicContact CD2-CB 4.45Å; F153-C185 HydrophobicContact CE2-CB 4.13Å; Y167-C185 PolarHBondContact OH-SG 3.1Å; C185-L209 HydrophobicContact CB-CD1 3.83Å; C185-S219 PolarHBondContact N-O 3.28Å; C185-C220 CarbonylContact O-C 3.57Å; C185-C220 WeakPolarHBondContact O-CA 3.37Å; C185-F221 PolarHBondContact O-N 3.01Å
186	L	98.4	Very high	96.2	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	109.4	177.2	-55.3	-172.8	0	0	0	109.1	M56 I150 Y151 V152 F153 H188 F221 T223 A233 I237	M56-L186 HydrophobicContact CE-CD1 4.05Å; M56-L186 HydrophobicContact SD-CD1 3.9Å; I150-L186 HydrophobicContact CG2-CD1 3.56Å; I150-L186 HydrophobicContact CG2-CG 3.77Å; Y151-L186 PolarHBondContact O-N 3.04Å; V152-L186 HydrophobicContact CG2-CB 4.42Å; V152-L186 HydrophobicContact CG2-CD1 4.41Å; F153-L186 PolarHBondContact N-O 3.13Å; L186-H188 PolarHBondContact O-N 2.87Å; L186-F221 WeakPolarHBondContact CA-O 3.37Å; L186-F221 HydrophobicContact CD2-CB 3.86Å; L186-F221 HydrophobicContact CD2-CD2 3.96Å; L186-F221 HydrophobicContact CD2-CG 4.41Å; L186-T223 HydrophobicContact CD2-CG2 4.14Å; L186-A233 HydrophobicContact CD2-CB 3.96Å; L186-I237 HydrophobicContact CD2-CD1 4.42Å
187	V	98.1	Very high	96.2	Very high	4 Å²	4	52 Å²	52	2%	0.024	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	103.3	166.5	-174.2	0	0	0	0	106.4	V155 M190 F202 R205 L209 F221 R222 T223	V155-V187 HydrophobicContact CB-CG1 4.31Å; V155-V187 HydrophobicContact CG2-CG1 4.39Å; V187-M190 HydrophobicContact CG1-CG 4.34Å; V187-M190 HydrophobicContact CG1-SD 3.72Å; V187-M190 WeakPolarHBondContact O-CG 3.48Å; V187-F202 HydrophobicContact CB-CD2 4.34Å; V187-F202 HydrophobicContact CG2-CD2 4.21Å; V187-F202 HydrophobicContact CG2-CE2 4.29Å; V187-R205 HydrophobicContact CG2-CB 4.17Å; V187-L209 HydrophobicContact CG2-CD1 4.4Å; V187-F221 PolarHBondContact N-O 2.93Å; V187-R222 CarbonylContact O-C 3.5Å; V187-R222 WeakPolarHBondContact O-CA 3.38Å; V187-T223 PolarHBondContact O-N 2.91Å; V187-T223 PolarHBondContact O-OG1 3.07Å
188	H	97.9	Very high	96.3	Very high	4 Å²	4	52.9 Å²	52.9	2%	0.019	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	164.9	-167.5	-160.8	62.1	0	0	0	112.9	S51 M56 V152 F153 V155 L186 M190 T223	S51-H188 PolarHBondContact O-CD2 3.3Å; M56-H188 PolarHBondContact SD-CE1 2.94Å; M56-H188 PolarHBondContact SD-ND1 3.07Å; M56-H188 VanDerWaalsContact SD-ND1 3.43Å; V152-H188 HydrophobicContact CG1-CB 3.82Å; F153-H188 WeakPolarHBondContact O-CB 3.48Å; F153-H188 PolarHBondContact O-N 2.84Å; V155-H188 WeakPolarHBondContact CB-O 3.44Å; V155-H188 WeakPolarHBondContact CG1-O 3.43Å; V155-H188 PolarHBondContact N-O 3.15Å; V155-H188 VanDerWaalsContact N-O 3.14Å; L186-H188 PolarHBondContact O-N 2.87Å; H188-M190 VanDerWaalsContact C-N 3.32Å; H188-T223 CarbonylContact C-O 3.57Å; H188-T223 WeakPolarHBondContact CA-O 3.27Å; H188-T223 PolarHBondContact ND1-O 3.16Å; H188-T223 PolarHBondContact ND1-OG1 3.11Å
189	K	97.1	Very high	96.2	Very high	53 Å²	53	56.1 Å²	56.1	23%	0.23	28%	0.282	C	S	.	.			trans	62.1	31.3	-174.6	-48.4	-173.1	-168.7	163.7	0	114.6	G50 D154 V155 D191 L192 T223	G50-K189 WeakPolarHBondContact O-CE 3.39Å; G50-K189 PolarHBondContact O-NZ 3.25Å; D154-K189 WeakPolarHBondContact OD1-CD 3.3Å; D154-K189 IonicContact OD1-NZ 3.86Å; D154-K189 VanDerWaalsContact OD2-CE 3.31Å; D154-K189 WeakPolarHBondContact OD2-CE 3.46Å; D154-K189 IonicContact OD2-NZ 2.71Å; D154-K189 PolarHBondContact OD2-NZ 2.93Å; V155-K189 HydrophobicContact CG1-CB 4.31Å; V155-K189 WeakPolarHBondContact CG1-O 3.25Å; K189-D191 VanDerWaalsContact CA-OD1 3.25Å; K189-D191 WeakPolarHBondContact CA-OD1 3.49Å; K189-D191 PolarHBondContact O-N 2.9Å; K189-L192 HydrophobicContact CB-CD1 3.84Å; K189-L192 HydrophobicContact CB-CG 4.17Å; K189-L192 HydrophobicContact CD-CD1 4.02Å; K189-L192 WeakPolarHBondContact O-CB 3.42Å; K189-L192 WeakPolarHBondContact O-CG 3.49Å; K189-L192 PolarHBondContact O-N 2.84Å; K189-T223 PolarHBondContact N-O 2.51Å; K189-T223 VanDerWaalsContact N-O 3.11Å
190	M	96.9	Very high	96.4	Very high	6 Å²	6	58.6 Å²	58.6	3%	0.03	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-64.1	-10.7	-179.3	-69.9	-68.1	-57.5	0	0	114	V155 V187 H188 L192 V193 R198 R222 T223	V155-M190 HydrophobicContact CB-SD 3.96Å; V155-M190 HydrophobicContact CG1-SD 4.26Å; V155-M190 HydrophobicContact CG2-SD 3.67Å; V187-M190 HydrophobicContact CG1-CG 4.34Å; V187-M190 HydrophobicContact CG1-SD 3.72Å; V187-M190 WeakPolarHBondContact O-CG 3.48Å; H188-M190 VanDerWaalsContact C-N 3.32Å; M190-L192 PolarHBondContact O-N 2.62Å; M190-V193 HydrophobicContact CE-CB 4.36Å; M190-V193 HydrophobicContact CE-CG1 4.48Å; M190-V193 HydrophobicContact CE-CG2 4.34Å; M190-V193 PolarHBondContact O-N 3.38Å; M190-V193 HydrophobicContact SD-CG2 4.34Å; M190-R198 HydrophobicContact CE-CB 3.98Å; M190-R198 HydrophobicContact CE-CG 4.07Å; M190-R198 PolarHBondContact O-NE 3.37Å; M190-R222 HydrophobicContact CG-CB 3.9Å; M190-T223 PolarHBondContact N-O 2.93Å
191	D	96	Very high	96.5	Very high	47 Å²	47	53.3 Å²	53.3	25%	0.251	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-57.9	-31.2	165.2	48.4	-69.8	0	0	0	113.7	K189 V193 R198 S224 W226	K189-D191 VanDerWaalsContact CA-OD1 3.25Å; K189-D191 WeakPolarHBondContact CA-OD1 3.49Å; K189-D191 PolarHBondContact O-N 2.9Å; D191-V193 PolarHBondContact O-N 2.95Å; D191-R198 PolarHBondContact O-NH2 2.9Å; D191-S224 WeakPolarHBondContact CB-OG 3.3Å; D191-S224 VanDerWaalsContact OD1-CB 3.31Å; D191-S224 WeakPolarHBondContact OD1-CB 3.37Å; D191-S224 PolarHBondContact OD1-OG 2.83Å; D191-W226 VanDerWaalsContact CG-CD1 3.46Å; D191-W226 PolarHBondContact OD2-NE1 3.44Å
192	L	95.8	Very high	96.5	Very high	97 Å²	97	54.1 Å²	54.1	51%	0.508	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-73.2	-14.7	178.3	-57	179.2	0	0	0	113.1	E156 K189 M190	E156-L192 HydrophobicContact CB-CD1 4.42Å; K189-L192 HydrophobicContact CB-CD1 3.84Å; K189-L192 HydrophobicContact CB-CG 4.17Å; K189-L192 HydrophobicContact CD-CD1 4.02Å; K189-L192 WeakPolarHBondContact O-CB 3.42Å; K189-L192 WeakPolarHBondContact O-CG 3.49Å; K189-L192 PolarHBondContact O-N 2.84Å; M190-L192 PolarHBondContact O-N 2.62Å
193	V	95.9	Very high	96.6	Very high	19 Å²	19	56.2 Å²	56.2	12%	0.115	27%	0.273	C	S	.	.	S	Bend	trans	-93.4	140.3	178.2	178	0	0	0	0	109.9	V155 M190 D191 Q197 R198 I201	V155-V193 HydrophobicContact CB-CG2 4.46Å; V155-V193 HydrophobicContact CG1-CG2 3.88Å; V155-V193 HydrophobicContact CG2-CG2 3.73Å; M190-V193 HydrophobicContact CE-CB 4.36Å; M190-V193 HydrophobicContact CE-CG1 4.48Å; M190-V193 HydrophobicContact CE-CG2 4.34Å; M190-V193 PolarHBondContact O-N 3.38Å; M190-V193 HydrophobicContact SD-CG2 4.34Å; D191-V193 PolarHBondContact O-N 2.95Å; V193-Q197 HydrophobicContact CG1-CB 3.96Å; V193-R198 HydrophobicContact CB-CG 4.03Å; V193-R198 HydrophobicContact CG1-CG 3.86Å; V193-R198 PolarHBondContact O-NE 2.93Å; V193-R198 PolarHBondContact O-NH2 2.85Å; V193-I201 HydrophobicContact CG1-CD1 3.89Å
194	Q	95.3	Very high	96.5	Very high	131 Å²	131	61 Å²	61	61%	0.612	30%	0.295	S	S	*	.			trans	-64.4	139.2	175.5	-58.8	-174.3	14.4	0	0	110.5	D196 Q197 R198	Q194-D196 VanDerWaalsContact C-N 3.31Å; Q194-D196 VanDerWaalsContact CB-OD1 3.27Å; Q194-D196 WeakPolarHBondContact CB-OD1 3.46Å; Q194-D196 PolarHBondContact O-N 2.95Å; Q194-Q197 WeakPolarHBondContact O-CA 3.24Å; Q194-Q197 PolarHBondContact O-N 2.99Å; Q194-R198 WeakPolarHBondContact O-CG 3.32Å; Q194-R198 PolarHBondContact O-N 3.25Å
195	E	93.8	Very high	96.3	Very high	155 Å²	155	63.5 Å²	63.5	72%	0.724	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-60.1	-38.2	-163.1	-168.8	171.5	168.2	0	0	113.8	Q197 R198	E195-Q197 VanDerWaalsContact C-N 3.28Å; E195-Q197 PolarHBondContact O-N 2.87Å; E195-R198 PolarHBondContact O-N 2.85Å
196	D	95.4	Very high	96.2	Very high	117 Å²	117	65.6 Å²	65.6	63%	0.626	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-61.1	-31.5	173.5	63.4	-47	0	0	0	113.5	Q194	Q194-D196 VanDerWaalsContact C-N 3.31Å; Q194-D196 VanDerWaalsContact CB-OD1 3.27Å; Q194-D196 WeakPolarHBondContact CB-OD1 3.46Å; Q194-D196 PolarHBondContact O-N 2.95Å
197	Q	95.3	Very high	96.1	Very high	86 Å²	86	72.4 Å²	72.4	40%	0.402	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-89.6	-15.2	-179.6	-58.5	-173.6	-2.8	0	0	113.3	V193 Q194 E195 D199 L200 I201	V193-Q197 HydrophobicContact CG1-CB 3.96Å; Q194-Q197 WeakPolarHBondContact O-CA 3.24Å; Q194-Q197 PolarHBondContact O-N 2.99Å; E195-Q197 VanDerWaalsContact C-N 3.28Å; E195-Q197 PolarHBondContact O-N 2.87Å; Q197-D199 VanDerWaalsContact C-N 3.29Å; Q197-D199 PolarHBondContact O-N 3.26Å; Q197-L200 PolarHBondContact O-N 3.41Å; Q197-I201 HydrophobicContact CB-CD1 4.18Å; Q197-I201 PolarHBondContact O-N 2.75Å
198	R	95.5	Very high	96	Very high	62 Å²	62	73.9 Å²	73.9	23%	0.234	35%	0.354	C	S	.	.	H	α-helix	trans	-62	-31.8	-176.1	-69.6	180	-175.3	158.9	2.2	113.9	M190 D191 V193 Q194 E195 F202 R222	M190-R198 HydrophobicContact CE-CB 3.98Å; M190-R198 HydrophobicContact CE-CG 4.07Å; M190-R198 PolarHBondContact O-NE 3.37Å; D191-R198 PolarHBondContact O-NH2 2.9Å; V193-R198 HydrophobicContact CB-CG 4.03Å; V193-R198 HydrophobicContact CG1-CG 3.86Å; V193-R198 PolarHBondContact O-NE 2.93Å; V193-R198 PolarHBondContact O-NH2 2.85Å; Q194-R198 WeakPolarHBondContact O-CG 3.32Å; Q194-R198 PolarHBondContact O-N 3.25Å; E195-R198 PolarHBondContact O-N 2.85Å; R198-F202 WeakPolarHBondContact O-CB 3.14Å; R198-F202 PolarHBondContact O-N 2.94Å; R198-R222 VanDerWaalsContact C-NH1 3.28Å; R198-R222 PolarHBondContact O-NH1 3.45Å
199	D	95.6	Very high	95.8	Very high	80 Å²	80	73.8 Å²	73.8	43%	0.428	35%	0.354	S	S	.	.	H	α-helix	trans	-74.4	-40.6	176.8	-92.7	17.5	0	0	0	111.9	Q197 K203 R222	Q197-D199 VanDerWaalsContact C-N 3.29Å; Q197-D199 PolarHBondContact O-N 3.26Å; D199-K203 VanDerWaalsContact O-CG 3.31Å; D199-K203 WeakPolarHBondContact O-CG 3.45Å; D199-K203 PolarHBondContact O-N 3.19Å; D199-R222 IonicContact OD1-CZ 3.32Å; D199-R222 IonicContact OD1-NH1 2.65Å; D199-R222 PolarHBondContact OD1-NH1 2.84Å; D199-R222 IonicContact OD1-NH2 3.72Å; D199-R222 PolarHBondContact OD1-NH2 3.15Å
200	L	96.5	Very high	95.8	Very high	121 Å²	121	76.7 Å²	76.7	63%	0.634	36%	0.363	S	S	*	.	H	α-helix	trans	-69.1	-55.2	-177.6	-179.5	62.1	0	0	0	111	Q197 F202 K203 E204	Q197-L200 PolarHBondContact O-N 3.41Å; L200-F202 VanDerWaalsContact C-N 3.28Å; L200-F202 PolarHBondContact O-N 3.24Å; L200-K203 PolarHBondContact O-N 2.79Å; L200-E204 PolarHBondContact O-N 2.99Å
201	I	95.9	Very high	95.7	Very high	41 Å²	41	84.1 Å²	84.1	21%	0.21	39%	0.391	C	S	.	.	H	α-helix	trans	-63.2	-36	-178.3	-66.2	174.5	0	0	0	111	V155 V193 Q197 R205	V155-I201 HydrophobicContact CG2-CG2 4.09Å; V193-I201 HydrophobicContact CG1-CD1 3.89Å; Q197-I201 HydrophobicContact CB-CD1 4.18Å; Q197-I201 PolarHBondContact O-N 2.75Å; I201-R205 WeakPolarHBondContact O-CB 2.93Å; I201-R205 VanDerWaalsContact O-CG 3.28Å; I201-R205 WeakPolarHBondContact O-CG 3.31Å; I201-R205 PolarHBondContact O-N 3.24Å; I201-R205 VanDerWaalsContact O-N 3.14Å
202	F	97.4	Very high	95.6	Very high	25 Å²	25	84.2 Å²	84.2	11%	0.11	39%	0.391	C	S	.	.	H	α-helix	trans	-65.7	-44.4	175.8	176.9	-106.7	0	0	0	112.2	V187 R198 L200 R205 E206 C220 F221 R222	V187-F202 HydrophobicContact CB-CD2 4.34Å; V187-F202 HydrophobicContact CG2-CD2 4.21Å; V187-F202 HydrophobicContact CG2-CE2 4.29Å; R198-F202 WeakPolarHBondContact O-CB 3.14Å; R198-F202 PolarHBondContact O-N 2.94Å; L200-F202 VanDerWaalsContact C-N 3.28Å; L200-F202 PolarHBondContact O-N 3.24Å; F202-R205 PolarHBondContact O-N 2.87Å; F202-E206 HydrophobicContact CE1-CB 4.41Å; F202-E206 WeakPolarHBondContact CE1-OE2 3.31Å; F202-E206 HydrophobicContact CZ-CB 4.3Å; F202-E206 VanDerWaalsContact O-CB 3.23Å; F202-E206 WeakPolarHBondContact O-CB 3.45Å; F202-E206 PolarHBondContact O-N 2.94Å; F202-C220 HydrophobicContact CE2-CB 4.09Å; F202-C220 HydrophobicContact CZ-CB 3.89Å; F202-F221 VanDerWaalsContact CE2-C 3.42Å; F202-R222 HydrophobicContact CD2-CB 3.69Å; F202-R222 HydrophobicContact CD2-CG 4.29Å; F202-R222 HydrophobicContact CE2-CB 4.14Å; F202-R222 HydrophobicContact CG-CB 4.08Å; F202-R222 HydrophobicContact CG-CG 4.3Å
203	K	96.9	Very high	95.5	Very high	127 Å²	127	79.7 Å²	79.7	55%	0.552	37%	0.368	S	S	*	.	H	α-helix	trans	-64.8	-41.8	179.4	-76.2	171.4	-179.1	170.2	0	112.6	D199 L200 E206 E207	D199-K203 VanDerWaalsContact O-CG 3.31Å; D199-K203 WeakPolarHBondContact O-CG 3.45Å; D199-K203 PolarHBondContact O-N 3.19Å; L200-K203 PolarHBondContact O-N 2.79Å; K203-E206 PolarHBondContact O-N 3.12Å; K203-E207 PolarHBondContact O-N 3.4Å
204	E	95.8	Very high	95.3	Very high	104 Å²	104	88 Å²	88	49%	0.486	40%	0.397	S	S	.	.	H	α-helix	trans	-58.1	-49.9	174.9	-174.6	-175.4	171.4	0	0	111	L200 E206 E207 D208	L200-E204 PolarHBondContact O-N 2.99Å; E204-E206 PolarHBondContact O-N 3.38Å; E204-E207 PolarHBondContact O-N 2.92Å; E204-D208 PolarHBondContact O-N 3.16Å
205	R	95	Very high	95.2	Very high	54 Å²	54	87 Å²	87	20%	0.204	40%	0.401	C	S	.	.	H	α-helix	trans	-65.1	-37.9	176.5	-67.1	-66.8	179	-118.7	-8.9	112.9	L160 V187 I201 F202 D208 L209	L160-R205 VanDerWaalsContact CD1-NH2 3.3Å; V187-R205 HydrophobicContact CG2-CB 4.17Å; I201-R205 WeakPolarHBondContact O-CB 2.93Å; I201-R205 VanDerWaalsContact O-CG 3.28Å; I201-R205 WeakPolarHBondContact O-CG 3.31Å; I201-R205 PolarHBondContact O-N 3.24Å; I201-R205 VanDerWaalsContact O-N 3.14Å; F202-R205 PolarHBondContact O-N 2.87Å; R205-D208 IonicContact NH1-OD2 3.63Å; R205-L209 VanDerWaalsContact O-CB 3.32Å; R205-L209 WeakPolarHBondContact O-CB 3.34Å; R205-L209 WeakPolarHBondContact O-CD1 3.42Å; R205-L209 WeakPolarHBondContact O-CG 3.39Å; R205-L209 PolarHBondContact O-N 2.86Å
206	E	96.4	Very high	95.1	Very high	44 Å²	44	81 Å²	81	21%	0.206	37%	0.374	C	S	.	.	H	α-helix	trans	-64.7	-40.2	177	175.7	178.6	-158.3	0	0	111.9	F202 K203 E204 R210 C220	F202-E206 HydrophobicContact CE1-CB 4.41Å; F202-E206 WeakPolarHBondContact CE1-OE2 3.31Å; F202-E206 HydrophobicContact CZ-CB 4.3Å; F202-E206 VanDerWaalsContact O-CB 3.23Å; F202-E206 WeakPolarHBondContact O-CB 3.45Å; F202-E206 PolarHBondContact O-N 2.94Å; K203-E206 PolarHBondContact O-N 3.12Å; E204-E206 PolarHBondContact O-N 3.38Å; E206-R210 WeakPolarHBondContact O-CB 3.29Å; E206-R210 PolarHBondContact O-N 2.56Å; E206-R210 IonicContact OE1-CZ 2.7Å; E206-R210 IonicContact OE1-NH1 3.66Å; E206-R210 IonicContact OE1-NH2 3.68Å; E206-R210 PolarHBondContact OE1-NH2 3.23Å; E206-C220 HydrophobicContact CB-CB 4.16Å; E206-C220 HydrophobicContact CG-CB 3.85Å
207	E	96.1	Very high	94.9	Very high	143 Å²	143	84 Å²	84	67%	0.668	39%	0.385	S	S	*	.	H	α-helix	trans	-68.1	-44.7	175.4	-173.9	168.3	-177.5	0	0	111.9	K203 E204 L209 R210 R211	K203-E207 PolarHBondContact O-N 3.4Å; E204-E207 PolarHBondContact O-N 2.92Å; E207-L209 PolarHBondContact O-N 3.46Å; E207-R210 PolarHBondContact O-N 3.31Å; E207-R211 VanDerWaalsContact O-CB 3.28Å; E207-R211 WeakPolarHBondContact O-CB 3.35Å; E207-R211 PolarHBondContact O-N 2.8Å
208	D	94.6	Very high	94.9	Very high	36 Å²	36	80.6 Å²	80.6	19%	0.193	37%	0.37	C	S	.	.	H	α-helix	trans	-54.8	-51.5	172.9	-93.7	-21.9	0	0	0	112	E204 R205 R211 L212	E204-D208 PolarHBondContact O-N 3.16Å; R205-D208 IonicContact NH1-OD2 3.63Å; D208-R211 WeakPolarHBondContact O-CB 3.38Å; D208-R211 PolarHBondContact O-N 3.03Å; D208-R211 IonicContact OD1-CZ 3.64Å; D208-R211 IonicContact OD1-NE 3.87Å; D208-R211 IonicContact OD1-NH2 2.66Å; D208-R211 PolarHBondContact OD1-NH2 3.27Å; D208-L212 WeakPolarHBondContact O-CB 3.39Å; D208-L212 VanDerWaalsContact O-CG 3.29Å; D208-L212 WeakPolarHBondContact O-CG 3.45Å; D208-L212 PolarHBondContact O-N 2.95Å
209	L	95.7	Very high	95	Very high	1 Å²	1	79.9 Å²	79.9	1%	0.005	38%	0.375	C	S	.	.	H	α-helix	trans	-65.8	-42.6	-178.6	-69.6	167.4	0	0	0	111.5	F153 M164 Y167 C185 V187 R205 E207 R211 L212 S213	F153-L209 HydrophobicContact CD2-CD1 4.12Å; F153-L209 HydrophobicContact CD2-CD2 4.29Å; F153-L209 HydrophobicContact CE1-CD2 4.15Å; F153-L209 HydrophobicContact CE2-CD1 3.93Å; F153-L209 HydrophobicContact CE2-CD2 3.4Å; F153-L209 VanDerWaalsContact CE2-CD2 3.4Å; F153-L209 HydrophobicContact CE2-CG 4.33Å; F153-L209 HydrophobicContact CZ-CD2 3.32Å; M164-L209 HydrophobicContact CE-CD2 3.85Å; M164-L209 HydrophobicContact CE-CG 4.29Å; M164-L209 HydrophobicContact SD-CD2 3.77Å; Y167-L209 HydrophobicContact CD1-CD2 3.95Å; Y167-L209 HydrophobicContact CE1-CD2 3.8Å; C185-L209 HydrophobicContact CB-CD1 3.83Å; V187-L209 HydrophobicContact CG2-CD1 4.4Å; R205-L209 VanDerWaalsContact O-CB 3.32Å; R205-L209 WeakPolarHBondContact O-CB 3.34Å; R205-L209 WeakPolarHBondContact O-CD1 3.42Å; R205-L209 WeakPolarHBondContact O-CG 3.39Å; R205-L209 PolarHBondContact O-N 2.86Å; E207-L209 PolarHBondContact O-N 3.46Å; L209-R211 VanDerWaalsContact C-N 3.26Å; L209-R211 PolarHBondContact O-N 3.41Å; L209-L212 PolarHBondContact O-N 2.82Å; L209-S213 VanDerWaalsContact O-CB 3.28Å; L209-S213 WeakPolarHBondContact O-CB 3.46Å; L209-S213 PolarHBondContact O-N 3.44Å; L209-S213 PolarHBondContact O-OG 3.11Å
210	R	95.8	Very high	95.1	Very high	115 Å²	115	76.7 Å²	76.7	43%	0.434	36%	0.358	S	S	.	.	H	α-helix	trans	-64.5	-29.1	175.5	-175.9	-179.2	-70.2	119.7	0.7	112.9	E206 E207	E206-R210 WeakPolarHBondContact O-CB 3.29Å; E206-R210 PolarHBondContact O-N 2.56Å; E206-R210 IonicContact OE1-CZ 2.7Å; E206-R210 IonicContact OE1-NH1 3.66Å; E206-R210 IonicContact OE1-NH2 3.68Å; E206-R210 PolarHBondContact OE1-NH2 3.23Å; E207-R210 PolarHBondContact O-N 3.31Å
211	R	95.1	Very high	95.2	Very high	162 Å²	162	72.8 Å²	72.8	61%	0.611	34%	0.336	S	S	*	.	H	α-helix	trans	-73.1	-47.7	172.8	174.6	171.3	63.3	156.7	-2.2	111.5	E207 D208 L209	E207-R211 VanDerWaalsContact O-CB 3.28Å; E207-R211 WeakPolarHBondContact O-CB 3.35Å; E207-R211 PolarHBondContact O-N 2.8Å; D208-R211 WeakPolarHBondContact O-CB 3.38Å; D208-R211 PolarHBondContact O-N 3.03Å; D208-R211 IonicContact OD1-CZ 3.64Å; D208-R211 IonicContact OD1-NE 3.87Å; D208-R211 IonicContact OD1-NH2 2.66Å; D208-R211 PolarHBondContact OD1-NH2 3.27Å; L209-R211 VanDerWaalsContact C-N 3.26Å; L209-R211 PolarHBondContact O-N 3.41Å
212	L	93.3	Very high	95.2	Very high	49 Å²	49	74.8 Å²	74.8	26%	0.257	34%	0.341	S	S	.	.	H	α-helix	trans	-74.5	-22.4	-177.1	-67.8	170	0	0	0	114.1	M164 D208 L209 R214	M164-L212 HydrophobicContact CB-CD1 4.29Å; M164-L212 HydrophobicContact CE-CD1 4.46Å; M164-L212 HydrophobicContact CG-CD1 4.05Å; M164-L212 HydrophobicContact SD-CD1 3.62Å; D208-L212 WeakPolarHBondContact O-CB 3.39Å; D208-L212 VanDerWaalsContact O-CG 3.29Å; D208-L212 WeakPolarHBondContact O-CG 3.45Å; D208-L212 PolarHBondContact O-N 2.95Å; L209-L212 PolarHBondContact O-N 2.82Å; L212-R214 VanDerWaalsContact C-N 3.32Å; L212-R214 PolarHBondContact O-N 3.4Å
213	S	93.8	Very high	95.3	Very high	2 Å²	2	73.6 Å²	73.6	1%	0.014	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-16	-177.2	-57.6	0	0	0	0	114.8	Y167 L209 L216 C218	Y167-S213 PolarHBondContact OH-OG 2.87Å; L209-S213 VanDerWaalsContact O-CB 3.28Å; L209-S213 WeakPolarHBondContact O-CB 3.46Å; L209-S213 PolarHBondContact O-N 3.44Å; L209-S213 PolarHBondContact O-OG 3.11Å; S213-L216 CarbonylContact C-O 3.39Å; S213-L216 WeakPolarHBondContact O-CA 3.3Å; S213-L216 WeakPolarHBondContact O-CB 3.28Å; S213-L216 PolarHBondContact O-N 2.67Å; S213-L216 VanDerWaalsContact O-O 3.09Å; S213-C218 WeakPolarHBondContact OG-CB 3.08Å; S213-C218 PolarHBondContact OG-SG 3Å
214	R	92.2	Very high	95.3	Very high	194 Å²	194	67.5 Å²	67.5	73%	0.732	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	135.7	-175.5	-65.3	-178.3	177.5	-164	-2	110.9	L212	L212-R214 VanDerWaalsContact C-N 3.32Å; L212-R214 PolarHBondContact O-N 3.4Å
215	P	92.4	Very high	95.3	Very high	108 Å²	108	64.1 Å²	64.1	70%	0.701	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	cis	-84.2	-3.5	14.6	34	-37.8	0	0	0	115.9	L175	L175-P215 HydrophobicContact CD1-CG 4.28Å; L175-P215 HydrophobicContact CD2-CG 4.03Å
216	L	92.1	Very high	95.2	Very high	29 Å²	29	67.4 Å²	67.4	15%	0.152	31%	0.307	C	S	.	.	S	Bend	trans	-83.5	151	-176.7	-60.4	172	0	0	0	112	L171 I174 L175 I183 S213	L171-L216 HydrophobicContact CD2-CD1 4.4Å; I174-L216 HydrophobicContact CG2-CD1 4.11Å; L175-L216 HydrophobicContact CB-CD1 4.21Å; L175-L216 HydrophobicContact CD1-CD1 4.3Å; L175-L216 HydrophobicContact CD1-CD2 3.92Å; L175-L216 HydrophobicContact CD1-CG 4.16Å; I183-L216 HydrophobicContact CD1-CB 3.69Å; I183-L216 HydrophobicContact CD1-CD1 3.54Å; I183-L216 HydrophobicContact CD1-CG 4.2Å; S213-L216 CarbonylContact C-O 3.39Å; S213-L216 WeakPolarHBondContact O-CA 3.3Å; S213-L216 WeakPolarHBondContact O-CB 3.28Å; S213-L216 PolarHBondContact O-N 2.67Å; S213-L216 VanDerWaalsContact O-O 3.09Å
217	E	92.6	Very high	95.1	Very high	182 Å²	182	67.2 Å²	67.2	85%	0.85	31%	0.307	S	S	*	.			trans	-87.9	133.2	174.4	-63.9	-167.6	160.2	0	0	111.2
218	C	95	Very high	95	Very high	13 Å²	13	62.7 Å²	62.7	9%	0.088	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	136.6	175.9	66.3	0	0	0	0	111.8	I183 S213	I183-C218 HydrophobicContact CB-CB 4.42Å; I183-C218 HydrophobicContact CG2-CB 3.85Å; I183-C218 WeakPolarHBondContact O-CA 3.27Å; S213-C218 WeakPolarHBondContact OG-CB 3.08Å; S213-C218 PolarHBondContact OG-SG 3Å
219	S	97.1	Very high	95.1	Very high	48 Å²	48	62.1 Å²	62.1	34%	0.336	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	118.1	169.4	-69.6	0	0	0	0	110.4	I183 F184 C185	I183-S219 PolarHBondContact O-N 3.3Å; F184-S219 CarbonylContact C-O 3.59Å; F184-S219 VanDerWaalsContact CA-O 3.28Å; F184-S219 WeakPolarHBondContact CA-O 3.43Å; C185-S219 PolarHBondContact N-O 3.28Å
220	C	97.8	Very high	95.1	Very high	12 Å²	12	62.1 Å²	62.1	8%	0.081	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	141	-178.7	-66.1	0	0	0	0	111.9	C185 F202 E206	C185-C220 CarbonylContact O-C 3.57Å; C185-C220 WeakPolarHBondContact O-CA 3.37Å; F202-C220 HydrophobicContact CE2-CB 4.09Å; F202-C220 HydrophobicContact CZ-CB 3.89Å; E206-C220 HydrophobicContact CB-CB 4.16Å; E206-C220 HydrophobicContact CG-CB 3.85Å
221	F	98.1	Very high	95.1	Very high	39 Å²	39	56.9 Å²	56.9	17%	0.171	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	134.6	170.5	-63.4	-67.5	0	0	0	111.3	F184 C185 L186 V187 F202 T223 A233 S236	F184-F221 HydrophobicContact CD1-CD2 4.38Å; F184-F221 AromaticContact CD1-CE2 3.74Å; F184-F221 HydrophobicContact CD1-CE2 3.74Å; F184-F221 HydrophobicContact CE1-CE2 4.12Å; C185-F221 PolarHBondContact O-N 3.01Å; L186-F221 WeakPolarHBondContact CA-O 3.37Å; L186-F221 HydrophobicContact CD2-CB 3.86Å; L186-F221 HydrophobicContact CD2-CD2 3.96Å; L186-F221 HydrophobicContact CD2-CG 4.41Å; V187-F221 PolarHBondContact N-O 2.93Å; F202-F221 VanDerWaalsContact CE2-C 3.42Å; F221-T223 HydrophobicContact CB-CG2 4.3Å; F221-A233 HydrophobicContact CB-CB 3.9Å; F221-A233 HydrophobicContact CD2-CB 3.8Å; F221-A233 HydrophobicContact CE2-CB 4.47Å; F221-A233 HydrophobicContact CG-CB 3.84Å; F221-S236 WeakPolarHBondContact CZ-OG 3.42Å
222	R	97.1	Very high	95.2	Very high	83 Å²	83	52.6 Å²	52.6	31%	0.313	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	138.1	158.7	52.5	171.4	175.5	-149.6	1.5	109.9	V187 M190 R198 D199 F202	V187-R222 CarbonylContact O-C 3.5Å; V187-R222 WeakPolarHBondContact O-CA 3.38Å; M190-R222 HydrophobicContact CG-CB 3.9Å; R198-R222 VanDerWaalsContact C-NH1 3.28Å; R198-R222 PolarHBondContact O-NH1 3.45Å; D199-R222 IonicContact OD1-CZ 3.32Å; D199-R222 IonicContact OD1-NH1 2.65Å; D199-R222 PolarHBondContact OD1-NH1 2.84Å; D199-R222 IonicContact OD1-NH2 3.72Å; D199-R222 PolarHBondContact OD1-NH2 3.15Å; F202-R222 HydrophobicContact CD2-CB 3.69Å; F202-R222 HydrophobicContact CD2-CG 4.29Å; F202-R222 HydrophobicContact CE2-CB 4.14Å; F202-R222 HydrophobicContact CG-CB 4.08Å; F202-R222 HydrophobicContact CG-CG 4.3Å
223	T	97.9	Very high	95.3	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	147.1	-179.2	53.5	0	0	0	0	113.1	L186 V187 H188 K189 M190 F221 T229 A233	L186-T223 HydrophobicContact CD2-CG2 4.14Å; V187-T223 PolarHBondContact O-N 2.91Å; V187-T223 PolarHBondContact O-OG1 3.07Å; H188-T223 CarbonylContact C-O 3.57Å; H188-T223 WeakPolarHBondContact CA-O 3.27Å; H188-T223 PolarHBondContact ND1-O 3.16Å; H188-T223 PolarHBondContact ND1-OG1 3.11Å; K189-T223 PolarHBondContact N-O 2.51Å; K189-T223 VanDerWaalsContact N-O 3.11Å; M190-T223 PolarHBondContact N-O 2.93Å; F221-T223 HydrophobicContact CB-CG2 4.3Å; T223-T229 VanDerWaalsContact CA-OG1 3.29Å; T223-T229 WeakPolarHBondContact CA-OG1 3.39Å; T223-A233 HydrophobicContact CG2-CB 3.63Å
224	S	97.2	Very high	95.4	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	24%	0.238	C	C	.	.			trans	-133.6	155.8	163.3	-177.4	0	0	0	0	110.4	D191 W226 D227 T229 L230	D191-S224 WeakPolarHBondContact CB-OG 3.3Å; D191-S224 VanDerWaalsContact OD1-CB 3.31Å; D191-S224 WeakPolarHBondContact OD1-CB 3.37Å; D191-S224 PolarHBondContact OD1-OG 2.83Å; S224-W226 VanDerWaalsContact C-N 3.28Å; S224-W226 PolarHBondContact OG-N 3.48Å; S224-W226 VanDerWaalsContact OG-N 3.11Å; S224-D227 WeakPolarHBondContact CB-OD2 3.32Å; S224-T229 PolarHBondContact N-OG1 3.21Å; S224-T229 VanDerWaalsContact N-OG1 3.07Å; S224-L230 WeakPolarHBondContact O-CB 3.34Å
225	I	95.5	Very high	95.5	Very high	32 Å²	32	41.7 Å²	41.7	16%	0.164	21%	0.207	C	C	.	.	S	Bend	trans	-76.8	-12.9	167.9	59.6	172.7	0	0	0	113.4	M56 I59 A66	M56-I225 HydrophobicContact CG-CG2 4.3Å; I59-I225 HydrophobicContact CD1-CB 3.59Å; I59-I225 HydrophobicContact CD1-CG2 3.54Å; A66-I225 HydrophobicContact CB-CB 4.14Å; A66-I225 HydrophobicContact CB-CD1 4.07Å; A66-I225 HydrophobicContact CB-CG1 4.06Å; A66-I225 VanDerWaalsContact CB-O 3.29Å; A66-I225 WeakPolarHBondContact CB-O 3.49Å
226	W	94.4	Very high	95.6	Very high	123 Å²	123	38.5 Å²	38.5	47%	0.466	19%	0.187	S	C	.	.	S	Bend	trans	-94.6	-9.6	-173.2	-57.1	101.7	0	0	0	114.5	A66 D191 S224	A66-W226 HydrophobicContact CB-CD2 4.09Å; A66-W226 HydrophobicContact CB-CE3 3.72Å; A66-W226 HydrophobicContact CB-CH2 4.25Å; A66-W226 HydrophobicContact CB-CZ3 3.82Å; D191-W226 VanDerWaalsContact CG-CD1 3.46Å; D191-W226 PolarHBondContact OD2-NE1 3.44Å; S224-W226 VanDerWaalsContact C-N 3.28Å; S224-W226 PolarHBondContact OG-N 3.48Å; S224-W226 VanDerWaalsContact OG-N 3.11Å
227	D	93.8	Very high	95.7	Very high	40 Å²	40	37.1 Å²	37.1	21%	0.214	18%	0.18	C	C	.	.	S	Bend	trans	-132.4	-178.2	-175.5	65.9	38.7	0	0	0	112.6	S224 T229	S224-D227 WeakPolarHBondContact CB-OD2 3.32Å; D227-T229 VanDerWaalsContact C-N 3.31Å; D227-T229 PolarHBondContact O-N 3.49Å; D227-T229 WeakPolarHBondContact OD1-CB 3.25Å; D227-T229 VanDerWaalsContact OD1-CG2 3.32Å; D227-T229 WeakPolarHBondContact OD1-CG2 3.46Å; D227-T229 PolarHBondContact OD1-N 2.89Å; D227-T229 PolarHBondContact OD1-OG1 2.68Å
228	E	94.1	Very high	95.6	Very high	48 Å²	48	28.6 Å²	28.6	22%	0.224	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-14.5	179.4	62.5	-93.7	-149.8	0	0	115.3	L230 Y231 K232 E290 K291	E228-L230 PolarHBondContact O-N 2.85Å; E228-L230 VanDerWaalsContact O-N 3.16Å; E228-Y231 WeakPolarHBondContact O-CA 3.38Å; E228-Y231 WeakPolarHBondContact O-CB 3.31Å; E228-Y231 PolarHBondContact O-N 3.31Å; E228-K232 PolarHBondContact O-N 3.32Å; E228-K232 VanDerWaalsContact O-N 3.15Å; E228-E290 HydrophobicContact CB-CB 4Å; E228-E290 HydrophobicContact CB-CG 3.72Å; E228-E290 HydrophobicContact CG-CB 4.47Å; E228-E290 HydrophobicContact CG-CG 3.64Å; E228-K291 HydrophobicContact CB-CG 4.18Å; E228-K291 HydrophobicContact CG-CG 3.83Å; E228-K291 WeakPolarHBondContact OE1-CE 3.46Å; E228-K291 WeakPolarHBondContact OE1-CG 3.3Å
229	T	96.5	Very high	95.4	Very high	25 Å²	25	31.7 Å²	31.7	15%	0.153	15%	0.151	C	C	.	.	H	α-helix	trans	-63	-30.1	-170.9	62.7	0	0	0	0	112.5	T223 S224 D227 K232 A233	T223-T229 VanDerWaalsContact CA-OG1 3.29Å; T223-T229 WeakPolarHBondContact CA-OG1 3.39Å; S224-T229 PolarHBondContact N-OG1 3.21Å; S224-T229 VanDerWaalsContact N-OG1 3.07Å; D227-T229 VanDerWaalsContact C-N 3.31Å; D227-T229 PolarHBondContact O-N 3.49Å; D227-T229 WeakPolarHBondContact OD1-CB 3.25Å; D227-T229 VanDerWaalsContact OD1-CG2 3.32Å; D227-T229 WeakPolarHBondContact OD1-CG2 3.46Å; D227-T229 PolarHBondContact OD1-N 2.89Å; D227-T229 PolarHBondContact OD1-OG1 2.68Å; T229-K232 WeakPolarHBondContact O-CB 3.33Å; T229-K232 PolarHBondContact O-N 2.92Å; T229-A233 PolarHBondContact O-N 2.83Å
230	L	96.4	Very high	95.1	Very high	1 Å²	1	32.7 Å²	32.7	1%	0.005	15%	0.15	C	C	.	.	H	α-helix	trans	-60.6	-42.4	171.4	-175	65.4	0	0	0	112.5	M56 I59 I60 S224 E228 K232 A233 W234	M56-L230 HydrophobicContact CB-CD1 3.9Å; M56-L230 HydrophobicContact CB-CD2 4.45Å; M56-L230 HydrophobicContact CG-CD1 3.47Å; M56-L230 VanDerWaalsContact CG-CD1 3.47Å; M56-L230 HydrophobicContact CG-CD2 4.26Å; M56-L230 HydrophobicContact SD-CD1 3.37Å; M56-L230 WeakPolarHBondContact SD-CD1 3.49Å; I59-L230 HydrophobicContact CB-CD2 4.39Å; I59-L230 HydrophobicContact CD1-CD2 4.41Å; I59-L230 HydrophobicContact CG2-CD2 4.17Å; I60-L230 HydrophobicContact CD1-CD2 4.16Å; I60-L230 HydrophobicContact CD1-CG 4.13Å; I60-L230 HydrophobicContact CG1-CD2 4.27Å; I60-L230 HydrophobicContact CG1-CG 4.34Å; S224-L230 WeakPolarHBondContact O-CB 3.34Å; E228-L230 PolarHBondContact O-N 2.85Å; E228-L230 VanDerWaalsContact O-N 3.16Å; L230-K232 VanDerWaalsContact C-N 3.34Å; L230-A233 PolarHBondContact O-N 3.43Å; L230-W234 VanDerWaalsContact CD1-CD1 3.47Å; L230-W234 PolarHBondContact O-N 3.4Å
231	Y	95.6	Very high	94.6	Very high	4 Å²	4	32.7 Å²	32.7	2%	0.016	15%	0.15	C	C	.	.	H	α-helix	trans	-68.7	-34.9	177.4	-68.8	-92.7	0	0	0	111.3	I60 E228 S235 L273 N294	I60-Y231 HydrophobicContact CD1-CD1 3.86Å; I60-Y231 HydrophobicContact CD1-CE1 3.68Å; I60-Y231 HydrophobicContact CD1-CE2 4.42Å; I60-Y231 HydrophobicContact CD1-CG 4.29Å; E228-Y231 WeakPolarHBondContact O-CA 3.38Å; E228-Y231 WeakPolarHBondContact O-CB 3.31Å; E228-Y231 PolarHBondContact O-N 3.31Å; Y231-S235 WeakPolarHBondContact O-CB 3.36Å; Y231-S235 PolarHBondContact O-N 3.1Å; Y231-S235 PolarHBondContact O-OG 3.07Å; Y231-L273 HydrophobicContact CD1-CD2 4.07Å; Y231-N294 HydrophobicContact CD2-CB 3.96Å; Y231-N294 HydrophobicContact CE2-CB 3.91Å
232	K	95.5	Very high	94.1	Very high	72 Å²	72	31.6 Å²	31.6	31%	0.313	15%	0.145	S	C	.	.	H	α-helix	trans	-60.8	-51.4	172.8	-163	-169.8	-164.2	89.6	0	111.3	E228 T229 L230 S235 S236 A286 H287 E290	E228-K232 PolarHBondContact O-N 3.32Å; E228-K232 VanDerWaalsContact O-N 3.15Å; T229-K232 WeakPolarHBondContact O-CB 3.33Å; T229-K232 PolarHBondContact O-N 2.92Å; L230-K232 VanDerWaalsContact C-N 3.34Å; K232-S235 PolarHBondContact O-N 2.92Å; K232-S236 PolarHBondContact O-N 2.93Å; K232-A286 PolarHBondContact NZ-O 2.88Å; K232-H287 PolarHBondContact NZ-CE1 2.91Å; K232-H287 PolarHBondContact NZ-ND1 2.86Å; K232-H287 VanDerWaalsContact NZ-ND1 3.16Å; K232-E290 HydrophobicContact CB-CB 4.11Å; K232-E290 HydrophobicContact CB-CG 4.03Å; K232-E290 WeakPolarHBondContact CD-OE1 3.41Å; K232-E290 WeakPolarHBondContact CE-OE1 3.45Å; K232-E290 VanDerWaalsContact CG-OE1 3.25Å; K232-E290 WeakPolarHBondContact CG-OE1 3.49Å; K232-E290 IonicContact NZ-OE1 2.86Å; K232-E290 PolarHBondContact NZ-OE1 3.44Å
233	A	96.6	Very high	93.3	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-61.4	-51.7	-179.5	0	0	0	0	0	111.8	L186 F221 T223 T229 L230 S235 S236 I237	L186-A233 HydrophobicContact CD2-CB 3.96Å; F221-A233 HydrophobicContact CB-CB 3.9Å; F221-A233 HydrophobicContact CD2-CB 3.8Å; F221-A233 HydrophobicContact CE2-CB 4.47Å; F221-A233 HydrophobicContact CG-CB 3.84Å; T223-A233 HydrophobicContact CG2-CB 3.63Å; T229-A233 PolarHBondContact O-N 2.83Å; L230-A233 PolarHBondContact O-N 3.43Å; A233-S235 PolarHBondContact O-N 2.94Å; A233-S236 PolarHBondContact O-N 3.22Å; A233-I237 WeakPolarHBondContact O-CD1 3.49Å; A233-I237 VanDerWaalsContact O-CG1 3.27Å; A233-I237 WeakPolarHBondContact O-CG1 3.44Å; A233-I237 PolarHBondContact O-N 3.09Å
234	W	95.6	Very high	92.5	Very high	3 Å²	3	33.2 Å²	33.2	1%	0.011	16%	0.162	C	C	.	.	H	α-helix	trans	-67	-32.9	179.5	-80.3	95.3	0	0	0	113.4	L45 I60 F61 L121 I150 L230 I237 V238 L273	L45-W234 HydrophobicContact CD1-CZ2 4.48Å; I60-W234 HydrophobicContact CG1-CB 4.47Å; I60-W234 HydrophobicContact CG1-CG 4.04Å; F61-W234 HydrophobicContact CE2-CD2 4.39Å; F61-W234 AromaticContact CE2-CE3 3.86Å; F61-W234 HydrophobicContact CE2-CE3 3.86Å; F61-W234 AromaticContact CE2-CH2 3.95Å; F61-W234 HydrophobicContact CE2-CH2 3.95Å; F61-W234 HydrophobicContact CE2-CZ2 4.46Å; F61-W234 AromaticContact CE2-CZ3 3.62Å; F61-W234 HydrophobicContact CE2-CZ3 3.62Å; F61-W234 AromaticContact CZ-CE3 3.75Å; F61-W234 HydrophobicContact CZ-CE3 3.75Å; F61-W234 AromaticContact CZ-CZ3 3.77Å; F61-W234 HydrophobicContact CZ-CZ3 3.77Å; L121-W234 HydrophobicContact CD1-CH2 3.73Å; L121-W234 HydrophobicContact CD1-CZ3 4.08Å; I150-W234 HydrophobicContact CD1-CE3 4.36Å; I150-W234 HydrophobicContact CD1-CH2 3.28Å; I150-W234 HydrophobicContact CD1-CZ2 3.91Å; I150-W234 HydrophobicContact CD1-CZ3 3.55Å; L230-W234 VanDerWaalsContact CD1-CD1 3.47Å; L230-W234 PolarHBondContact O-N 3.4Å; W234-I237 PolarHBondContact O-N 3.45Å; W234-V238 WeakPolarHBondContact O-CB 3.29Å; W234-V238 VanDerWaalsContact O-CG2 3.32Å; W234-V238 WeakPolarHBondContact O-CG2 3.22Å; W234-V238 PolarHBondContact O-N 2.98Å; W234-L273 HydrophobicContact CB-CD1 4.07Å; W234-L273 HydrophobicContact CB-CD2 3.75Å
235	S	94.3	Very high	91.9	Very high	14 Å²	14	34.2 Å²	34.2	10%	0.098	17%	0.168	C	C	.	.	H	α-helix	trans	-64.8	-43.9	173.3	-58.4	0	0	0	0	110.5	Y231 K232 A233 V238 Y239 L273 V274	Y231-S235 WeakPolarHBondContact O-CB 3.36Å; Y231-S235 PolarHBondContact O-N 3.1Å; Y231-S235 PolarHBondContact O-OG 3.07Å; K232-S235 PolarHBondContact O-N 2.92Å; A233-S235 PolarHBondContact O-N 2.94Å; S235-V238 PolarHBondContact O-N 3.36Å; S235-Y239 WeakPolarHBondContact O-CB 3.4Å; S235-Y239 PolarHBondContact O-N 2.88Å; S235-L273 WeakPolarHBondContact OG-CD2 3.22Å; S235-V274 PolarHBondContact OG-N 3.04Å
236	S	94.3	Very high	91.5	Very high	40 Å²	40	39.8 Å²	39.8	28%	0.28	19%	0.194	S	C	.	.	H	α-helix	trans	-64.6	-40.9	176.8	-170.8	0	0	0	0	113.1	F221 K232 A233 Q240	F221-S236 WeakPolarHBondContact CZ-OG 3.42Å; K232-S236 PolarHBondContact O-N 2.93Å; A233-S236 PolarHBondContact O-N 3.22Å; S236-Q240 WeakPolarHBondContact O-CG 3.28Å; S236-Q240 PolarHBondContact O-N 3.22Å
237	I	94	Very high	91.2	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.005	19%	0.193	C	C	.	.	H	α-helix	trans	-62.3	-48	176.3	-68.6	162.4	0	0	0	111	V148 I150 F184 L186 A233 W234 Q240	V148-I237 HydrophobicContact CG1-CG2 4.11Å; I150-I237 HydrophobicContact CD1-CD1 4.06Å; I150-I237 HydrophobicContact CD1-CG2 4.08Å; I150-I237 HydrophobicContact CG1-CD1 4.24Å; I150-I237 HydrophobicContact CG1-CG2 4.44Å; I150-I237 HydrophobicContact CG2-CD1 4.41Å; F184-I237 HydrophobicContact CB-CD1 4.22Å; F184-I237 HydrophobicContact CB-CG1 4.21Å; F184-I237 HydrophobicContact CD1-CD1 4.4Å; F184-I237 HydrophobicContact CD1-CG1 3.6Å; F184-I237 HydrophobicContact CD2-CG1 3.9Å; F184-I237 HydrophobicContact CD2-CG2 4.45Å; F184-I237 HydrophobicContact CE1-CG1 3.8Å; F184-I237 HydrophobicContact CE2-CB 4.46Å; F184-I237 HydrophobicContact CE2-CG1 4.08Å; F184-I237 HydrophobicContact CE2-CG2 4.31Å; F184-I237 HydrophobicContact CG-CD1 4.19Å; F184-I237 HydrophobicContact CG-CG1 3.64Å; F184-I237 HydrophobicContact CZ-CB 4.42Å; F184-I237 HydrophobicContact CZ-CG1 4.02Å; L186-I237 HydrophobicContact CD2-CD1 4.42Å; A233-I237 WeakPolarHBondContact O-CD1 3.49Å; A233-I237 VanDerWaalsContact O-CG1 3.27Å; A233-I237 WeakPolarHBondContact O-CG1 3.44Å; A233-I237 PolarHBondContact O-N 3.09Å; W234-I237 PolarHBondContact O-N 3.45Å; I237-Q240 PolarHBondContact O-N 3.36Å
238	V	91.4	Very high	90.9	Very high	3 Å²	3	38 Å²	38	2%	0.018	19%	0.19	C	C	.	.	H	α-helix	trans	-73.8	-36.4	-178	179.6	0	0	0	0	111.5	F113 L119 W234 S235 Q240 L241 I242 L273	F113-V238 HydrophobicContact CD1-CG1 3.84Å; F113-V238 HydrophobicContact CD2-CG1 4.24Å; F113-V238 HydrophobicContact CE1-CG1 3.48Å; F113-V238 VanDerWaalsContact CE1-CG1 3.48Å; F113-V238 HydrophobicContact CE2-CG1 3.91Å; F113-V238 HydrophobicContact CG-CG1 4.21Å; F113-V238 HydrophobicContact CZ-CB 4.49Å; F113-V238 HydrophobicContact CZ-CG1 3.51Å; L119-V238 HydrophobicContact CD1-CG2 4.13Å; W234-V238 WeakPolarHBondContact O-CB 3.29Å; W234-V238 VanDerWaalsContact O-CG2 3.32Å; W234-V238 WeakPolarHBondContact O-CG2 3.22Å; W234-V238 PolarHBondContact O-N 2.98Å; S235-V238 PolarHBondContact O-N 3.36Å; V238-Q240 PolarHBondContact O-N 2.68Å; V238-L241 WeakPolarHBondContact O-CA 3.45Å; V238-L241 WeakPolarHBondContact O-CB 3.19Å; V238-L241 PolarHBondContact O-N 3.49Å; V238-I242 HydrophobicContact CG1-CD1 4.28Å; V238-I242 HydrophobicContact CG1-CG1 4.35Å; V238-I242 WeakPolarHBondContact O-CG1 3.37Å; V238-I242 PolarHBondContact O-N 3.4Å; V238-L273 HydrophobicContact CG2-CD1 4.06Å
239	Y	90.6	Very high	90.8	Very high	77 Å²	77	39 Å²	39	30%	0.302	19%	0.194	S	C	.	.	H	α-helix	trans	-49.9	-45.2	171.1	-176.8	-91.2	0	0	0	111.6	S235 L241 I242 V245 E249 I275	S235-Y239 WeakPolarHBondContact O-CB 3.4Å; S235-Y239 PolarHBondContact O-N 2.88Å; Y239-L241 PolarHBondContact O-N 2.89Å; Y239-I242 PolarHBondContact O-N 2.82Å; Y239-V245 HydrophobicContact CD2-CG2 4.06Å; Y239-V245 HydrophobicContact CE1-CG1 4.48Å; Y239-V245 HydrophobicContact CE2-CG2 3.41Å; Y239-V245 VanDerWaalsContact CE2-CG2 3.41Å; Y239-E249 PolarHBondContact OH-OE1 3.03Å; Y239-I275 VanDerWaalsContact CD2-O 3.24Å; Y239-I275 WeakPolarHBondContact CD2-O 3.47Å; Y239-I275 WeakPolarHBondContact CE2-O 3.29Å
240	Q	90.1	Very high	90.6	Very high	69 Å²	69	43.7 Å²	43.7	32%	0.322	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-4.9	178.6	-74.7	-153.4	52.5	0	0	115.7	K182 F184 S236 I237 V238	K182-Q240 HydrophobicContact CD-CB 4.23Å; K182-Q240 PolarHBondContact NZ-O 3.47Å; K182-Q240 VanDerWaalsContact NZ-OE1 3.08Å; F184-Q240 HydrophobicContact CZ-CB 4.33Å; F184-Q240 HydrophobicContact CZ-CG 4.39Å; S236-Q240 WeakPolarHBondContact O-CG 3.28Å; S236-Q240 PolarHBondContact O-N 3.22Å; I237-Q240 PolarHBondContact O-N 3.36Å; V238-Q240 PolarHBondContact O-N 2.68Å
241	L	88.4	Confident	90.4	Very high	13 Å²	13	44.9 Å²	44.9	7%	0.068	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.1	-9.1	174.4	-73.4	173.6	0	0	0	113.5	K41 V43 L117 L119 E147 V148 V238 Y239	K41-L241 HydrophobicContact CB-CD2 4.14Å; K41-L241 HydrophobicContact CD-CD2 4.23Å; K41-L241 HydrophobicContact CG-CD2 4.15Å; V43-L241 HydrophobicContact CG2-CD1 3.82Å; L117-L241 HydrophobicContact CD2-CB 4.48Å; L119-L241 HydrophobicContact CD2-CD1 3.7Å; E147-L241 HydrophobicContact CB-CD2 4.13Å; V148-L241 HydrophobicContact CG2-CD1 3.94Å; V148-L241 HydrophobicContact CG2-CD2 3.73Å; V148-L241 HydrophobicContact CG2-CG 3.88Å; V238-L241 WeakPolarHBondContact O-CA 3.45Å; V238-L241 WeakPolarHBondContact O-CB 3.19Å; V238-L241 PolarHBondContact O-N 3.49Å; Y239-L241 PolarHBondContact O-N 2.89Å
242	I	86.4	Confident	90.4	Very high	15 Å²	15	44.7 Å²	44.7	8%	0.077	22%	0.222	C	C	.	.			trans	-79.1	124.6	-175.6	-72.3	169.7	0	0	0	110.4	F113 L114 L117 V238 Y239 V245 I275	F113-I242 HydrophobicContact CE1-CD1 3.94Å; F113-I242 HydrophobicContact CE1-CG1 4.46Å; L114-I242 HydrophobicContact CD1-CD1 3.9Å; L114-I242 HydrophobicContact CD1-CG1 4.1Å; L114-I242 HydrophobicContact CD1-CG2 4.08Å; L117-I242 HydrophobicContact CD2-CG1 4.33Å; V238-I242 HydrophobicContact CG1-CD1 4.28Å; V238-I242 HydrophobicContact CG1-CG1 4.35Å; V238-I242 WeakPolarHBondContact O-CG1 3.37Å; V238-I242 PolarHBondContact O-N 3.4Å; Y239-I242 PolarHBondContact O-N 2.82Å; I242-V245 HydrophobicContact CG2-CB 4.13Å; I242-V245 HydrophobicContact CG2-CG2 4.34Å; I242-I275 HydrophobicContact CD1-CB 4.45Å; I242-I275 HydrophobicContact CD1-CG1 4.36Å; I242-I275 HydrophobicContact CD1-CG2 3.88Å
243	P	81.1	Confident	90.3	Very high	35 Å²	35	47.9 Å²	47.9	23%	0.227	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	152.7	173.7	32.4	-36.8	0	0	0	110.7	M39 V245	M39-P243 HydrophobicContact CE-CB 3.83Å; M39-P243 HydrophobicContact CE-CG 3.69Å; P243-V245 PolarHBondContact O-N 3.28Å
244	N	80.2	Confident	90.3	Very high	82 Å²	82	51.4 Å²	51.4	44%	0.439	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.8	22.4	171.5	-51.5	-51.8	0	0	0	115.8	Q246 Q247 L248 D365	N244-Q246 PolarHBondContact O-N 3.09Å; N244-Q246 VanDerWaalsContact O-N 3.11Å; N244-Q247 HydrophobicContact CB-CB 4.49Å; N244-Q247 WeakPolarHBondContact O-CA 3.49Å; N244-Q247 WeakPolarHBondContact O-CB 3.28Å; N244-Q247 PolarHBondContact O-N 3.45Å; N244-L248 PolarHBondContact O-N 2.76Å; N244-D365 PolarHBondContact ND2-OD1 2.7Å; N244-D365 PolarHBondContact ND2-OD2 2.67Å
245	V	84.8	Confident	90.2	Very high	22 Å²	22	51.9 Å²	51.9	13%	0.133	25%	0.253	C	S	.	.	H	α-helix	trans	-55.9	-35.1	-172.6	71.8	0	0	0	0	113.4	Y239 I242 P243 Q247 L248 E249	Y239-V245 HydrophobicContact CD2-CG2 4.06Å; Y239-V245 HydrophobicContact CE1-CG1 4.48Å; Y239-V245 HydrophobicContact CE2-CG2 3.41Å; Y239-V245 VanDerWaalsContact CE2-CG2 3.41Å; I242-V245 HydrophobicContact CG2-CB 4.13Å; I242-V245 HydrophobicContact CG2-CG2 4.34Å; P243-V245 PolarHBondContact O-N 3.28Å; V245-Q247 VanDerWaalsContact C-N 3.34Å; V245-Q247 PolarHBondContact O-N 3Å; V245-L248 WeakPolarHBondContact O-CA 3.32Å; V245-L248 WeakPolarHBondContact O-CB 3.17Å; V245-L248 PolarHBondContact O-N 3.17Å; V245-E249 WeakPolarHBondContact O-CG 3.36Å; V245-E249 PolarHBondContact O-N 3.4Å
246	Q	87.1	Confident	90.3	Very high	149 Å²	149	51.2 Å²	51.2	70%	0.696	25%	0.249	S	C	*	.	H	α-helix	trans	-58.5	-40.5	173.3	-65.2	173.1	-16.2	0	0	113	N244 L248 E249 M250	N244-Q246 PolarHBondContact O-N 3.09Å; N244-Q246 VanDerWaalsContact O-N 3.11Å; Q246-L248 VanDerWaalsContact C-N 3.31Å; Q246-E249 PolarHBondContact O-N 3.14Å; Q246-M250 VanDerWaalsContact O-CG 3.3Å; Q246-M250 WeakPolarHBondContact O-CG 3.35Å; Q246-M250 PolarHBondContact O-N 3.4Å
247	Q	88.3	Confident	90.2	Very high	97 Å²	97	54.2 Å²	54.2	45%	0.453	26%	0.258	S	S	.	.	H	α-helix	trans	-69.3	-33.1	176	-175.7	177.8	0.7	0	0	110.8	N244 V245 N251	N244-Q247 HydrophobicContact CB-CB 4.49Å; N244-Q247 WeakPolarHBondContact O-CA 3.49Å; N244-Q247 WeakPolarHBondContact O-CB 3.28Å; N244-Q247 PolarHBondContact O-N 3.45Å; V245-Q247 VanDerWaalsContact C-N 3.34Å; V245-Q247 PolarHBondContact O-N 3Å; Q247-N251 PolarHBondContact O-N 3Å; Q247-N251 VanDerWaalsContact O-N 3.1Å; Q247-N251 PolarHBondContact O-ND2 2.79Å
248	L	88.7	Confident	90.2	Very high	29 Å²	29	60.6 Å²	60.6	15%	0.152	29%	0.291	C	S	.	.	H	α-helix	trans	-68.6	-44.6	175.5	-171.1	58.5	0	0	0	111.3	N244 V245 Q246 N251 L252 L266 I275 F358	N244-L248 PolarHBondContact O-N 2.76Å; V245-L248 WeakPolarHBondContact O-CA 3.32Å; V245-L248 WeakPolarHBondContact O-CB 3.17Å; V245-L248 PolarHBondContact O-N 3.17Å; Q246-L248 VanDerWaalsContact C-N 3.31Å; L248-N251 PolarHBondContact O-N 3.04Å; L248-L252 WeakPolarHBondContact O-CB 3.31Å; L248-L252 PolarHBondContact O-N 3.38Å; L248-L266 HydrophobicContact CD1-CD2 3.84Å; L248-L266 HydrophobicContact CD2-CD2 3.83Å; L248-L266 HydrophobicContact CG-CD2 3.96Å; L248-I275 HydrophobicContact CD2-CG2 3.43Å; L248-I275 VanDerWaalsContact CD2-CG2 3.43Å; L248-F358 HydrophobicContact CD1-CD1 3.91Å; L248-F358 HydrophobicContact CD1-CE1 3.89Å
249	E	91	Very high	90.2	Very high	67 Å²	67	61 Å²	61	31%	0.313	29%	0.293	S	S	.	.	H	α-helix	trans	-59.5	-45.9	173.4	-71.3	-177.6	125.3	0	0	112.2	Y239 V245 Q246 N251 L252 R253	Y239-E249 PolarHBondContact OH-OE1 3.03Å; V245-E249 WeakPolarHBondContact O-CG 3.36Å; V245-E249 PolarHBondContact O-N 3.4Å; Q246-E249 PolarHBondContact O-N 3.14Å; E249-N251 PolarHBondContact O-N 2.93Å; E249-L252 PolarHBondContact O-N 2.84Å; E249-R253 WeakPolarHBondContact O-CB 3.16Å; E249-R253 PolarHBondContact O-N 2.88Å
250	M	92.2	Very high	90.3	Very high	124 Å²	124	64.3 Å²	64.3	61%	0.611	31%	0.311	S	S	*	.	H	α-helix	trans	-60.1	-44	176.6	-74.6	178.6	72.6	0	0	112.1	Q246 R253 N254	Q246-M250 VanDerWaalsContact O-CG 3.3Å; Q246-M250 WeakPolarHBondContact O-CG 3.35Å; Q246-M250 PolarHBondContact O-N 3.4Å; M250-R253 PolarHBondContact O-N 3.07Å; M250-N254 WeakPolarHBondContact O-CB 3.39Å; M250-N254 PolarHBondContact O-N 2.92Å; M250-N254 PolarHBondContact O-ND2 3.28Å; M250-N254 PolarHBondContact O-OD1 3.09Å
251	N	92.8	Very high	90.5	Very high	26 Å²	26	61.2 Å²	61.2	14%	0.139	30%	0.297	C	S	.	.	H	α-helix	trans	-71.7	-32.8	178.3	-71.7	-55	0	0	0	112.5	Q247 L248 E249 F255 H357 F358 L361	Q247-N251 PolarHBondContact O-N 3Å; Q247-N251 VanDerWaalsContact O-N 3.1Å; Q247-N251 PolarHBondContact O-ND2 2.79Å; L248-N251 PolarHBondContact O-N 3.04Å; E249-N251 PolarHBondContact O-N 2.93Å; N251-F255 WeakPolarHBondContact O-CB 3.36Å; N251-F255 PolarHBondContact O-N 2.64Å; N251-H357 PolarHBondContact OD1-NE2 2.94Å; N251-F358 HydrophobicContact CB-CE1 4.14Å; N251-F358 HydrophobicContact CB-CZ 3.96Å; N251-L361 HydrophobicContact CB-CD1 4.03Å
252	L	94.3	Very high	90.7	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-68.5	-39	174.7	-162.7	69.9	0	0	0	111.6	L248 E249 F255 A256 V264 L266 S276 F358	L248-L252 WeakPolarHBondContact O-CB 3.31Å; L248-L252 PolarHBondContact O-N 3.38Å; E249-L252 PolarHBondContact O-N 2.84Å; L252-F255 PolarHBondContact O-N 3.35Å; L252-A256 WeakPolarHBondContact O-CB 3.47Å; L252-A256 PolarHBondContact O-N 3.03Å; L252-V264 HydrophobicContact CD1-CG1 3.74Å; L252-V264 HydrophobicContact CG-CG1 4.15Å; L252-L266 HydrophobicContact CD1-CB 4.34Å; L252-L266 HydrophobicContact CD2-CB 4.15Å; L252-S276 WeakPolarHBondContact CD2-OG 3.49Å; L252-F358 HydrophobicContact CD1-CE1 4.39Å; L252-F358 HydrophobicContact CD1-CZ 4.34Å
253	R	95.1	Very high	91.1	Very high	139 Å²	139	61.1 Å²	61.1	53%	0.525	30%	0.297	S	S	.	.	H	α-helix	trans	-60.4	-54.5	170.5	175.9	173.6	-53.6	180	5.4	111.6	E249 M250 F255 A256 E257 Y278	E249-R253 WeakPolarHBondContact O-CB 3.16Å; E249-R253 PolarHBondContact O-N 2.88Å; M250-R253 PolarHBondContact O-N 3.07Å; R253-F255 PolarHBondContact O-N 3.2Å; R253-A256 PolarHBondContact O-N 3.46Å; R253-E257 WeakPolarHBondContact CD-OE1 3.43Å; R253-E257 HydrophobicContact CG-CG 4.33Å; R253-E257 WeakPolarHBondContact CG-OE1 3.28Å; R253-E257 WeakPolarHBondContact O-CG 3.47Å; R253-E257 PolarHBondContact O-N 2.73Å; R253-Y278 HydrophobicContact CB-CD2 3.87Å; R253-Y278 HydrophobicContact CB-CE2 4.3Å; R253-Y278 HydrophobicContact CG-CD2 3.8Å; R253-Y278 HydrophobicContact CG-CE2 3.71Å
254	N	95	Very high	91.8	Very high	74 Å²	74	59.4 Å²	59.4	40%	0.396	29%	0.286	S	S	.	.	H	α-helix	trans	-55.5	-40	178.2	-66.1	-13.9	0	0	0	111.5	M250 I258	M250-N254 WeakPolarHBondContact O-CB 3.39Å; M250-N254 PolarHBondContact O-N 2.92Å; M250-N254 PolarHBondContact O-ND2 3.28Å; M250-N254 PolarHBondContact O-OD1 3.09Å; N254-I258 WeakPolarHBondContact O-CB 3.43Å; N254-I258 WeakPolarHBondContact O-CD1 3.44Å; N254-I258 WeakPolarHBondContact O-CG1 3.34Å; N254-I258 PolarHBondContact O-N 2.84Å; N254-I258 VanDerWaalsContact O-N 3.07Å
255	F	95.2	Very high	92.6	Very high	13 Å²	13	55.5 Å²	55.5	6%	0.057	27%	0.265	C	S	.	.	H	α-helix	trans	-65.5	-46	175.1	171.5	-118.9	0	0	0	112.5	N251 L252 R253 E257 I258 I259 V264 F327 V333 V335 I351 A354 F358	N251-F255 WeakPolarHBondContact O-CB 3.36Å; N251-F255 PolarHBondContact O-N 2.64Å; L252-F255 PolarHBondContact O-N 3.35Å; R253-F255 PolarHBondContact O-N 3.2Å; F255-E257 PolarHBondContact O-N 2.81Å; F255-I258 PolarHBondContact O-N 3.03Å; F255-I259 HydrophobicContact CD1-CD1 4.27Å; F255-I259 HydrophobicContact CD2-CD1 4.46Å; F255-I259 HydrophobicContact CD2-CG2 4.08Å; F255-I259 HydrophobicContact CE1-CD1 3.77Å; F255-I259 HydrophobicContact CE2-CD1 3.98Å; F255-I259 HydrophobicContact CE2-CG2 3.74Å; F255-I259 HydrophobicContact CZ-CD1 3.61Å; F255-I259 HydrophobicContact CZ-CG2 4.37Å; F255-I259 WeakPolarHBondContact O-CG1 3.18Å; F255-I259 WeakPolarHBondContact O-CG2 2.84Å; F255-I259 PolarHBondContact O-N 2.96Å; F255-V264 HydrophobicContact CD1-CG1 4.18Å; F255-V264 HydrophobicContact CE1-CG1 4.15Å; F255-F327 HydrophobicContact CD1-CZ 4.47Å; F255-F327 HydrophobicContact CE1-CZ 4.28Å; F255-F327 HydrophobicContact CZ-CE2 4.45Å; F255-V333 HydrophobicContact CE1-CG2 4.39Å; F255-V335 HydrophobicContact CE1-CG2 4.13Å; F255-V335 HydrophobicContact CZ-CG2 4.42Å; F255-I351 HydrophobicContact CZ-CG1 3.99Å; F255-A354 HydrophobicContact CD2-CB 3.46Å; F255-A354 VanDerWaalsContact CD2-CB 3.46Å; F255-A354 HydrophobicContact CE2-CB 3.36Å; F255-A354 HydrophobicContact CG-CB 4.26Å; F255-A354 HydrophobicContact CZ-CB 4.09Å; F255-F358 HydrophobicContact CB-CE2 4.3Å; F255-F358 HydrophobicContact CB-CZ 4.39Å
256	A	94.9	Very high	93.1	Very high	1 Å²	1	54.6 Å²	54.6	1%	0.008	26%	0.259	C	S	.	.	H	α-helix	trans	-62.9	-39.5	178.6	0	0	0	0	0	112.8	L252 R253 I259 E260 A261 V264 Y278	L252-A256 WeakPolarHBondContact O-CB 3.47Å; L252-A256 PolarHBondContact O-N 3.03Å; R253-A256 PolarHBondContact O-N 3.46Å; A256-I259 WeakPolarHBondContact O-CG1 3.14Å; A256-I259 PolarHBondContact O-N 2.91Å; A256-E260 PolarHBondContact O-N 2.57Å; A256-A261 PolarHBondContact O-N 3.41Å; A256-V264 HydrophobicContact CB-CB 4.23Å; A256-V264 HydrophobicContact CB-CG2 3.55Å; A256-Y278 HydrophobicContact CB-CD1 3.21Å; A256-Y278 HydrophobicContact CB-CD2 4.47Å; A256-Y278 HydrophobicContact CB-CE1 3.59Å; A256-Y278 HydrophobicContact CB-CG 3.69Å
257	E	93.5	Very high	93.5	Very high	103 Å²	103	47.6 Å²	47.6	48%	0.481	23%	0.226	S	C	.	.	H	α-helix	trans	-66.8	-42.1	176	-70.9	170	-173.9	0	0	111.6	R253 F255 I259 E260	R253-E257 WeakPolarHBondContact CD-OE1 3.43Å; R253-E257 HydrophobicContact CG-CG 4.33Å; R253-E257 WeakPolarHBondContact CG-OE1 3.28Å; R253-E257 WeakPolarHBondContact O-CG 3.47Å; R253-E257 PolarHBondContact O-N 2.73Å; F255-E257 PolarHBondContact O-N 2.81Å; E257-I259 VanDerWaalsContact C-N 3.26Å; E257-I259 PolarHBondContact O-N 2.78Å; E257-E260 PolarHBondContact O-N 2.81Å
258	I	92.7	Very high	93.7	Very high	134 Å²	134	43.4 Å²	43.4	69%	0.687	21%	0.207	S	C	*	.	H	α-helix	trans	-64.6	-27.1	177.3	-74.2	166.5	0	0	0	113.2	N254 F255	N254-I258 WeakPolarHBondContact O-CB 3.43Å; N254-I258 WeakPolarHBondContact O-CD1 3.44Å; N254-I258 WeakPolarHBondContact O-CG1 3.34Å; N254-I258 PolarHBondContact O-N 2.84Å; N254-I258 VanDerWaalsContact O-N 3.07Å; F255-I258 PolarHBondContact O-N 3.03Å
259	I	92.4	Very high	93.9	Very high	11 Å²	11	47 Å²	47	6%	0.056	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.8	1.3	-179.9	73.8	-173.8	0	0	0	113.6	F255 A256 E257 A261 V264 V335 M337 N350	F255-I259 HydrophobicContact CD1-CD1 4.27Å; F255-I259 HydrophobicContact CD2-CD1 4.46Å; F255-I259 HydrophobicContact CD2-CG2 4.08Å; F255-I259 HydrophobicContact CE1-CD1 3.77Å; F255-I259 HydrophobicContact CE2-CD1 3.98Å; F255-I259 HydrophobicContact CE2-CG2 3.74Å; F255-I259 HydrophobicContact CZ-CD1 3.61Å; F255-I259 HydrophobicContact CZ-CG2 4.37Å; F255-I259 WeakPolarHBondContact O-CG1 3.18Å; F255-I259 WeakPolarHBondContact O-CG2 2.84Å; F255-I259 PolarHBondContact O-N 2.96Å; A256-I259 WeakPolarHBondContact O-CG1 3.14Å; A256-I259 PolarHBondContact O-N 2.91Å; E257-I259 VanDerWaalsContact C-N 3.26Å; E257-I259 PolarHBondContact O-N 2.78Å; I259-A261 VanDerWaalsContact C-N 3.32Å; I259-A261 HydrophobicContact CD1-CB 3.94Å; I259-A261 HydrophobicContact CG1-CB 3.73Å; I259-A261 PolarHBondContact O-N 2.67Å; I259-V264 HydrophobicContact CD1-CG2 4.3Å; I259-V335 HydrophobicContact CD1-CG1 3.69Å; I259-V335 HydrophobicContact CD1-CG2 4.11Å; I259-M337 VanDerWaalsContact O-CE 3.23Å; I259-M337 WeakPolarHBondContact O-CE 3.12Å; I259-N350 HydrophobicContact CG2-CB 3.6Å
260	E	92.3	Very high	93.9	Very high	147 Å²	147	46.1 Å²	46.1	69%	0.687	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.3	37.5	-177.4	-57.1	-175.2	163.6	0	0	114.3	A256 E257 M337	A256-E260 PolarHBondContact O-N 2.57Å; E257-E260 PolarHBondContact O-N 2.81Å; E260-M337 WeakPolarHBondContact O-CE 3.32Å
261	A	93.6	Very high	93.9	Very high	5 Å²	5	40.3 Å²	40.3	4%	0.041	20%	0.195	C	C	.	.			trans	-78.8	140	-179	0	0	0	0	0	113.7	A256 I259 V264 V335 M337	A256-A261 PolarHBondContact O-N 3.41Å; I259-A261 VanDerWaalsContact C-N 3.32Å; I259-A261 HydrophobicContact CD1-CB 3.94Å; I259-A261 HydrophobicContact CG1-CB 3.73Å; I259-A261 PolarHBondContact O-N 2.67Å; A261-V264 HydrophobicContact CB-CG2 3.62Å; A261-V335 HydrophobicContact CB-CG1 3.91Å; A261-M337 HydrophobicContact CB-SD 3.72Å
262	D	93.3	Very high	94	Very high	15 Å²	15	39.1 Å²	39.1	8%	0.08	19%	0.188	C	C	.	.	S	Bend	trans	-69.1	-36	171.5	-73.2	-81.2	0	0	0	112	C280 K281 V336 S338	D262-C280 WeakPolarHBondContact O-CB 3.32Å; D262-C280 PolarHBondContact O-N 3.4Å; D262-K281 IonicContact OD1-NZ 2.67Å; D262-K281 PolarHBondContact OD1-NZ 2.65Å; D262-V336 PolarHBondContact N-O 2.81Å; D262-S338 PolarHBondContact OD1-OG 2.99Å; D262-S338 WeakPolarHBondContact OD2-CB 3.2Å; D262-S338 PolarHBondContact OD2-N 2.69Å; D262-S338 PolarHBondContact OD2-OG 2.84Å
263	E	94.9	Very high	94	Very high	10 Å²	10	39.2 Å²	39.2	5%	0.047	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	137.9	-178.7	171.8	156.3	-130.7	0	0	111.1	L265 Y278 R288 F289 V336	E263-L265 HydrophobicContact CG-CD2 3.77Å; E263-L265 HydrophobicContact CG-CG 4.15Å; E263-Y278 CarbonylContact C-O 3.57Å; E263-Y278 VanDerWaalsContact CA-O 3.31Å; E263-Y278 WeakPolarHBondContact CA-O 3.4Å; E263-R288 VanDerWaalsContact CD-NE 3.34Å; E263-R288 IonicContact OE1-CZ 2.7Å; E263-R288 IonicContact OE1-NE 3.84Å; E263-R288 PolarHBondContact OE1-NE 3.05Å; E263-R288 IonicContact OE1-NH2 2.65Å; E263-R288 PolarHBondContact OE1-NH2 3.05Å; E263-R288 IonicContact OE2-CZ 2.74Å; E263-R288 IonicContact OE2-NE 3.43Å; E263-R288 PolarHBondContact OE2-NE 3.31Å; E263-R288 IonicContact OE2-NH2 3.14Å; E263-F289 WeakPolarHBondContact OE1-CE1 3.44Å; E263-V336 HydrophobicContact CB-CB 4.18Å; E263-V336 HydrophobicContact CB-CG2 4.36Å; E263-V336 PolarHBondContact O-N 3.34Å
264	V	96.4	Very high	94	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	125.9	173.8	-176.9	0	0	0	0	109.5	L252 F255 A256 I259 A261 H277 Y278 V333 M334 V335	L252-V264 HydrophobicContact CD1-CG1 3.74Å; L252-V264 HydrophobicContact CG-CG1 4.15Å; F255-V264 HydrophobicContact CD1-CG1 4.18Å; F255-V264 HydrophobicContact CE1-CG1 4.15Å; A256-V264 HydrophobicContact CB-CB 4.23Å; A256-V264 HydrophobicContact CB-CG2 3.55Å; I259-V264 HydrophobicContact CD1-CG2 4.3Å; A261-V264 HydrophobicContact CB-CG2 3.62Å; V264-H277 CarbonylContact O-C 3.51Å; V264-H277 VanDerWaalsContact O-CA 3.28Å; V264-H277 WeakPolarHBondContact O-CA 3.41Å; V264-Y278 PolarHBondContact N-O 2.85Å; V264-Y278 PolarHBondContact O-N 2.84Å; V264-V333 HydrophobicContact CG1-CG2 3.68Å; V264-M334 CarbonylContact C-O 3.52Å; V264-M334 VanDerWaalsContact CA-O 3.32Å; V264-M334 WeakPolarHBondContact CA-O 3.34Å; V264-V335 HydrophobicContact CG1-CG2 4.27Å; V264-V335 HydrophobicContact CG2-CG1 4.4Å; V264-V335 HydrophobicContact CG2-CG2 4.33Å
265	L	96.1	Very high	93.8	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	138	-179.8	-48.2	-178.7	0	0	0	110.3	E263 F267 H277 F289 I292 V333 M334	E263-L265 HydrophobicContact CG-CD2 3.77Å; E263-L265 HydrophobicContact CG-CG 4.15Å; L265-F267 HydrophobicContact CB-CD2 4.39Å; L265-F267 HydrophobicContact CB-CE2 3.56Å; L265-F267 HydrophobicContact CB-CZ 3.69Å; L265-F267 HydrophobicContact CD1-CE2 4.27Å; L265-F267 HydrophobicContact CD1-CZ 3.69Å; L265-F267 HydrophobicContact CG-CZ 4.35Å; L265-H277 HydrophobicContact CD2-CB 3.58Å; L265-F289 HydrophobicContact CD1-CD1 4.2Å; L265-F289 HydrophobicContact CD2-CD1 3.56Å; L265-F289 HydrophobicContact CD2-CE1 3.59Å; L265-I292 HydrophobicContact CD1-CD1 3.8Å; L265-V333 CarbonylContact O-C 3.48Å; L265-V333 WeakPolarHBondContact O-CA 3.16Å; L265-M334 HydrophobicContact CB-CB 4.22Å; L265-M334 HydrophobicContact CD1-SD 4.28Å; L265-M334 PolarHBondContact N-O 3.29Å; L265-M334 PolarHBondContact O-N 3.02Å
266	L	95.4	Very high	93.7	Very high	3 Å²	3	29.4 Å²	29.4	2%	0.016	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	125	175.4	-171.3	72.7	0	0	0	109.8	L248 L252 I275 S276 F327 T331	L248-L266 HydrophobicContact CD1-CD2 3.84Å; L248-L266 HydrophobicContact CD2-CD2 3.83Å; L248-L266 HydrophobicContact CG-CD2 3.96Å; L252-L266 HydrophobicContact CD1-CB 4.34Å; L252-L266 HydrophobicContact CD2-CB 4.15Å; L266-I275 HydrophobicContact CD2-CB 4.38Å; L266-I275 HydrophobicContact CD2-CD1 4.35Å; L266-I275 HydrophobicContact CD2-CG2 4.15Å; L266-I275 HydrophobicContact CG-CB 4.46Å; L266-I275 HydrophobicContact CG-CD1 4.14Å; L266-I275 PolarHBondContact O-N 3.4Å; L266-S276 PolarHBondContact N-O 3.01Å; L266-F327 HydrophobicContact CD1-CD1 3.66Å; L266-F327 HydrophobicContact CD1-CE1 4.26Å; L266-T331 HydrophobicContact CD1-CG2 4.15Å; L266-T331 HydrophobicContact CG-CG2 4.28Å
267	F	95.4	Very high	93.6	Very high	1 Å²	1	32.7 Å²	32.7	0%	0.004	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	147.5	-177.2	-53.1	-93.4	0	0	0	111.7	L265 F272 L273 V274 I275 I292 T331 Y332 M334	L265-F267 HydrophobicContact CB-CD2 4.39Å; L265-F267 HydrophobicContact CB-CE2 3.56Å; L265-F267 HydrophobicContact CB-CZ 3.69Å; L265-F267 HydrophobicContact CD1-CE2 4.27Å; L265-F267 HydrophobicContact CD1-CZ 3.69Å; L265-F267 HydrophobicContact CG-CZ 4.35Å; F267-F272 HydrophobicContact CB-CD1 4.02Å; F267-F272 HydrophobicContact CB-CE1 4.27Å; F267-F272 HydrophobicContact CD1-CD1 4.12Å; F267-F272 HydrophobicContact CD2-CE1 4.35Å; F267-F272 HydrophobicContact CG-CD1 4Å; F267-F272 HydrophobicContact CG-CE1 4.23Å; F267-L273 CarbonylContact C-O 3.5Å; F267-L273 VanDerWaalsContact CA-O 3.27Å; F267-L273 WeakPolarHBondContact CA-O 3.31Å; F267-V274 HydrophobicContact CD1-CB 4.49Å; F267-V274 HydrophobicContact CD1-CG2 3.75Å; F267-V274 HydrophobicContact CE1-CG2 3.55Å; F267-I275 VanDerWaalsContact C-CD1 3.41Å; F267-I292 HydrophobicContact CE1-CG2 4.14Å; F267-I292 HydrophobicContact CE2-CG2 4.48Å; F267-I292 HydrophobicContact CZ-CB 4.44Å; F267-I292 HydrophobicContact CZ-CG2 3.62Å; F267-T331 CarbonylContact O-C 3.55Å; F267-T331 WeakPolarHBondContact O-CA 3.4Å; F267-T331 WeakPolarHBondContact O-CB 3.46Å; F267-Y332 PolarHBondContact N-O 3.21Å; F267-Y332 PolarHBondContact O-N 3.33Å; F267-M334 HydrophobicContact CE2-CB 3.77Å
268	E	93.3	Very high	93.7	Very high	9 Å²	9	29.6 Å²	29.6	4%	0.042	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	134.8	170.9	-170.6	-77.1	129.4	0	0	110.4	F113 A270 T271 F272 L273 I275	F113-E268 HydrophobicContact CD1-CG 4.12Å; F113-E268 HydrophobicContact CD2-CB 4.33Å; F113-E268 HydrophobicContact CD2-CG 3.74Å; F113-E268 HydrophobicContact CE1-CB 3.85Å; F113-E268 HydrophobicContact CE1-CG 3.9Å; F113-E268 HydrophobicContact CE2-CB 3.59Å; F113-E268 HydrophobicContact CE2-CG 3.51Å; F113-E268 HydrophobicContact CG-CG 4.04Å; F113-E268 HydrophobicContact CZ-CB 3.3Å; F113-E268 HydrophobicContact CZ-CG 3.59Å; E268-A270 VanDerWaalsContact CD-N 3.29Å; E268-A270 PolarHBondContact O-N 3.44Å; E268-A270 WeakPolarHBondContact OE1-CB 3.38Å; E268-A270 PolarHBondContact OE1-N 3.31Å; E268-A270 PolarHBondContact OE2-N 2.96Å; E268-T271 VanDerWaalsContact OE2-CB 3.29Å; E268-T271 WeakPolarHBondContact OE2-CB 3.21Å; E268-T271 WeakPolarHBondContact OE2-CG2 3.47Å; E268-T271 PolarHBondContact OE2-N 3.47Å; E268-T271 PolarHBondContact OE2-OG1 3.05Å; E268-F272 VanDerWaalsContact O-CA 3.23Å; E268-F272 WeakPolarHBondContact O-CA 3.48Å; E268-F272 PolarHBondContact O-N 3.2Å; E268-L273 PolarHBondContact N-O 2.92Å; E268-I275 HydrophobicContact CB-CD1 3.94Å; E268-I275 HydrophobicContact CB-CG1 4.24Å; E268-I275 VanDerWaalsContact N-CD1 3.33Å
269	R	92.4	Very high	93.7	Very high	104 Å²	104	26.5 Å²	26.5	39%	0.392	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-33.6	-164.1	-176.5	-179.1	179.5	-155.2	-1.7	114.9	K300 S329 N330 Y332	R269-K300 PolarHBondContact O-NZ 3.32Å; R269-S329 WeakPolarHBondContact CD-O 3.47Å; R269-S329 PolarHBondContact NH1-O 3.33Å; R269-N330 VanDerWaalsContact CB-C 3.45Å; R269-N330 VanDerWaalsContact CB-O 3.28Å; R269-N330 WeakPolarHBondContact CB-O 3.38Å; R269-N330 PolarHBondContact N-O 3.35Å; R269-Y332 HydrophobicContact CB-CD2 4.26Å; R269-Y332 HydrophobicContact CG-CD2 3.92Å; R269-Y332 HydrophobicContact CG-CE2 3.86Å
270	A	90.4	Very high	93.4	Very high	50 Å²	50	29.5 Å²	29.5	41%	0.413	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-55.9	-179.7	0	0	0	0	0	111.7	E268 K297 K300	E268-A270 VanDerWaalsContact CD-N 3.29Å; E268-A270 PolarHBondContact O-N 3.44Å; E268-A270 WeakPolarHBondContact OE1-CB 3.38Å; E268-A270 PolarHBondContact OE1-N 3.31Å; E268-A270 PolarHBondContact OE2-N 2.96Å; A270-K297 PolarHBondContact O-NZ 3.48Å; A270-K300 PolarHBondContact O-NZ 2.95Å
271	T	92	Very high	92.8	Very high	2 Å²	2	27.9 Å²	27.9	1%	0.012	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-31.8	-173.3	60.6	0	0	0	0	113.6	I60 F61 F113 E268 L273 K297	I60-T271 HydrophobicContact CG2-CG2 4.06Å; F61-T271 HydrophobicContact CD1-CG2 3.58Å; F61-T271 HydrophobicContact CE1-CG2 3.79Å; F113-T271 HydrophobicContact CE2-CG2 4.33Å; E268-T271 VanDerWaalsContact OE2-CB 3.29Å; E268-T271 WeakPolarHBondContact OE2-CB 3.21Å; E268-T271 WeakPolarHBondContact OE2-CG2 3.47Å; E268-T271 PolarHBondContact OE2-N 3.47Å; E268-T271 PolarHBondContact OE2-OG1 3.05Å; T271-L273 PolarHBondContact OG1-N 3.44Å; T271-K297 PolarHBondContact O-NZ 3.11Å
272	F	94.8	Very high	92.3	Very high	1 Å²	1	36 Å²	36	0%	0.004	18%	0.179	C	C	.	.			trans	63.7	19.1	-164.9	-101.1	-92.3	0	0	0	115.2	F267 E268 S293 I296 K300 F310 Y332	F267-F272 HydrophobicContact CB-CD1 4.02Å; F267-F272 HydrophobicContact CB-CE1 4.27Å; F267-F272 HydrophobicContact CD1-CD1 4.12Å; F267-F272 HydrophobicContact CD2-CE1 4.35Å; F267-F272 HydrophobicContact CG-CD1 4Å; F267-F272 HydrophobicContact CG-CE1 4.23Å; E268-F272 VanDerWaalsContact O-CA 3.23Å; E268-F272 WeakPolarHBondContact O-CA 3.48Å; E268-F272 PolarHBondContact O-N 3.2Å; F272-S293 WeakPolarHBondContact O-CB 3.28Å; F272-S293 PolarHBondContact O-OG 3.02Å; F272-I296 HydrophobicContact CD1-CB 4.09Å; F272-I296 HydrophobicContact CD1-CG2 3.88Å; F272-I296 HydrophobicContact CE1-CB 3.97Å; F272-I296 HydrophobicContact CE1-CG2 3.36Å; F272-I296 HydrophobicContact CE2-CG2 4.15Å; F272-I296 HydrophobicContact CG-CG2 4.47Å; F272-I296 HydrophobicContact CZ-CG2 3.5Å; F272-I296 VanDerWaalsContact CZ-CG2 3.5Å; F272-K300 HydrophobicContact CD2-CD 4.12Å; F272-K300 HydrophobicContact CE2-CD 4.09Å; F272-F310 HydrophobicContact CZ-CD1 4.47Å; F272-F310 HydrophobicContact CZ-CE1 4.32Å; F272-Y332 HydrophobicContact CE1-CD2 4.49Å; F272-Y332 HydrophobicContact CE1-CG 4.2Å; F272-Y332 AromaticContact CE2-CD2 3.49Å; F272-Y332 HydrophobicContact CE2-CD2 3.49Å; F272-Y332 VanDerWaalsContact CE2-CD2 3.49Å; F272-Y332 AromaticContact CE2-CE2 3.63Å; F272-Y332 HydrophobicContact CE2-CE2 3.63Å; F272-Y332 AromaticContact CE2-CG 3.99Å; F272-Y332 HydrophobicContact CE2-CG 3.99Å; F272-Y332 AromaticContact CZ-CD1 3.77Å; F272-Y332 HydrophobicContact CZ-CD1 3.77Å; F272-Y332 AromaticContact CZ-CD2 3.44Å; F272-Y332 HydrophobicContact CZ-CD2 3.44Å; F272-Y332 VanDerWaalsContact CZ-CD2 3.44Å; F272-Y332 HydrophobicContact CZ-CE1 4.11Å; F272-Y332 AromaticContact CZ-CE2 3.81Å; F272-Y332 HydrophobicContact CZ-CE2 3.81Å; F272-Y332 AromaticContact CZ-CG 3.41Å; F272-Y332 HydrophobicContact CZ-CG 3.41Å; F272-Y332 VanDerWaalsContact CZ-CG 3.41Å
273	L	94.9	Very high	92	Very high	1 Å²	1	38.9 Å²	38.9	1%	0.005	19%	0.191	C	C	.	.			trans	-65.6	145.6	167.4	-66.1	175	0	0	0	110.9	I60 F113 Y231 W234 S235 V238 F267 E268 T271	I60-L273 HydrophobicContact CD1-CD2 4.35Å; I60-L273 HydrophobicContact CG2-CD1 3.93Å; I60-L273 HydrophobicContact CG2-CD2 4.4Å; I60-L273 HydrophobicContact CG2-CG 4.25Å; F113-L273 HydrophobicContact CE2-CD1 4.21Å; F113-L273 HydrophobicContact CZ-CB 4.44Å; Y231-L273 HydrophobicContact CD1-CD2 4.07Å; W234-L273 HydrophobicContact CB-CD1 4.07Å; W234-L273 HydrophobicContact CB-CD2 3.75Å; S235-L273 WeakPolarHBondContact OG-CD2 3.22Å; V238-L273 HydrophobicContact CG2-CD1 4.06Å; F267-L273 CarbonylContact C-O 3.5Å; F267-L273 VanDerWaalsContact CA-O 3.27Å; F267-L273 WeakPolarHBondContact CA-O 3.31Å; E268-L273 PolarHBondContact N-O 2.92Å; T271-L273 PolarHBondContact OG1-N 3.44Å
274	V	94.6	Very high	91.6	Very high	18 Å²	18	50.8 Å²	50.8	11%	0.109	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	130.5	177.9	-178	0	0	0	0	108.9	S235 F267 F289	S235-V274 PolarHBondContact OG-N 3.04Å; F267-V274 HydrophobicContact CD1-CB 4.49Å; F267-V274 HydrophobicContact CD1-CG2 3.75Å; F267-V274 HydrophobicContact CE1-CG2 3.55Å; V274-F289 HydrophobicContact CG2-CB 3.88Å
275	I	91.9	Very high	91.3	Very high	1 Å²	1	53.5 Å²	53.5	1%	0.005	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	-45.3	178.7	-65.4	153.8	0	0	0	111.2	F113 L114 Y239 I242 L248 L266 F267 E268 T331	F113-I275 HydrophobicContact CE1-CG1 4.2Å; F113-I275 HydrophobicContact CZ-CG1 4.45Å; L114-I275 HydrophobicContact CD1-CD1 4.35Å; L114-I275 HydrophobicContact CD1-CG1 4.42Å; L114-I275 HydrophobicContact CD1-CG2 4.2Å; L114-I275 HydrophobicContact CD2-CD1 3.65Å; L114-I275 HydrophobicContact CG-CD1 4.2Å; Y239-I275 VanDerWaalsContact CD2-O 3.24Å; Y239-I275 WeakPolarHBondContact CD2-O 3.47Å; Y239-I275 WeakPolarHBondContact CE2-O 3.29Å; I242-I275 HydrophobicContact CD1-CB 4.45Å; I242-I275 HydrophobicContact CD1-CG1 4.36Å; I242-I275 HydrophobicContact CD1-CG2 3.88Å; L248-I275 HydrophobicContact CD2-CG2 3.43Å; L248-I275 VanDerWaalsContact CD2-CG2 3.43Å; L266-I275 HydrophobicContact CD2-CB 4.38Å; L266-I275 HydrophobicContact CD2-CD1 4.35Å; L266-I275 HydrophobicContact CD2-CG2 4.15Å; L266-I275 HydrophobicContact CG-CB 4.46Å; L266-I275 HydrophobicContact CG-CD1 4.14Å; L266-I275 PolarHBondContact O-N 3.4Å; F267-I275 VanDerWaalsContact C-CD1 3.41Å; E268-I275 HydrophobicContact CB-CD1 3.94Å; E268-I275 HydrophobicContact CB-CG1 4.24Å; E268-I275 VanDerWaalsContact N-CD1 3.33Å; I275-T331 HydrophobicContact CD1-CG2 3.72Å
276	S	92	Very high	91	Very high	1 Å²	1	56.6 Å²	56.6	1%	0.007	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.7	153	-169.8	-179.6	0	0	0	0	108.5	L252 L266	L252-S276 WeakPolarHBondContact CD2-OG 3.49Å; L266-S276 PolarHBondContact N-O 3.01Å
277	H	93.6	Very high	90.8	Very high	71 Å²	71	60.1 Å²	60.1	33%	0.329	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	158	176.5	67	-71.5	0	0	0	111.4	V264 L265 F289	V264-H277 CarbonylContact O-C 3.51Å; V264-H277 VanDerWaalsContact O-CA 3.28Å; V264-H277 WeakPolarHBondContact O-CA 3.41Å; L265-H277 HydrophobicContact CD2-CB 3.58Å; H277-F289 HydrophobicContact CB-CE1 4.06Å; H277-F289 AromaticContact CD2-CE1 3.66Å; H277-F289 AromaticContact CD2-CZ 3.49Å; H277-F289 VanDerWaalsContact CD2-CZ 3.49Å; H277-F289 WeakPolarHBondContact CD2-CZ 3.23Å; H277-F289 AromaticContact CG-CE1 3.87Å; H277-F289 AromaticContact NE2-CZ 3.73Å
278	Y	94.5	Very high	90.7	Very high	37 Å²	37	61.4 Å²	61.4	15%	0.145	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	140.5	164.9	170	-89.6	0	0	0	108.3	R253 A256 E263 V264 C280	R253-Y278 HydrophobicContact CB-CD2 3.87Å; R253-Y278 HydrophobicContact CB-CE2 4.3Å; R253-Y278 HydrophobicContact CG-CD2 3.8Å; R253-Y278 HydrophobicContact CG-CE2 3.71Å; A256-Y278 HydrophobicContact CB-CD1 3.21Å; A256-Y278 HydrophobicContact CB-CD2 4.47Å; A256-Y278 HydrophobicContact CB-CE1 3.59Å; A256-Y278 HydrophobicContact CB-CG 3.69Å; E263-Y278 CarbonylContact C-O 3.57Å; E263-Y278 VanDerWaalsContact CA-O 3.31Å; E263-Y278 WeakPolarHBondContact CA-O 3.4Å; V264-Y278 PolarHBondContact N-O 2.85Å; V264-Y278 PolarHBondContact O-N 2.84Å; Y278-C280 HydrophobicContact CE1-CB 3.94Å
279	Q	92.9	Very high	90.7	Very high	70 Å²	70	62.5 Å²	62.5	33%	0.327	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	126.6	172.9	57.6	-179.7	4.4	0	0	108.7
280	C	86.8	Confident	90.8	Very high	73 Å²	73	57.8 Å²	57.8	49%	0.493	28%	0.284	S	S	.	.	S	Bend	trans	-78.4	-33.8	173.9	178.1	0	0	0	0	111.1	D262 Y278	D262-C280 WeakPolarHBondContact O-CB 3.32Å; D262-C280 PolarHBondContact O-N 3.4Å; Y278-C280 HydrophobicContact CE1-CB 3.94Å
281	K	80.3	Confident	91	Very high	114 Å²	114	58.3 Å²	58.3	50%	0.496	28%	0.277	S	S	.	.	S	Bend	trans	-129.4	139.1	179.4	-61.2	163.7	-167.1	142.2	0	109	D262 Q283	D262-K281 IonicContact OD1-NZ 2.67Å; D262-K281 PolarHBondContact OD1-NZ 2.65Å; K281-Q283 PolarHBondContact O-N 3.32Å
282	E	83.1	Confident	91.2	Very high	176 Å²	176	59.7 Å²	59.7	82%	0.822	28%	0.284	S	S	*	.			trans	-67.9	126.5	175.1	-173.3	167.4	-149.4	0	0	110.3
283	Q	86.3	Confident	91.2	Very high	74 Å²	74	59.7 Å²	59.7	35%	0.346	28%	0.284	S	S	.	.			trans	-94	148.2	-176.4	-60.5	-66.9	-11.3	0	0	111.5	K281 D285	K281-Q283 PolarHBondContact O-N 3.32Å; Q283-D285 PolarHBondContact O-N 2.95Å; Q283-D285 VanDerWaalsContact O-N 3.12Å
284	R	86.1	Confident	91.2	Very high	261 Å²	261	60.9 Å²	60.9	99%	0.985	29%	0.291	S	S	*	.	S	Bend	trans	-59.4	-26	-177	-61.8	-177.9	-177.1	178.9	0.6	114.8
285	D	90.8	Very high	91.2	Very high	57 Å²	57	65.2 Å²	65.2	31%	0.305	31%	0.312	S	S	.	.			trans	-108.3	104.3	-178.6	-171.7	2.9	0	0	0	110.8	Q283 H287 R288 K291	Q283-D285 PolarHBondContact O-N 2.95Å; Q283-D285 VanDerWaalsContact O-N 3.12Å; D285-H287 PolarHBondContact O-N 3.03Å; D285-H287 WeakPolarHBondContact OD1-CA 3.32Å; D285-H287 WeakPolarHBondContact OD1-CB 3.27Å; D285-H287 PolarHBondContact OD1-N 2.95Å; D285-R288 HydrophobicContact CB-CB 4.27Å; D285-R288 WeakPolarHBondContact O-CD 3.49Å; D285-R288 WeakPolarHBondContact O-CG 3.17Å; D285-R288 PolarHBondContact O-N 3.17Å; D285-R288 PolarHBondContact O-NH1 3.39Å; D285-K291 VanDerWaalsContact CG-NZ 3.28Å; D285-K291 IonicContact OD1-NZ 3.9Å; D285-K291 PolarHBondContact OD1-NZ 2.86Å; D285-K291 VanDerWaalsContact OD1-NZ 3.11Å; D285-K291 IonicContact OD2-NZ 3.8Å; D285-K291 PolarHBondContact OD2-NZ 3.24Å
286	A	89.3	Confident	91.4	Very high	65 Å²	65	65.7 Å²	65.7	54%	0.537	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-4.7	173.6	0	0	0	0	0	113.6	K232	K232-A286 PolarHBondContact NZ-O 2.88Å
287	H	90.4	Very high	91.5	Very high	77 Å²	77	65.7 Å²	65.7	36%	0.356	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.7	10.7	178	-68.6	-77.1	0	0	0	113.6	K232 D285 F289 E290 K291	K232-H287 PolarHBondContact NZ-CE1 2.91Å; K232-H287 PolarHBondContact NZ-ND1 2.86Å; K232-H287 VanDerWaalsContact NZ-ND1 3.16Å; D285-H287 PolarHBondContact O-N 3.03Å; D285-H287 WeakPolarHBondContact OD1-CA 3.32Å; D285-H287 WeakPolarHBondContact OD1-CB 3.27Å; D285-H287 PolarHBondContact OD1-N 2.95Å; H287-F289 VanDerWaalsContact C-N 3.33Å; H287-F289 PolarHBondContact O-N 3.35Å; H287-E290 VanDerWaalsContact C-OE2 3.23Å; H287-E290 VanDerWaalsContact CA-CD 3.45Å; H287-E290 WeakPolarHBondContact CA-OE1 3.48Å; H287-E290 WeakPolarHBondContact CA-OE2 3.36Å; H287-E290 HydrophobicContact CB-CG 4.47Å; H287-E290 IonicContact CE1-OE1 2.7Å; H287-E290 IonicContact CG-OE1 2.83Å; H287-E290 IonicContact ND1-OE1 2.66Å; H287-E290 PolarHBondContact ND1-OE1 3.39Å; H287-E290 WeakPolarHBondContact O-CG 3.35Å; H287-K291 HydrophobicContact CB-CD 4.47Å; H287-K291 VanDerWaalsContact O-CD 3.32Å; H287-K291 WeakPolarHBondContact O-CD 3.41Å; H287-K291 WeakPolarHBondContact O-CG 3.45Å; H287-K291 PolarHBondContact O-N 3.21Å
288	R	93.9	Very high	91.4	Very high	28 Å²	28	65.7 Å²	65.7	11%	0.106	31%	0.314	C	S	.	.	H	α-helix	trans	-64.5	-33.5	-177.8	69.2	-169.7	-178.6	-79.6	1	113.8	E263 D285 K291 I292	E263-R288 VanDerWaalsContact CD-NE 3.34Å; E263-R288 IonicContact OE1-CZ 2.7Å; E263-R288 IonicContact OE1-NE 3.84Å; E263-R288 PolarHBondContact OE1-NE 3.05Å; E263-R288 IonicContact OE1-NH2 2.65Å; E263-R288 PolarHBondContact OE1-NH2 3.05Å; E263-R288 IonicContact OE2-CZ 2.74Å; E263-R288 IonicContact OE2-NE 3.43Å; E263-R288 PolarHBondContact OE2-NE 3.31Å; E263-R288 IonicContact OE2-NH2 3.14Å; D285-R288 HydrophobicContact CB-CB 4.27Å; D285-R288 WeakPolarHBondContact O-CD 3.49Å; D285-R288 WeakPolarHBondContact O-CG 3.17Å; D285-R288 PolarHBondContact O-N 3.17Å; D285-R288 PolarHBondContact O-NH1 3.39Å; R288-K291 PolarHBondContact O-N 3.03Å; R288-I292 WeakPolarHBondContact O-CB 3.48Å; R288-I292 WeakPolarHBondContact O-CD1 3.15Å; R288-I292 WeakPolarHBondContact O-CG1 3.34Å; R288-I292 PolarHBondContact O-N 3.09Å
289	F	94.1	Very high	91.4	Very high	31 Å²	31	68.3 Å²	68.3	14%	0.136	33%	0.327	C	S	.	.	H	α-helix	trans	-63.9	-51.6	-173.8	-49.2	-70.7	0	0	0	111.1	E263 L265 V274 H277 H287 I292 S293	E263-F289 WeakPolarHBondContact OE1-CE1 3.44Å; L265-F289 HydrophobicContact CD1-CD1 4.2Å; L265-F289 HydrophobicContact CD2-CD1 3.56Å; L265-F289 HydrophobicContact CD2-CE1 3.59Å; V274-F289 HydrophobicContact CG2-CB 3.88Å; H277-F289 HydrophobicContact CB-CE1 4.06Å; H277-F289 AromaticContact CD2-CE1 3.66Å; H277-F289 AromaticContact CD2-CZ 3.49Å; H277-F289 VanDerWaalsContact CD2-CZ 3.49Å; H277-F289 WeakPolarHBondContact CD2-CZ 3.23Å; H277-F289 AromaticContact CG-CE1 3.87Å; H277-F289 AromaticContact NE2-CZ 3.73Å; H287-F289 VanDerWaalsContact C-N 3.33Å; H287-F289 PolarHBondContact O-N 3.35Å; F289-I292 PolarHBondContact O-N 3.43Å; F289-S293 PolarHBondContact O-N 2.81Å; F289-S293 PolarHBondContact O-OG 3.4Å
290	E	93.6	Very high	91.4	Very high	5 Å²	5	66.8 Å²	66.8	2%	0.023	32%	0.319	C	S	.	.	H	α-helix	trans	-70.8	-31.4	179.9	59.2	-93.9	-126	0	0	112.5	E228 K232 H287 S293 N294	E228-E290 HydrophobicContact CB-CB 4Å; E228-E290 HydrophobicContact CB-CG 3.72Å; E228-E290 HydrophobicContact CG-CB 4.47Å; E228-E290 HydrophobicContact CG-CG 3.64Å; K232-E290 HydrophobicContact CB-CB 4.11Å; K232-E290 HydrophobicContact CB-CG 4.03Å; K232-E290 WeakPolarHBondContact CD-OE1 3.41Å; K232-E290 WeakPolarHBondContact CE-OE1 3.45Å; K232-E290 VanDerWaalsContact CG-OE1 3.25Å; K232-E290 WeakPolarHBondContact CG-OE1 3.49Å; K232-E290 IonicContact NZ-OE1 2.86Å; K232-E290 PolarHBondContact NZ-OE1 3.44Å; H287-E290 VanDerWaalsContact C-OE2 3.23Å; H287-E290 VanDerWaalsContact CA-CD 3.45Å; H287-E290 WeakPolarHBondContact CA-OE1 3.48Å; H287-E290 WeakPolarHBondContact CA-OE2 3.36Å; H287-E290 HydrophobicContact CB-CG 4.47Å; H287-E290 IonicContact CE1-OE1 2.7Å; H287-E290 IonicContact CG-OE1 2.83Å; H287-E290 IonicContact ND1-OE1 2.66Å; H287-E290 PolarHBondContact ND1-OE1 3.39Å; H287-E290 WeakPolarHBondContact O-CG 3.35Å; E290-S293 WeakPolarHBondContact O-CB 3.48Å; E290-S293 PolarHBondContact O-N 2.97Å; E290-N294 WeakPolarHBondContact O-CB 3.26Å; E290-N294 PolarHBondContact O-N 3.06Å
291	K	95.3	Very high	91.5	Very high	62 Å²	62	64 Å²	64	27%	0.27	30%	0.299	S	S	.	.	H	α-helix	trans	-62.7	-47	169.4	-72	167.3	-169.4	169.6	0	111.2	E228 D285 H287 R288 N294 I295	E228-K291 HydrophobicContact CB-CG 4.18Å; E228-K291 HydrophobicContact CG-CG 3.83Å; E228-K291 WeakPolarHBondContact OE1-CE 3.46Å; E228-K291 WeakPolarHBondContact OE1-CG 3.3Å; D285-K291 VanDerWaalsContact CG-NZ 3.28Å; D285-K291 IonicContact OD1-NZ 3.9Å; D285-K291 PolarHBondContact OD1-NZ 2.86Å; D285-K291 VanDerWaalsContact OD1-NZ 3.11Å; D285-K291 IonicContact OD2-NZ 3.8Å; D285-K291 PolarHBondContact OD2-NZ 3.24Å; H287-K291 HydrophobicContact CB-CD 4.47Å; H287-K291 VanDerWaalsContact O-CD 3.32Å; H287-K291 WeakPolarHBondContact O-CD 3.41Å; H287-K291 WeakPolarHBondContact O-CG 3.45Å; H287-K291 PolarHBondContact O-N 3.21Å; R288-K291 PolarHBondContact O-N 3.03Å; K291-N294 PolarHBondContact O-N 3.21Å; K291-I295 WeakPolarHBondContact O-CB 3.29Å; K291-I295 WeakPolarHBondContact O-CD1 3.46Å; K291-I295 WeakPolarHBondContact O-CG1 3.39Å; K291-I295 PolarHBondContact O-N 2.85Å
292	I	96	Very high	92.1	Very high	31 Å²	31	61.5 Å²	61.5	16%	0.159	30%	0.296	C	S	.	.	H	α-helix	trans	-61.4	-46.2	175.9	-68.6	160.6	0	0	0	110.4	L265 F267 R288 F289 N294 I295 I296 M334	L265-I292 HydrophobicContact CD1-CD1 3.8Å; F267-I292 HydrophobicContact CE1-CG2 4.14Å; F267-I292 HydrophobicContact CE2-CG2 4.48Å; F267-I292 HydrophobicContact CZ-CB 4.44Å; F267-I292 HydrophobicContact CZ-CG2 3.62Å; R288-I292 WeakPolarHBondContact O-CB 3.48Å; R288-I292 WeakPolarHBondContact O-CD1 3.15Å; R288-I292 WeakPolarHBondContact O-CG1 3.34Å; R288-I292 PolarHBondContact O-N 3.09Å; F289-I292 PolarHBondContact O-N 3.43Å; I292-N294 PolarHBondContact O-N 3.34Å; I292-I295 PolarHBondContact O-N 2.98Å; I292-I296 HydrophobicContact CG2-CG1 4.12Å; I292-I296 WeakPolarHBondContact O-CB 3.34Å; I292-I296 WeakPolarHBondContact O-CG1 3.45Å; I292-I296 PolarHBondContact O-N 2.63Å; I292-M334 HydrophobicContact CD1-CE 3.88Å; I292-M334 HydrophobicContact CD1-SD 4.07Å; I292-M334 HydrophobicContact CG2-SD 3.82Å
293	S	95.5	Very high	92.6	Very high	0 Å²	0	54 Å²	54	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-52.6	-50	173.5	-71.9	0	0	0	0	112.4	F272 F289 E290 K297	F272-S293 WeakPolarHBondContact O-CB 3.28Å; F272-S293 PolarHBondContact O-OG 3.02Å; F289-S293 PolarHBondContact O-N 2.81Å; F289-S293 PolarHBondContact O-OG 3.4Å; E290-S293 WeakPolarHBondContact O-CB 3.48Å; E290-S293 PolarHBondContact O-N 2.97Å; S293-K297 WeakPolarHBondContact O-CB 3.33Å; S293-K297 PolarHBondContact O-N 3.37Å
294	N	93.8	Very high	92.7	Very high	27 Å²	27	53.8 Å²	53.8	14%	0.144	27%	0.269	C	S	.	.	H	α-helix	trans	-65.3	-50.5	179.9	-167.8	9.7	0	0	0	111.3	Y231 E290 K291 I292 I296 K297 Q298	Y231-N294 HydrophobicContact CD2-CB 3.96Å; Y231-N294 HydrophobicContact CE2-CB 3.91Å; E290-N294 WeakPolarHBondContact O-CB 3.26Å; E290-N294 PolarHBondContact O-N 3.06Å; K291-N294 PolarHBondContact O-N 3.21Å; I292-N294 PolarHBondContact O-N 3.34Å; N294-I296 PolarHBondContact O-N 3.22Å; N294-K297 WeakPolarHBondContact O-CB 3.45Å; N294-K297 PolarHBondContact O-N 2.96Å; N294-Q298 WeakPolarHBondContact O-CG 3.28Å; N294-Q298 PolarHBondContact O-N 2.93Å; N294-Q298 PolarHBondContact OD1-NE2 2.78Å; N294-Q298 VanDerWaalsContact OD1-NE2 3.12Å
295	I	95.6	Very high	92.9	Very high	109 Å²	109	48.6 Å²	48.6	56%	0.559	25%	0.254	S	S	*	.	H	α-helix	trans	-56.7	-50.8	-179.6	-69.7	164.2	0	0	0	111.3	K291 I292 Q298 F299	K291-I295 WeakPolarHBondContact O-CB 3.29Å; K291-I295 WeakPolarHBondContact O-CD1 3.46Å; K291-I295 WeakPolarHBondContact O-CG1 3.39Å; K291-I295 PolarHBondContact O-N 2.85Å; I292-I295 PolarHBondContact O-N 2.98Å; I295-Q298 PolarHBondContact O-N 2.92Å; I295-F299 WeakPolarHBondContact O-CB 3.32Å; I295-F299 PolarHBondContact O-N 2.88Å
296	I	95.5	Very high	92.9	Very high	11 Å²	11	52.7 Å²	52.7	6%	0.056	28%	0.275	C	S	.	.	H	α-helix	trans	-71.5	-31.6	-178	-57.1	-62.9	0	0	0	111.3	F272 I292 N294 F299 K300 F310 M313 I324	F272-I296 HydrophobicContact CD1-CB 4.09Å; F272-I296 HydrophobicContact CD1-CG2 3.88Å; F272-I296 HydrophobicContact CE1-CB 3.97Å; F272-I296 HydrophobicContact CE1-CG2 3.36Å; F272-I296 HydrophobicContact CE2-CG2 4.15Å; F272-I296 HydrophobicContact CG-CG2 4.47Å; F272-I296 HydrophobicContact CZ-CG2 3.5Å; F272-I296 VanDerWaalsContact CZ-CG2 3.5Å; I292-I296 HydrophobicContact CG2-CG1 4.12Å; I292-I296 WeakPolarHBondContact O-CB 3.34Å; I292-I296 WeakPolarHBondContact O-CG1 3.45Å; I292-I296 PolarHBondContact O-N 2.63Å; N294-I296 PolarHBondContact O-N 3.22Å; I296-F299 PolarHBondContact O-N 2.77Å; I296-K300 VanDerWaalsContact O-CB 3.22Å; I296-K300 WeakPolarHBondContact O-CB 3.33Å; I296-K300 PolarHBondContact O-N 2.8Å; I296-F310 HydrophobicContact CG2-CD1 4.28Å; I296-F310 HydrophobicContact CG2-CE1 3.83Å; I296-M313 HydrophobicContact CD1-CE 4.33Å; I296-M313 HydrophobicContact CD1-SD 4.45Å; I296-I324 HydrophobicContact CD1-CD1 3.59Å; I296-I324 HydrophobicContact CG1-CD1 3.95Å
297	K	93.1	Very high	93.1	Very high	1 Å²	1	54.5 Å²	54.5	0%	0.004	29%	0.29	C	S	.	.	H	α-helix	trans	-60.9	-52.5	168.4	-175.2	81.5	156.4	-168.8	0	111	I60 N63 A270 T271 S293 N294 F299 K300 L301	I60-K297 PolarHBondContact O-NZ 3.24Å; N63-K297 WeakPolarHBondContact OD1-CE 3.42Å; N63-K297 PolarHBondContact OD1-NZ 3Å; A270-K297 PolarHBondContact O-NZ 3.48Å; T271-K297 PolarHBondContact O-NZ 3.11Å; S293-K297 WeakPolarHBondContact O-CB 3.33Å; S293-K297 PolarHBondContact O-N 3.37Å; N294-K297 WeakPolarHBondContact O-CB 3.45Å; N294-K297 PolarHBondContact O-N 2.96Å; K297-F299 VanDerWaalsContact C-N 3.27Å; K297-F299 PolarHBondContact O-N 2.82Å; K297-K300 PolarHBondContact O-N 2.84Å; K297-K300 VanDerWaalsContact O-N 3.16Å; K297-L301 HydrophobicContact CG-CD1 4.3Å; K297-L301 HydrophobicContact CG-CG 4.44Å; K297-L301 VanDerWaalsContact O-CG 3.28Å; K297-L301 WeakPolarHBondContact O-CG 3.33Å; K297-L301 PolarHBondContact O-N 2.81Å
298	Q	91.8	Very high	93.1	Very high	71 Å²	71	53.1 Å²	53.1	33%	0.332	29%	0.292	S	S	.	.	H	α-helix	trans	-59.9	-37.6	178.9	-60.7	-49.8	-31.3	0	0	112.2	N294 I295 L301 S302	N294-Q298 WeakPolarHBondContact O-CG 3.28Å; N294-Q298 PolarHBondContact O-N 2.93Å; N294-Q298 PolarHBondContact OD1-NE2 2.78Å; N294-Q298 VanDerWaalsContact OD1-NE2 3.12Å; I295-Q298 PolarHBondContact O-N 2.92Å; Q298-L301 PolarHBondContact O-N 3.37Å; Q298-S302 WeakPolarHBondContact O-CB 3.42Å; Q298-S302 PolarHBondContact O-N 3.19Å; Q298-S302 PolarHBondContact O-OG 3.24Å
299	F	94.8	Very high	92.9	Very high	92 Å²	92	57 Å²	57	40%	0.404	32%	0.323	S	S	.	.	H	α-helix	trans	-63.5	-49.6	173.9	-174.8	-108.1	0	0	0	111.6	I295 I296 K297 L301 S302 C303 F310 M313	I295-F299 WeakPolarHBondContact O-CB 3.32Å; I295-F299 PolarHBondContact O-N 2.88Å; I296-F299 PolarHBondContact O-N 2.77Å; K297-F299 VanDerWaalsContact C-N 3.27Å; K297-F299 PolarHBondContact O-N 2.82Å; F299-L301 VanDerWaalsContact C-N 3.33Å; F299-L301 PolarHBondContact O-N 3.07Å; F299-S302 CarbonylContact O-C 3.55Å; F299-S302 WeakPolarHBondContact O-CA 3.25Å; F299-S302 VanDerWaalsContact O-CB 3.31Å; F299-S302 WeakPolarHBondContact O-CB 3.25Å; F299-S302 PolarHBondContact O-N 3.29Å; F299-C303 PolarHBondContact O-N 2.53Å; F299-C303 PolarHBondContact O-SG 3.33Å; F299-C303 VanDerWaalsContact O-SG 3.33Å; F299-F310 AromaticContact CD1-CD2 3.98Å; F299-F310 HydrophobicContact CD1-CD2 3.98Å; F299-F310 HydrophobicContact CD1-CE2 4.14Å; F299-F310 AromaticContact CE1-CD2 3.67Å; F299-F310 HydrophobicContact CE1-CD2 3.67Å; F299-F310 AromaticContact CE1-CE2 3.81Å; F299-F310 HydrophobicContact CE1-CE2 3.81Å; F299-M313 HydrophobicContact CD1-CE 3.63Å; F299-M313 HydrophobicContact CE1-CE 3.43Å; F299-M313 VanDerWaalsContact CE1-CE 3.43Å; F299-M313 HydrophobicContact CE2-CE 4.48Å; F299-M313 HydrophobicContact CG-CE 4.25Å; F299-M313 HydrophobicContact CZ-CE 3.91Å
300	K	92.4	Very high	92.9	Very high	37 Å²	37	56.4 Å²	56.4	16%	0.161	32%	0.321	C	S	.	.	H	α-helix	trans	-60.2	-37.9	176.6	-178.9	-175	171.8	-164.8	0	112.7	R269 A270 F272 I296 K297 S302 C303 S304 F310	R269-K300 PolarHBondContact O-NZ 3.32Å; A270-K300 PolarHBondContact O-NZ 2.95Å; F272-K300 HydrophobicContact CD2-CD 4.12Å; F272-K300 HydrophobicContact CE2-CD 4.09Å; I296-K300 VanDerWaalsContact O-CB 3.22Å; I296-K300 WeakPolarHBondContact O-CB 3.33Å; I296-K300 PolarHBondContact O-N 2.8Å; K297-K300 PolarHBondContact O-N 2.84Å; K297-K300 VanDerWaalsContact O-N 3.16Å; K300-S302 VanDerWaalsContact C-N 3.3Å; K300-C303 PolarHBondContact O-N 3.06Å; K300-S304 WeakPolarHBondContact O-CB 3.46Å; K300-S304 PolarHBondContact O-N 2.73Å; K300-S304 PolarHBondContact O-OG 3.24Å; K300-F310 HydrophobicContact CB-CB 4.34Å; K300-F310 HydrophobicContact CG-CB 4.2Å
301	L	90.4	Very high	92.8	Very high	16 Å²	16	62 Å²	62	8%	0.084	35%	0.347	C	S	.	.	H	α-helix	trans	-65.4	-34.1	172	-65.1	179.7	0	0	0	111.9	N63 I65 K297 Q298 F299 S304 K305	N63-L301 HydrophobicContact CB-CD2 3.61Å; N63-L301 WeakPolarHBondContact O-CD2 3.45Å; I65-L301 HydrophobicContact CG2-CD1 3.71Å; K297-L301 HydrophobicContact CG-CD1 4.3Å; K297-L301 HydrophobicContact CG-CG 4.44Å; K297-L301 VanDerWaalsContact O-CG 3.28Å; K297-L301 WeakPolarHBondContact O-CG 3.33Å; K297-L301 PolarHBondContact O-N 2.81Å; Q298-L301 PolarHBondContact O-N 3.37Å; F299-L301 VanDerWaalsContact C-N 3.33Å; F299-L301 PolarHBondContact O-N 3.07Å; L301-S304 PolarHBondContact O-N 2.83Å; L301-K305 PolarHBondContact O-N 2.83Å
302	S	92.9	Very high	92.8	Very high	60 Å²	60	62.4 Å²	62.4	42%	0.42	36%	0.357	S	S	.	.	H	α-helix	trans	-72	-42.6	175.7	-57.1	0	0	0	0	112.1	Q298 F299 K300 S304 K305	Q298-S302 WeakPolarHBondContact O-CB 3.42Å; Q298-S302 PolarHBondContact O-N 3.19Å; Q298-S302 PolarHBondContact O-OG 3.24Å; F299-S302 CarbonylContact O-C 3.55Å; F299-S302 WeakPolarHBondContact O-CA 3.25Å; F299-S302 VanDerWaalsContact O-CB 3.31Å; F299-S302 WeakPolarHBondContact O-CB 3.25Å; F299-S302 PolarHBondContact O-N 3.29Å; K300-S302 VanDerWaalsContact C-N 3.3Å; S302-S304 VanDerWaalsContact C-N 3.26Å; S302-S304 PolarHBondContact O-N 3.36Å; S302-K305 PolarHBondContact O-N 2.86Å
303	C	92.6	Very high	92.8	Very high	20 Å²	20	63.4 Å²	63.4	14%	0.135	36%	0.362	C	S	.	.	H	α-helix	trans	-57.3	-41.2	170.4	-58.7	0	0	0	0	111.7	F299 K300 K305 L306 A307 A308	F299-C303 PolarHBondContact O-N 2.53Å; F299-C303 PolarHBondContact O-SG 3.33Å; F299-C303 VanDerWaalsContact O-SG 3.33Å; K300-C303 PolarHBondContact O-N 3.06Å; C303-K305 VanDerWaalsContact C-N 3.25Å; C303-K305 PolarHBondContact O-N 2.88Å; C303-L306 CarbonylContact O-C 3.57Å; C303-L306 WeakPolarHBondContact O-CA 3.22Å; C303-L306 WeakPolarHBondContact O-CB 3.46Å; C303-L306 PolarHBondContact O-N 3.48Å; C303-A307 PolarHBondContact O-N 3.02Å; C303-A308 CarbonylContact C-O 3.09Å; C303-A308 WeakPolarHBondContact CB-O 3.48Å; C303-A308 PolarHBondContact O-N 2.88Å; C303-A308 VanDerWaalsContact O-N 3.12Å
304	S	89.3	Confident	92.7	Very high	68 Å²	68	67.8 Å²	67.8	48%	0.476	38%	0.382	S	S	.	.	H	α-helix	trans	-63.1	-30.4	-178.4	-57.1	0	0	0	0	112.6	K300 L301 S302 L306 A307 A308	K300-S304 WeakPolarHBondContact O-CB 3.46Å; K300-S304 PolarHBondContact O-N 2.73Å; K300-S304 PolarHBondContact O-OG 3.24Å; L301-S304 PolarHBondContact O-N 2.83Å; S302-S304 VanDerWaalsContact C-N 3.26Å; S302-S304 PolarHBondContact O-N 3.36Å; S304-L306 PolarHBondContact O-N 3.38Å; S304-A307 PolarHBondContact O-N 2.59Å; S304-A307 VanDerWaalsContact O-N 3.16Å; S304-A308 PolarHBondContact N-O 2.92Å
305	K	89.4	Confident	92.8	Very high	153 Å²	153	69.7 Å²	69.7	67%	0.665	40%	0.395	S	S	*	.	H	α-helix	trans	-69.9	-19.5	172.5	-68.1	168.5	-176.4	172.6	0	113.4	L301 S302 C303 A307	L301-K305 PolarHBondContact O-N 2.83Å; S302-K305 PolarHBondContact O-N 2.86Å; C303-K305 VanDerWaalsContact C-N 3.25Å; C303-K305 PolarHBondContact O-N 2.88Å; K305-A307 VanDerWaalsContact C-N 3.32Å
306	L	91.9	Very high	92.5	Very high	143 Å²	143	70 Å²	70	75%	0.749	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	12.7	173	-54.6	175.7	0	0	0	112.2	C303 S304 A308	C303-L306 CarbonylContact O-C 3.57Å; C303-L306 WeakPolarHBondContact O-CA 3.22Å; C303-L306 WeakPolarHBondContact O-CB 3.46Å; C303-L306 PolarHBondContact O-N 3.48Å; S304-L306 PolarHBondContact O-N 3.38Å; L306-A308 PolarHBondContact O-N 3.3Å; L306-A308 VanDerWaalsContact O-N 3.12Å
307	A	91.6	Very high	92.4	Very high	102 Å²	102	73.1 Å²	73.1	84%	0.843	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	56	19.1	-171.4	0	0	0	0	0	114.8	C303 S304 K305	C303-A307 PolarHBondContact O-N 3.02Å; S304-A307 PolarHBondContact O-N 2.59Å; S304-A307 VanDerWaalsContact O-N 3.16Å; K305-A307 VanDerWaalsContact C-N 3.32Å
308	A	91.7	Very high	92.2	Very high	49 Å²	49	78.6 Å²	78.6	41%	0.405	44%	0.444	S	S	.	.			trans	-107.2	136.9	-179.1	0	0	0	0	0	111.5	C303 S304 L306	C303-A308 CarbonylContact C-O 3.09Å; C303-A308 WeakPolarHBondContact CB-O 3.48Å; C303-A308 PolarHBondContact O-N 2.88Å; C303-A308 VanDerWaalsContact O-N 3.12Å; S304-A308 PolarHBondContact N-O 2.92Å; L306-A308 PolarHBondContact O-N 3.3Å; L306-A308 VanDerWaalsContact O-N 3.12Å
309	S	89.8	Confident	92.1	Very high	110 Å²	110	80.9 Å²	80.9	77%	0.769	46%	0.459	S	S	*	.			trans	-84.8	134.7	170.8	49.1	0	0	0	0	110.9
310	F	93.3	Very high	92	Very high	18 Å²	18	80.2 Å²	80.2	8%	0.079	46%	0.456	C	S	.	.			trans	-63.1	141.7	164	-177.3	-122.6	0	0	0	109.8	F272 I296 F299 K300 S312 M313 I324 Y332	F272-F310 HydrophobicContact CZ-CD1 4.47Å; F272-F310 HydrophobicContact CZ-CE1 4.32Å; I296-F310 HydrophobicContact CG2-CD1 4.28Å; I296-F310 HydrophobicContact CG2-CE1 3.83Å; F299-F310 AromaticContact CD1-CD2 3.98Å; F299-F310 HydrophobicContact CD1-CD2 3.98Å; F299-F310 HydrophobicContact CD1-CE2 4.14Å; F299-F310 AromaticContact CE1-CD2 3.67Å; F299-F310 HydrophobicContact CE1-CD2 3.67Å; F299-F310 AromaticContact CE1-CE2 3.81Å; F299-F310 HydrophobicContact CE1-CE2 3.81Å; K300-F310 HydrophobicContact CB-CB 4.34Å; K300-F310 HydrophobicContact CG-CB 4.2Å; F310-S312 VanDerWaalsContact CE2-O 3.24Å; F310-S312 WeakPolarHBondContact CE2-O 3.43Å; F310-M313 HydrophobicContact CE2-CB 3.95Å; F310-M313 HydrophobicContact CE2-CE 4.02Å; F310-M313 HydrophobicContact CZ-CB 3.86Å; F310-M313 HydrophobicContact CZ-CE 4.29Å; F310-I324 HydrophobicContact CE1-CG2 3.92Å; F310-I324 HydrophobicContact CZ-CB 4.49Å; F310-I324 HydrophobicContact CZ-CG2 4.02Å; F310-Y332 AromaticContact CD1-CE1 3.76Å; F310-Y332 HydrophobicContact CD1-CE1 3.76Å; F310-Y332 AromaticContact CD1-CZ 3.64Å; F310-Y332 VanDerWaalsContact CD1-OH 3.23Å; F310-Y332 WeakPolarHBondContact CD1-OH 3.06Å; F310-Y332 HydrophobicContact CE1-CD1 4.32Å; F310-Y332 AromaticContact CE1-CE1 3.54Å; F310-Y332 HydrophobicContact CE1-CE1 3.54Å; F310-Y332 AromaticContact CE1-CZ 3.94Å; F310-Y332 HydrophobicContact CZ-CE1 4.49Å; F310-Y332 PolarHBondContact O-OH 2.9Å
311	Q	92.3	Very high	92	Very high	123 Å²	123	78.7 Å²	78.7	58%	0.575	45%	0.45	S	S	*	.			trans	-131.7	-53.8	178.9	177.1	175.4	-11.3	0	0	111.8	I326 Y332	Q311-I326 HydrophobicContact CB-CD1 4.48Å; Q311-I326 HydrophobicContact CG-CD1 4.18Å; Q311-I326 PolarHBondContact O-N 2.87Å; Q311-Y332 WeakPolarHBondContact CA-OH 3.39Å; Q311-Y332 PolarHBondContact N-OH 3.12Å; Q311-Y332 VanDerWaalsContact O-CE1 3.28Å; Q311-Y332 WeakPolarHBondContact O-CE1 3.09Å
312	S	94.8	Very high	92.3	Very high	69 Å²	69	78.2 Å²	78.2	48%	0.483	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	164.1	-179.7	59.6	0	0	0	0	112.8	F310 I324	F310-S312 VanDerWaalsContact CE2-O 3.24Å; F310-S312 WeakPolarHBondContact CE2-O 3.43Å; S312-I324 CarbonylContact C-O 3.5Å; S312-I324 WeakPolarHBondContact CA-O 3.37Å; S312-I324 WeakPolarHBondContact CB-O 3.49Å
313	M	95.3	Very high	92.5	Very high	52 Å²	52	75.5 Å²	75.5	26%	0.256	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	134.1	176.8	-171.2	-177.2	-68.7	0	0	109.7	I296 F299 F310 V315 I324	I296-M313 HydrophobicContact CD1-CE 4.33Å; I296-M313 HydrophobicContact CD1-SD 4.45Å; F299-M313 HydrophobicContact CD1-CE 3.63Å; F299-M313 HydrophobicContact CE1-CE 3.43Å; F299-M313 VanDerWaalsContact CE1-CE 3.43Å; F299-M313 HydrophobicContact CE2-CE 4.48Å; F299-M313 HydrophobicContact CG-CE 4.25Å; F299-M313 HydrophobicContact CZ-CE 3.91Å; F310-M313 HydrophobicContact CE2-CB 3.95Å; F310-M313 HydrophobicContact CE2-CE 4.02Å; F310-M313 HydrophobicContact CZ-CB 3.86Å; F310-M313 HydrophobicContact CZ-CE 4.29Å; M313-V315 HydrophobicContact CG-CG2 3.82Å; M313-V315 HydrophobicContact SD-CG2 3.71Å; M313-I324 HydrophobicContact CB-CB 4.32Å; M313-I324 PolarHBondContact N-O 3.49Å; M313-I324 PolarHBondContact O-N 2.9Å
314	E	95.1	Very high	92.7	Very high	92 Å²	92	75.2 Å²	75.2	43%	0.43	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	130.1	163.7	179.8	172.6	166.3	0	0	108.2	R316 A322 F323 S344	E314-R316 IonicContact OE1-NE 2.76Å; E314-R316 PolarHBondContact OE1-NE 2.98Å; E314-R316 IonicContact OE1-NH2 3.97Å; E314-A322 WeakPolarHBondContact CA-O 3.35Å; E314-F323 HydrophobicContact CB-CD1 4.31Å; E314-F323 HydrophobicContact CG-CD1 3.93Å; E314-F323 HydrophobicContact CG-CE1 3.71Å; E314-F323 WeakPolarHBondContact OE2-CE1 3.47Å; E314-S344 PolarHBondContact OE1-OG 3.44Å; E314-S344 PolarHBondContact OE2-OG 2.94Å
315	V	94.3	Very high	93	Very high	67 Å²	67	73 Å²	73	41%	0.406	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	122.3	174.9	-176.2	0	0	0	0	108	M313 A321 A322	M313-V315 HydrophobicContact CG-CG2 3.82Å; M313-V315 HydrophobicContact SD-CG2 3.71Å; V315-A321 CarbonylContact O-C 3.54Å; V315-A321 WeakPolarHBondContact O-CA 3.22Å; V315-A322 PolarHBondContact N-O 2.88Å; V315-A322 PolarHBondContact O-N 3.45Å
316	R	91	Very high	93.3	Very high	116 Å²	116	67.2 Å²	67.2	44%	0.438	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	138	-176.3	-177	178	-76.8	-93.2	7.6	110.7	E314 A321 S344	E314-R316 IonicContact OE1-NE 2.76Å; E314-R316 PolarHBondContact OE1-NE 2.98Å; E314-R316 IonicContact OE1-NH2 3.97Å; R316-A321 HydrophobicContact CB-CB 4.35Å; R316-A321 HydrophobicContact CG-CB 4.18Å; R316-S344 PolarHBondContact NH2-OG 3.24Å
317	N	91.6	Very high	93.4	Very high	77 Å²	77	60.4 Å²	60.4	41%	0.412	35%	0.349	S	S	.	.			trans	-134.1	-165.5	168.6	64.1	41.6	0	0	0	109.9	N319 F320	N317-N319 PolarHBondContact O-N 2.92Å; N317-N319 WeakPolarHBondContact OD1-CA 3.42Å; N317-N319 PolarHBondContact OD1-N 3.42Å; N317-F320 PolarHBondContact N-O 3.31Å; N317-F320 WeakPolarHBondContact ND2-CD1 3.45Å; N317-F320 WeakPolarHBondContact ND2-CE1 3.22Å; N317-F320 WeakPolarHBondContact ND2-CZ 3.4Å; N317-F320 PolarHBondContact OD1-N 2.87Å; N317-F320 PolarHBondContact OD1-O 3.07Å
318	S	89.8	Confident	93.4	Very high	116 Å²	116	55.8 Å²	55.8	81%	0.811	31%	0.31	S	S	*	.	S	Bend	trans	-70.1	-15.5	-179.9	53.4	0	0	0	0	115
319	N	89.5	Confident	93.3	Very high	118 Å²	118	56.5 Å²	56.5	63%	0.631	31%	0.313	S	S	*	.	S	Bend	trans	-120.2	-24.3	-167.5	-57.1	7.2	0	0	0	112.8	N317	N317-N319 PolarHBondContact O-N 2.92Å; N317-N319 WeakPolarHBondContact OD1-CA 3.42Å; N317-N319 PolarHBondContact OD1-N 3.42Å
320	F	92.6	Very high	93.4	Very high	79 Å²	79	53 Å²	53	35%	0.346	29%	0.286	S	S	.	.			trans	-154.4	160	175.1	73.1	-97.2	0	0	0	113.2	N317 A322 V336 M337	N317-F320 PolarHBondContact N-O 3.31Å; N317-F320 WeakPolarHBondContact ND2-CD1 3.45Å; N317-F320 WeakPolarHBondContact ND2-CE1 3.22Å; N317-F320 WeakPolarHBondContact ND2-CZ 3.4Å; N317-F320 PolarHBondContact OD1-N 2.87Å; N317-F320 PolarHBondContact OD1-O 3.07Å; F320-A322 HydrophobicContact CD2-CB 4Å; F320-A322 HydrophobicContact CE2-CB 3.8Å; F320-V336 HydrophobicContact CB-CG1 4.21Å; F320-V336 HydrophobicContact CD2-CG1 4.2Å; F320-V336 HydrophobicContact CG-CG1 4.37Å; F320-M337 CarbonylContact C-O 3.55Å; F320-M337 WeakPolarHBondContact CA-O 3.23Å; F320-M337 WeakPolarHBondContact CB-O 3.31Å
321	A	93.8	Very high	93.4	Very high	4 Å²	4	52.3 Å²	52.3	3%	0.033	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	134.8	159.9	0	0	0	0	0	109.8	V315 R316 F323 M337	V315-A321 CarbonylContact O-C 3.54Å; V315-A321 WeakPolarHBondContact O-CA 3.22Å; R316-A321 HydrophobicContact CB-CB 4.35Å; R316-A321 HydrophobicContact CG-CB 4.18Å; A321-F323 HydrophobicContact CB-CE2 3.75Å; A321-F323 HydrophobicContact CB-CZ 3.89Å; A321-M337 PolarHBondContact N-O 3.33Å; A321-M337 PolarHBondContact O-N 3.04Å
322	A	95.4	Very high	93.7	Very high	7 Å²	7	46.6 Å²	46.6	6%	0.058	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	131.2	177.5	0	0	0	0	0	110.3	E314 V315 F320 M334 V335 V336	E314-A322 WeakPolarHBondContact CA-O 3.35Å; V315-A322 PolarHBondContact N-O 2.88Å; V315-A322 PolarHBondContact O-N 3.45Å; F320-A322 HydrophobicContact CD2-CB 4Å; F320-A322 HydrophobicContact CE2-CB 3.8Å; A322-M334 HydrophobicContact CB-CE 4.11Å; A322-V335 CarbonylContact C-O 3.6Å; A322-V335 VanDerWaalsContact CA-O 3.31Å; A322-V335 WeakPolarHBondContact CA-O 3.35Å; A322-V336 HydrophobicContact CB-CG2 4.39Å
323	F	96.5	Very high	93.8	Very high	3 Å²	3	43.3 Å²	43.3	1%	0.013	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	120.7	-176.2	-55.4	-90.2	0	0	0	109.3	E314 A321 M334 V335 M337 T347 L348 I351	E314-F323 HydrophobicContact CB-CD1 4.31Å; E314-F323 HydrophobicContact CG-CD1 3.93Å; E314-F323 HydrophobicContact CG-CE1 3.71Å; E314-F323 WeakPolarHBondContact OE2-CE1 3.47Å; A321-F323 HydrophobicContact CB-CE2 3.75Å; A321-F323 HydrophobicContact CB-CZ 3.89Å; F323-M334 CarbonylContact O-C 3.44Å; F323-M334 VanDerWaalsContact O-CA 3.22Å; F323-M334 WeakPolarHBondContact O-CA 3.23Å; F323-V335 PolarHBondContact N-O 2.65Å; F323-V335 PolarHBondContact O-N 2.71Å; F323-M337 HydrophobicContact CD2-CG 4.36Å; F323-M337 HydrophobicContact CE2-CG 3.94Å; F323-T347 HydrophobicContact CD2-CG2 3.77Å; F323-T347 HydrophobicContact CE2-CG2 3.94Å; F323-T347 HydrophobicContact CG-CG2 4.3Å; F323-L348 HydrophobicContact CD1-CD2 4.21Å; F323-L348 HydrophobicContact CD1-CG 4.37Å; F323-I351 HydrophobicContact CB-CD1 4.16Å
324	I	97.3	Very high	93.9	Very high	13 Å²	13	41.8 Å²	41.8	7%	0.067	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	125.1	173.1	-56.9	177	0	0	0	107.7	I296 F310 S312 M313 Y332 V333 M334	I296-I324 HydrophobicContact CD1-CD1 3.59Å; I296-I324 HydrophobicContact CG1-CD1 3.95Å; F310-I324 HydrophobicContact CE1-CG2 3.92Å; F310-I324 HydrophobicContact CZ-CB 4.49Å; F310-I324 HydrophobicContact CZ-CG2 4.02Å; S312-I324 CarbonylContact C-O 3.5Å; S312-I324 WeakPolarHBondContact CA-O 3.37Å; S312-I324 WeakPolarHBondContact CB-O 3.49Å; M313-I324 HydrophobicContact CB-CB 4.32Å; M313-I324 PolarHBondContact N-O 3.49Å; M313-I324 PolarHBondContact O-N 2.9Å; I324-Y332 HydrophobicContact CG2-CD1 3.72Å; I324-Y332 HydrophobicContact CG2-CE1 4.15Å; I324-V333 WeakPolarHBondContact CA-O 3.18Å; I324-M334 HydrophobicContact CD1-CG 4.46Å; I324-M334 HydrophobicContact CD1-SD 4Å; I324-M334 HydrophobicContact CG1-CB 4.02Å; I324-M334 HydrophobicContact CG1-CG 3.82Å; I324-M334 HydrophobicContact CG1-SD 4.03Å
325	D	96	Very high	93.9	Very high	23 Å²	23	37.4 Å²	37.4	12%	0.123	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	156	174.7	-172.6	26.5	0	0	0	110.7	F327 Y332 V333 I351 R355	D325-F327 PolarHBondContact O-N 3.11Å; D325-Y332 WeakPolarHBondContact O-CA 3.41Å; D325-Y332 VanDerWaalsContact O-CD1 3.24Å; D325-Y332 WeakPolarHBondContact O-CD1 3.44Å; D325-V333 PolarHBondContact N-O 3.44Å; D325-V333 VanDerWaalsContact N-O 3.12Å; D325-V333 PolarHBondContact O-N 3.36Å; D325-I351 HydrophobicContact CB-CG2 4.42Å; D325-R355 IonicContact OD2-CZ 3.19Å; D325-R355 IonicContact OD2-NH2 3.64Å; D325-R355 PolarHBondContact OD2-NH2 3.16Å
326	I	95	Very high	94	Very high	31 Å²	31	35.1 Å²	35.1	16%	0.159	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.7	117	169.4	-67.8	173	0	0	0	107.7	Q311 T328 Y332 R355	Q311-I326 HydrophobicContact CB-CD1 4.48Å; Q311-I326 HydrophobicContact CG-CD1 4.18Å; Q311-I326 PolarHBondContact O-N 2.87Å; I326-T328 WeakPolarHBondContact CG2-O 3.48Å; I326-Y332 HydrophobicContact CG1-CD1 4.41Å; I326-Y332 HydrophobicContact CG1-CD2 4.45Å; I326-Y332 HydrophobicContact CG1-CE1 3.77Å; I326-Y332 HydrophobicContact CG1-CE2 3.81Å; I326-Y332 VanDerWaalsContact CG1-CZ 3.43Å; I326-R355 VanDerWaalsContact O-CZ 3.27Å; I326-R355 PolarHBondContact O-NE 2.92Å; I326-R355 PolarHBondContact O-NH2 3.24Å
327	F	94.2	Very high	94.1	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.171	C	C	.	.			trans	-89.7	-46.8	-174.4	-164.8	-137.5	0	0	0	112.2	F255 L266 D325 T331 V333 I351 A354 R355 F358	F255-F327 HydrophobicContact CD1-CZ 4.47Å; F255-F327 HydrophobicContact CE1-CZ 4.28Å; F255-F327 HydrophobicContact CZ-CE2 4.45Å; L266-F327 HydrophobicContact CD1-CD1 3.66Å; L266-F327 HydrophobicContact CD1-CE1 4.26Å; D325-F327 PolarHBondContact O-N 3.11Å; F327-T331 PolarHBondContact N-O 3.25Å; F327-V333 HydrophobicContact CB-CB 3.76Å; F327-V333 HydrophobicContact CB-CG1 3.83Å; F327-V333 HydrophobicContact CD1-CB 4.13Å; F327-V333 HydrophobicContact CD2-CB 3.99Å; F327-V333 HydrophobicContact CD2-CG1 3.58Å; F327-V333 HydrophobicContact CE2-CG1 4.23Å; F327-V333 HydrophobicContact CG-CB 3.74Å; F327-V333 HydrophobicContact CG-CG1 3.8Å; F327-I351 HydrophobicContact CD2-CG2 4.11Å; F327-I351 HydrophobicContact CE2-CG2 4.35Å; F327-A354 HydrophobicContact CE2-CB 3.87Å; F327-A354 HydrophobicContact CZ-CB 3.83Å; F327-R355 WeakPolarHBondContact O-CB 3.32Å; F327-R355 WeakPolarHBondContact O-CD 3.46Å; F327-R355 WeakPolarHBondContact O-CG 3.24Å; F327-R355 PolarHBondContact O-NE 2.9Å; F327-F358 HydrophobicContact CD1-CB 4.26Å; F327-F358 HydrophobicContact CD1-CD1 4.49Å; F327-F358 HydrophobicContact CD1-CG 4.19Å; F327-F358 HydrophobicContact CE1-CB 3.84Å; F327-F358 AromaticContact CE1-CD1 3.73Å; F327-F358 HydrophobicContact CE1-CD1 3.73Å; F327-F358 AromaticContact CE1-CD2 3.36Å; F327-F358 HydrophobicContact CE1-CD2 3.36Å; F327-F358 HydrophobicContact CE1-CE1 4.06Å; F327-F358 AromaticContact CE1-CE2 3.74Å; F327-F358 HydrophobicContact CE1-CE2 3.74Å; F327-F358 AromaticContact CE1-CG 3.35Å; F327-F358 HydrophobicContact CE1-CG 3.35Å; F327-F358 HydrophobicContact CE1-CZ 4.06Å; F327-F358 HydrophobicContact CZ-CB 4.46Å; F327-F358 AromaticContact CZ-CD2 3.42Å; F327-F358 HydrophobicContact CZ-CD2 3.42Å; F327-F358 VanDerWaalsContact CZ-CD2 3.42Å; F327-F358 AromaticContact CZ-CE2 3.67Å; F327-F358 HydrophobicContact CZ-CE2 3.67Å; F327-F358 AromaticContact CZ-CG 3.92Å; F327-F358 HydrophobicContact CZ-CG 3.92Å; F327-F358 HydrophobicContact CZ-CZ 4.34Å
328	T	92.8	Very high	94.1	Very high	4 Å²	4	28.7 Å²	28.7	3%	0.025	17%	0.169	C	C	.	.	S	Bend	trans	-129.4	-173.1	173.7	69	0	0	0	0	110.2	I326 N330 T331 F358 E359 E362	I326-T328 WeakPolarHBondContact CG2-O 3.48Å; T328-N330 PolarHBondContact O-N 2.88Å; T328-N330 PolarHBondContact OG1-N 2.98Å; T328-T331 WeakPolarHBondContact CG2-OG1 3.44Å; T328-T331 PolarHBondContact N-O 3.12Å; T328-T331 PolarHBondContact N-OG1 3.32Å; T328-T331 PolarHBondContact OG1-N 2.99Å; T328-T331 PolarHBondContact OG1-OG1 2.89Å; T328-F358 HydrophobicContact CG2-CB 3.83Å; T328-E359 HydrophobicContact CG2-CG 4.13Å; T328-E362 VanDerWaalsContact CB-OE1 3.28Å; T328-E362 WeakPolarHBondContact CB-OE1 3.31Å; T328-E362 WeakPolarHBondContact CG2-OE1 3.37Å; T328-E362 VanDerWaalsContact OG1-CD 3.28Å; T328-E362 PolarHBondContact OG1-OE1 2.87Å; T328-E362 PolarHBondContact OG1-OE2 3.17Å
329	S	89.9	Confident	93.9	Very high	65 Å²	65	26.2 Å²	26.2	46%	0.455	15%	0.147	S	C	.	.	S	Bend	trans	-57.2	-28.5	167.3	43.5	0	0	0	0	113.7	R269	R269-S329 WeakPolarHBondContact CD-O 3.47Å; R269-S329 PolarHBondContact NH1-O 3.33Å
330	N	91.3	Very high	93.5	Very high	37 Å²	37	25.7 Å²	25.7	20%	0.198	15%	0.15	C	C	.	.	S	Bend	trans	-118.3	-4.9	-169.8	-55.4	-73.9	0	0	0	114.1	G115 R269 T328 E362	G115-N330 PolarHBondContact N-OD1 3.15Å; R269-N330 VanDerWaalsContact CB-C 3.45Å; R269-N330 VanDerWaalsContact CB-O 3.28Å; R269-N330 WeakPolarHBondContact CB-O 3.38Å; R269-N330 PolarHBondContact N-O 3.35Å; T328-N330 PolarHBondContact O-N 2.88Å; T328-N330 PolarHBondContact OG1-N 2.98Å; N330-E362 PolarHBondContact ND2-OE2 2.95Å
331	T	93.9	Very high	93.2	Very high	2 Å²	2	26.2 Å²	26.2	1%	0.012	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	157.1	-177.3	61.8	0	0	0	0	114.4	L114 L266 F267 I275 F327 T328	L114-T331 HydrophobicContact CD2-CG2 3.44Å; L114-T331 VanDerWaalsContact CD2-CG2 3.44Å; L266-T331 HydrophobicContact CD1-CG2 4.15Å; L266-T331 HydrophobicContact CG-CG2 4.28Å; F267-T331 CarbonylContact O-C 3.55Å; F267-T331 WeakPolarHBondContact O-CA 3.4Å; F267-T331 WeakPolarHBondContact O-CB 3.46Å; I275-T331 HydrophobicContact CD1-CG2 3.72Å; F327-T331 PolarHBondContact N-O 3.25Å; T328-T331 WeakPolarHBondContact CG2-OG1 3.44Å; T328-T331 PolarHBondContact N-O 3.12Å; T328-T331 PolarHBondContact N-OG1 3.32Å; T328-T331 PolarHBondContact OG1-N 2.99Å; T328-T331 PolarHBondContact OG1-OG1 2.89Å
332	Y	96.6	Very high	92.8	Very high	4 Å²	4	27.6 Å²	27.6	2%	0.016	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	148.6	160.2	-94.1	-95	0	0	0	109.2	F267 R269 F272 F310 Q311 I324 D325 I326	F267-Y332 PolarHBondContact N-O 3.21Å; F267-Y332 PolarHBondContact O-N 3.33Å; R269-Y332 HydrophobicContact CB-CD2 4.26Å; R269-Y332 HydrophobicContact CG-CD2 3.92Å; R269-Y332 HydrophobicContact CG-CE2 3.86Å; F272-Y332 HydrophobicContact CE1-CD2 4.49Å; F272-Y332 HydrophobicContact CE1-CG 4.2Å; F272-Y332 AromaticContact CE2-CD2 3.49Å; F272-Y332 HydrophobicContact CE2-CD2 3.49Å; F272-Y332 VanDerWaalsContact CE2-CD2 3.49Å; F272-Y332 AromaticContact CE2-CE2 3.63Å; F272-Y332 HydrophobicContact CE2-CE2 3.63Å; F272-Y332 AromaticContact CE2-CG 3.99Å; F272-Y332 HydrophobicContact CE2-CG 3.99Å; F272-Y332 AromaticContact CZ-CD1 3.77Å; F272-Y332 HydrophobicContact CZ-CD1 3.77Å; F272-Y332 AromaticContact CZ-CD2 3.44Å; F272-Y332 HydrophobicContact CZ-CD2 3.44Å; F272-Y332 VanDerWaalsContact CZ-CD2 3.44Å; F272-Y332 HydrophobicContact CZ-CE1 4.11Å; F272-Y332 AromaticContact CZ-CE2 3.81Å; F272-Y332 HydrophobicContact CZ-CE2 3.81Å; F272-Y332 AromaticContact CZ-CG 3.41Å; F272-Y332 HydrophobicContact CZ-CG 3.41Å; F272-Y332 VanDerWaalsContact CZ-CG 3.41Å; F310-Y332 AromaticContact CD1-CE1 3.76Å; F310-Y332 HydrophobicContact CD1-CE1 3.76Å; F310-Y332 AromaticContact CD1-CZ 3.64Å; F310-Y332 VanDerWaalsContact CD1-OH 3.23Å; F310-Y332 WeakPolarHBondContact CD1-OH 3.06Å; F310-Y332 HydrophobicContact CE1-CD1 4.32Å; F310-Y332 AromaticContact CE1-CE1 3.54Å; F310-Y332 HydrophobicContact CE1-CE1 3.54Å; F310-Y332 AromaticContact CE1-CZ 3.94Å; F310-Y332 HydrophobicContact CZ-CE1 4.49Å; F310-Y332 PolarHBondContact O-OH 2.9Å; Q311-Y332 WeakPolarHBondContact CA-OH 3.39Å; Q311-Y332 PolarHBondContact N-OH 3.12Å; Q311-Y332 VanDerWaalsContact O-CE1 3.28Å; Q311-Y332 WeakPolarHBondContact O-CE1 3.09Å; I324-Y332 HydrophobicContact CG2-CD1 3.72Å; I324-Y332 HydrophobicContact CG2-CE1 4.15Å; D325-Y332 WeakPolarHBondContact O-CA 3.41Å; D325-Y332 VanDerWaalsContact O-CD1 3.24Å; D325-Y332 WeakPolarHBondContact O-CD1 3.44Å; I326-Y332 HydrophobicContact CG1-CD1 4.41Å; I326-Y332 HydrophobicContact CG1-CD2 4.45Å; I326-Y332 HydrophobicContact CG1-CE1 3.77Å; I326-Y332 HydrophobicContact CG1-CE2 3.81Å; I326-Y332 VanDerWaalsContact CG1-CZ 3.43Å
333	V	97.1	Very high	92.5	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	143.3	167.1	69.1	0	0	0	0	109.3	F255 V264 L265 I324 D325 F327 V335 I351	F255-V333 HydrophobicContact CE1-CG2 4.39Å; V264-V333 HydrophobicContact CG1-CG2 3.68Å; L265-V333 CarbonylContact O-C 3.48Å; L265-V333 WeakPolarHBondContact O-CA 3.16Å; I324-V333 WeakPolarHBondContact CA-O 3.18Å; D325-V333 PolarHBondContact N-O 3.44Å; D325-V333 VanDerWaalsContact N-O 3.12Å; D325-V333 PolarHBondContact O-N 3.36Å; F327-V333 HydrophobicContact CB-CB 3.76Å; F327-V333 HydrophobicContact CB-CG1 3.83Å; F327-V333 HydrophobicContact CD1-CB 4.13Å; F327-V333 HydrophobicContact CD2-CB 3.99Å; F327-V333 HydrophobicContact CD2-CG1 3.58Å; F327-V333 HydrophobicContact CE2-CG1 4.23Å; F327-V333 HydrophobicContact CG-CB 3.74Å; F327-V333 HydrophobicContact CG-CG1 3.8Å; V333-V335 HydrophobicContact CG2-CG2 4.07Å; V333-I351 HydrophobicContact CG1-CG1 4.49Å; V333-I351 HydrophobicContact CG1-CG2 3.94Å
334	M	97.4	Very high	92.1	Very high	20 Å²	20	32.3 Å²	32.3	10%	0.099	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	130.9	161.1	179.5	169.7	159.4	0	0	108.8	V264 L265 F267 I292 A322 F323 I324 V336	V264-M334 CarbonylContact C-O 3.52Å; V264-M334 VanDerWaalsContact CA-O 3.32Å; V264-M334 WeakPolarHBondContact CA-O 3.34Å; L265-M334 HydrophobicContact CB-CB 4.22Å; L265-M334 HydrophobicContact CD1-SD 4.28Å; L265-M334 PolarHBondContact N-O 3.29Å; L265-M334 PolarHBondContact O-N 3.02Å; F267-M334 HydrophobicContact CE2-CB 3.77Å; I292-M334 HydrophobicContact CD1-CE 3.88Å; I292-M334 HydrophobicContact CD1-SD 4.07Å; I292-M334 HydrophobicContact CG2-SD 3.82Å; A322-M334 HydrophobicContact CB-CE 4.11Å; F323-M334 CarbonylContact O-C 3.44Å; F323-M334 VanDerWaalsContact O-CA 3.22Å; F323-M334 WeakPolarHBondContact O-CA 3.23Å; I324-M334 HydrophobicContact CD1-CG 4.46Å; I324-M334 HydrophobicContact CD1-SD 4Å; I324-M334 HydrophobicContact CG1-CB 4.02Å; I324-M334 HydrophobicContact CG1-CG 3.82Å; I324-M334 HydrophobicContact CG1-SD 4.03Å; M334-V336 HydrophobicContact CE-CG2 3.71Å; M334-V336 HydrophobicContact CG-CG2 4.48Å
335	V	96.6	Very high	91.8	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	131.8	175.3	178.1	0	0	0	0	108.5	F255 I259 A261 V264 A322 F323 V333 M337 T347 I351	F255-V335 HydrophobicContact CE1-CG2 4.13Å; F255-V335 HydrophobicContact CZ-CG2 4.42Å; I259-V335 HydrophobicContact CD1-CG1 3.69Å; I259-V335 HydrophobicContact CD1-CG2 4.11Å; A261-V335 HydrophobicContact CB-CG1 3.91Å; V264-V335 HydrophobicContact CG1-CG2 4.27Å; V264-V335 HydrophobicContact CG2-CG1 4.4Å; V264-V335 HydrophobicContact CG2-CG2 4.33Å; A322-V335 CarbonylContact C-O 3.6Å; A322-V335 VanDerWaalsContact CA-O 3.31Å; A322-V335 WeakPolarHBondContact CA-O 3.35Å; F323-V335 PolarHBondContact N-O 2.65Å; F323-V335 PolarHBondContact O-N 2.71Å; V333-V335 HydrophobicContact CG2-CG2 4.07Å; V335-M337 HydrophobicContact CG1-CG 4.21Å; V335-M337 HydrophobicContact CG1-SD 3.65Å; V335-T347 HydrophobicContact CG1-CG2 3.98Å; V335-I351 HydrophobicContact CB-CD1 4.43Å; V335-I351 HydrophobicContact CG2-CD1 3.93Å; V335-I351 HydrophobicContact CG2-CG1 4.06Å
336	V	95.3	Very high	91.6	Very high	18 Å²	18	35.3 Å²	35.3	11%	0.109	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	127.3	176.5	-173.3	0	0	0	0	109.8	D262 E263 F320 A322 M334	D262-V336 PolarHBondContact N-O 2.81Å; E263-V336 HydrophobicContact CB-CB 4.18Å; E263-V336 HydrophobicContact CB-CG2 4.36Å; E263-V336 PolarHBondContact O-N 3.34Å; F320-V336 HydrophobicContact CB-CG1 4.21Å; F320-V336 HydrophobicContact CD2-CG1 4.2Å; F320-V336 HydrophobicContact CG-CG1 4.37Å; A322-V336 HydrophobicContact CB-CG2 4.39Å; M334-V336 HydrophobicContact CE-CG2 3.71Å; M334-V336 HydrophobicContact CG-CG2 4.48Å
337	M	93.3	Very high	91.5	Very high	5 Å²	5	34 Å²	34	3%	0.025	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	123.7	-178.1	-53.8	-58.3	-53.9	0	0	109.5	I259 E260 A261 F320 A321 F323 V335 I342 T347	I259-M337 VanDerWaalsContact O-CE 3.23Å; I259-M337 WeakPolarHBondContact O-CE 3.12Å; E260-M337 WeakPolarHBondContact O-CE 3.32Å; A261-M337 HydrophobicContact CB-SD 3.72Å; F320-M337 CarbonylContact C-O 3.55Å; F320-M337 WeakPolarHBondContact CA-O 3.23Å; F320-M337 WeakPolarHBondContact CB-O 3.31Å; A321-M337 PolarHBondContact N-O 3.33Å; A321-M337 PolarHBondContact O-N 3.04Å; F323-M337 HydrophobicContact CD2-CG 4.36Å; F323-M337 HydrophobicContact CE2-CG 3.94Å; V335-M337 HydrophobicContact CG1-CG 4.21Å; V335-M337 HydrophobicContact CG1-SD 3.65Å; M337-I342 HydrophobicContact CE-CD1 3.57Å; M337-T347 HydrophobicContact CG-CG2 4.25Å; M337-T347 HydrophobicContact SD-CG2 4.38Å
338	S	90.9	Very high	91.4	Very high	53 Å²	53	37.6 Å²	37.6	37%	0.371	24%	0.243	S	C	.	.			trans	-91.7	-20.5	170.3	62	0	0	0	0	114.4	D262 P340	D262-S338 PolarHBondContact OD1-OG 2.99Å; D262-S338 WeakPolarHBondContact OD2-CB 3.2Å; D262-S338 PolarHBondContact OD2-N 2.69Å; D262-S338 PolarHBondContact OD2-OG 2.84Å; S338-P340 VanDerWaalsContact O-CD 3.25Å; S338-P340 WeakPolarHBondContact O-CD 3.28Å
339	D	86.8	Confident	91.4	Very high	64 Å²	64	42.1 Å²	42.1	34%	0.342	27%	0.266	S	S	.	.			trans	-72.3	117.2	177.4	-177.3	13.3	0	0	0	111.7	S341 I342	D339-S341 PolarHBondContact O-N 3Å; D339-S341 VanDerWaalsContact OD1-CB 3.25Å; D339-S341 WeakPolarHBondContact OD1-CB 3.42Å; D339-S341 PolarHBondContact OD1-N 3.42Å; D339-S341 PolarHBondContact OD1-OG 2.69Å; D339-S341 WeakPolarHBondContact OD2-CB 3.39Å; D339-S341 PolarHBondContact OD2-OG 2.87Å; D339-I342 HydrophobicContact CB-CD1 4.2Å; D339-I342 HydrophobicContact CB-CG1 4.42Å
340	P	80.8	Confident	91.6	Very high	108 Å²	108	41.7 Å²	41.7	70%	0.701	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-12	174.6	32.8	-37.9	0	0	0	113.8	S338 I342	S338-P340 VanDerWaalsContact O-CD 3.25Å; S338-P340 WeakPolarHBondContact O-CD 3.28Å; P340-I342 VanDerWaalsContact C-N 3.34Å
341	S	86.3	Confident	91.7	Very high	90 Å²	90	40 Å²	40	63%	0.629	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-30.2	-179.6	95.7	0	0	0	0	112.7	D339 P343	D339-S341 PolarHBondContact O-N 3Å; D339-S341 VanDerWaalsContact OD1-CB 3.25Å; D339-S341 WeakPolarHBondContact OD1-CB 3.42Å; D339-S341 PolarHBondContact OD1-N 3.42Å; D339-S341 PolarHBondContact OD1-OG 2.69Å; D339-S341 WeakPolarHBondContact OD2-CB 3.39Å; D339-S341 PolarHBondContact OD2-OG 2.87Å; S341-P343 VanDerWaalsContact O-CD 3.28Å; S341-P343 WeakPolarHBondContact O-CD 3.44Å
342	I	85.9	Confident	91.7	Very high	32 Å²	32	48.2 Å²	48.2	16%	0.164	28%	0.28	C	S	.	.	S	Bend	trans	-77.4	115.9	-176.8	-61.6	172.3	0	0	0	110	M337 D339 P340 A346	M337-I342 HydrophobicContact CE-CD1 3.57Å; D339-I342 HydrophobicContact CB-CD1 4.2Å; D339-I342 HydrophobicContact CB-CG1 4.42Å; P340-I342 VanDerWaalsContact C-N 3.34Å; I342-A346 HydrophobicContact CG2-CB 4.39Å
343	P	88.8	Confident	91.5	Very high	85 Å²	85	52.1 Å²	52.1	55%	0.552	30%	0.302	S	S	*	.			trans	-71.1	140.9	179.5	-17.4	32.4	0	0	0	111.5	S341 A345 A346	S341-P343 VanDerWaalsContact O-CD 3.28Å; S341-P343 WeakPolarHBondContact O-CD 3.44Å; P343-A345 PolarHBondContact O-N 2.87Å; P343-A346 WeakPolarHBondContact O-CB 3.49Å; P343-A346 PolarHBondContact O-N 2.99Å
344	S	88.7	Confident	91.4	Very high	24 Å²	24	52.8 Å²	52.8	17%	0.168	31%	0.307	C	S	.	.	H	α-helix	trans	-49.3	-35.1	177.4	-60	0	0	0	0	113.4	E314 R316 A346 T347 L348	E314-S344 PolarHBondContact OE1-OG 3.44Å; E314-S344 PolarHBondContact OE2-OG 2.94Å; R316-S344 PolarHBondContact NH2-OG 3.24Å; S344-A346 VanDerWaalsContact C-N 3.33Å; S344-A346 PolarHBondContact O-N 2.82Å; S344-T347 PolarHBondContact O-N 3.38Å; S344-L348 WeakPolarHBondContact O-CB 3.26Å; S344-L348 VanDerWaalsContact O-CG 3.26Å; S344-L348 WeakPolarHBondContact O-CG 3.49Å; S344-L348 PolarHBondContact O-N 3.41Å
345	A	90.4	Very high	91.2	Very high	62 Å²	62	54.5 Å²	54.5	51%	0.512	31%	0.312	S	S	.	.	H	α-helix	trans	-60.3	-36.9	176.5	0	0	0	0	0	113.5	P343 I349	P343-A345 PolarHBondContact O-N 2.87Å; A345-I349 WeakPolarHBondContact O-CB 3.45Å; A345-I349 WeakPolarHBondContact O-CD1 3.22Å; A345-I349 WeakPolarHBondContact O-CG1 3.49Å; A345-I349 PolarHBondContact O-N 2.77Å
346	A	92.4	Very high	90.9	Very high	37 Å²	37	61.1 Å²	61.1	31%	0.306	34%	0.341	S	S	.	.	H	α-helix	trans	-67.2	-48.7	177.6	0	0	0	0	0	110.9	I342 P343 S344 L348 I349 N350	I342-A346 HydrophobicContact CG2-CB 4.39Å; P343-A346 WeakPolarHBondContact O-CB 3.49Å; P343-A346 PolarHBondContact O-N 2.99Å; S344-A346 VanDerWaalsContact C-N 3.33Å; S344-A346 PolarHBondContact O-N 2.82Å; A346-L348 PolarHBondContact O-N 2.83Å; A346-I349 PolarHBondContact O-N 2.89Å; A346-N350 WeakPolarHBondContact O-CB 3.26Å; A346-N350 VanDerWaalsContact O-CG 3.26Å; A346-N350 PolarHBondContact O-N 3.38Å
347	T	91.8	Very high	90.6	Very high	4 Å²	4	64.6 Å²	64.6	3%	0.025	36%	0.356	C	S	.	.	H	α-helix	trans	-59.1	-44.6	177.3	-41.9	0	0	0	0	111.7	F323 V335 M337 S344 N350 I351	F323-T347 HydrophobicContact CD2-CG2 3.77Å; F323-T347 HydrophobicContact CE2-CG2 3.94Å; F323-T347 HydrophobicContact CG-CG2 4.3Å; V335-T347 HydrophobicContact CG1-CG2 3.98Å; M337-T347 HydrophobicContact CG-CG2 4.25Å; M337-T347 HydrophobicContact SD-CG2 4.38Å; S344-T347 PolarHBondContact O-N 3.38Å; T347-N350 PolarHBondContact O-N 3.39Å; T347-I351 HydrophobicContact CG2-CD1 4.22Å; T347-I351 VanDerWaalsContact O-CG1 3.32Å; T347-I351 WeakPolarHBondContact O-CG1 3.28Å; T347-I351 PolarHBondContact O-N 2.85Å
348	L	92.1	Very high	90.4	Very high	76 Å²	76	64.8 Å²	64.8	40%	0.398	36%	0.357	S	S	.	.	H	α-helix	trans	-66.4	-37.5	177.8	-68.7	170.2	0	0	0	112.9	F323 S344 A346 R352	F323-L348 HydrophobicContact CD1-CD2 4.21Å; F323-L348 HydrophobicContact CD1-CG 4.37Å; S344-L348 WeakPolarHBondContact O-CB 3.26Å; S344-L348 VanDerWaalsContact O-CG 3.26Å; S344-L348 WeakPolarHBondContact O-CG 3.49Å; S344-L348 PolarHBondContact O-N 3.41Å; A346-L348 PolarHBondContact O-N 2.83Å; L348-R352 WeakPolarHBondContact O-CB 3.18Å; L348-R352 PolarHBondContact O-N 2.84Å
349	I	93.8	Very high	90.3	Very high	98 Å²	98	64.9 Å²	64.9	50%	0.503	35%	0.351	S	S	.	.	H	α-helix	trans	-64.6	-42.2	172.5	-73.9	166.2	0	0	0	110.5	A345 A346 R352 N353	A345-I349 WeakPolarHBondContact O-CB 3.45Å; A345-I349 WeakPolarHBondContact O-CD1 3.22Å; A345-I349 WeakPolarHBondContact O-CG1 3.49Å; A345-I349 PolarHBondContact O-N 2.77Å; A346-I349 PolarHBondContact O-N 2.89Å; I349-R352 PolarHBondContact O-N 2.99Å; I349-N353 WeakPolarHBondContact O-CB 3.37Å; I349-N353 PolarHBondContact O-N 2.88Å; I349-N353 PolarHBondContact O-ND2 3.31Å
350	N	93.9	Very high	90.2	Very high	57 Å²	57	68.6 Å²	68.6	31%	0.305	36%	0.364	S	S	.	.	H	α-helix	trans	-66.3	-44.1	179.6	-69.7	-12.6	0	0	0	112	I259 A346 T347 R352 N353 A354	I259-N350 HydrophobicContact CG2-CB 3.6Å; A346-N350 WeakPolarHBondContact O-CB 3.26Å; A346-N350 VanDerWaalsContact O-CG 3.26Å; A346-N350 PolarHBondContact O-N 3.38Å; T347-N350 PolarHBondContact O-N 3.39Å; N350-R352 VanDerWaalsContact C-N 3.34Å; N350-R352 PolarHBondContact O-N 3Å; N350-N353 PolarHBondContact O-N 3.47Å; N350-A354 WeakPolarHBondContact O-CB 3.39Å; N350-A354 PolarHBondContact O-N 2.83Å
351	I	94.1	Very high	90.1	Very high	0 Å²	0	65.4 Å²	65.4	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-55.7	-48.5	171.2	-69.8	163.7	0	0	0	110.6	F255 F323 D325 F327 V333 V335 T347 N353 A354 R355	F255-I351 HydrophobicContact CZ-CG1 3.99Å; F323-I351 HydrophobicContact CB-CD1 4.16Å; D325-I351 HydrophobicContact CB-CG2 4.42Å; F327-I351 HydrophobicContact CD2-CG2 4.11Å; F327-I351 HydrophobicContact CE2-CG2 4.35Å; V333-I351 HydrophobicContact CG1-CG1 4.49Å; V333-I351 HydrophobicContact CG1-CG2 3.94Å; V335-I351 HydrophobicContact CB-CD1 4.43Å; V335-I351 HydrophobicContact CG2-CD1 3.93Å; V335-I351 HydrophobicContact CG2-CG1 4.06Å; T347-I351 HydrophobicContact CG2-CD1 4.22Å; T347-I351 VanDerWaalsContact O-CG1 3.32Å; T347-I351 WeakPolarHBondContact O-CG1 3.28Å; T347-I351 PolarHBondContact O-N 2.85Å; I351-N353 VanDerWaalsContact C-N 3.3Å; I351-N353 PolarHBondContact O-N 2.95Å; I351-A354 PolarHBondContact O-N 3.02Å; I351-R355 PolarHBondContact O-N 3.5Å
352	R	93.3	Very high	89.6	Confident	176 Å²	176	62.6 Å²	62.6	66%	0.664	32%	0.318	S	S	*	.	H	α-helix	trans	-64.7	-30.5	179.4	-175.7	178.7	179.4	-171	0.7	113.3	L348 I349 N350	L348-R352 WeakPolarHBondContact O-CB 3.18Å; L348-R352 PolarHBondContact O-N 2.84Å; I349-R352 PolarHBondContact O-N 2.99Å; N350-R352 VanDerWaalsContact C-N 3.34Å; N350-R352 PolarHBondContact O-N 3Å
353	N	93	Very high	88.8	Confident	86 Å²	86	69.1 Å²	69.1	46%	0.46	34%	0.341	S	S	.	.	H	α-helix	trans	-75.8	-45.4	175	-75.9	-28.9	0	0	0	111.4	I349 N350 I351 R355 K356	I349-N353 WeakPolarHBondContact O-CB 3.37Å; I349-N353 PolarHBondContact O-N 2.88Å; I349-N353 PolarHBondContact O-ND2 3.31Å; N350-N353 PolarHBondContact O-N 3.47Å; I351-N353 VanDerWaalsContact C-N 3.3Å; I351-N353 PolarHBondContact O-N 2.95Å; N353-R355 VanDerWaalsContact C-N 3.33Å; N353-R355 PolarHBondContact O-N 2.86Å; N353-K356 PolarHBondContact O-N 2.99Å
354	A	94.2	Very high	87.1	Confident	14 Å²	14	68.9 Å²	68.9	12%	0.116	34%	0.338	C	S	.	.	H	α-helix	trans	-63.6	-33.5	179.4	0	0	0	0	0	113.1	F255 F327 N350 I351 K356 H357 F358	F255-A354 HydrophobicContact CD2-CB 3.46Å; F255-A354 VanDerWaalsContact CD2-CB 3.46Å; F255-A354 HydrophobicContact CE2-CB 3.36Å; F255-A354 HydrophobicContact CG-CB 4.26Å; F255-A354 HydrophobicContact CZ-CB 4.09Å; F327-A354 HydrophobicContact CE2-CB 3.87Å; F327-A354 HydrophobicContact CZ-CB 3.83Å; N350-A354 WeakPolarHBondContact O-CB 3.39Å; N350-A354 PolarHBondContact O-N 2.83Å; I351-A354 PolarHBondContact O-N 3.02Å; A354-K356 PolarHBondContact O-N 3.41Å; A354-K356 VanDerWaalsContact O-N 3.07Å; A354-H357 WeakPolarHBondContact O-CA 3.23Å; A354-H357 WeakPolarHBondContact O-CB 3.45Å; A354-H357 PolarHBondContact O-N 2.85Å; A354-F358 HydrophobicContact CB-CE2 4.5Å; A354-F358 WeakPolarHBondContact O-CD2 3.48Å; A354-F358 PolarHBondContact O-N 3.5Å
355	R	93.7	Very high	85.3	Confident	56 Å²	56	70.1 Å²	70.1	21%	0.211	34%	0.342	C	S	.	.	H	α-helix	trans	-40.9	-46.1	170.5	170.1	168.8	-50.6	139.2	16.7	113.3	D325 I326 F327 I351 N353 H357 F358 E359	D325-R355 IonicContact OD2-CZ 3.19Å; D325-R355 IonicContact OD2-NH2 3.64Å; D325-R355 PolarHBondContact OD2-NH2 3.16Å; I326-R355 VanDerWaalsContact O-CZ 3.27Å; I326-R355 PolarHBondContact O-NE 2.92Å; I326-R355 PolarHBondContact O-NH2 3.24Å; F327-R355 WeakPolarHBondContact O-CB 3.32Å; F327-R355 WeakPolarHBondContact O-CD 3.46Å; F327-R355 WeakPolarHBondContact O-CG 3.24Å; F327-R355 PolarHBondContact O-NE 2.9Å; I351-R355 PolarHBondContact O-N 3.5Å; N353-R355 VanDerWaalsContact C-N 3.33Å; N353-R355 PolarHBondContact O-N 2.86Å; R355-H357 PolarHBondContact O-N 3.34Å; R355-F358 PolarHBondContact O-N 2.69Å; R355-E359 HydrophobicContact CG-CG 4.33Å; R355-E359 VanDerWaalsContact CG-OE1 3.23Å; R355-E359 WeakPolarHBondContact CG-OE1 3.28Å; R355-E359 WeakPolarHBondContact O-CB 3.19Å; R355-E359 WeakPolarHBondContact O-CG 3.07Å; R355-E359 PolarHBondContact O-N 3.01Å
356	K	89.8	Confident	83.1	Confident	138 Å²	138	68.6 Å²	68.6	60%	0.6	33%	0.333	S	S	*	.	H	α-helix	trans	-66.5	-19.3	-179.4	-61.6	175	-178.4	169.3	0	114.5	N353 A354 K360	N353-K356 PolarHBondContact O-N 2.99Å; A354-K356 PolarHBondContact O-N 3.41Å; A354-K356 VanDerWaalsContact O-N 3.07Å; K356-K360 WeakPolarHBondContact O-CG 3.24Å
357	H	89.9	Confident	80.4	Confident	91 Å²	91	72 Å²	72	42%	0.421	35%	0.351	S	S	.	.	H	α-helix	trans	-86.2	-51	174.8	-174.9	100.7	0	0	0	110.1	N251 A354 R355 E359 K360 L361	N251-H357 PolarHBondContact OD1-NE2 2.94Å; A354-H357 WeakPolarHBondContact O-CA 3.23Å; A354-H357 WeakPolarHBondContact O-CB 3.45Å; A354-H357 PolarHBondContact O-N 2.85Å; R355-H357 PolarHBondContact O-N 3.34Å; H357-E359 PolarHBondContact O-N 3.48Å; H357-K360 WeakPolarHBondContact O-CB 3.34Å; H357-K360 PolarHBondContact O-N 3.03Å; H357-L361 PolarHBondContact O-N 3.46Å
358	F	88.9	Confident	77.9	Confident	9 Å²	9	80.3 Å²	80.3	4%	0.039	39%	0.387	C	S	.	.	H	α-helix	trans	-67.4	-34.4	-178.8	-72.8	-100.7	0	0	0	112.8	L248 N251 L252 F255 F327 T328 A354 R355 K360 L361 E362	L248-F358 HydrophobicContact CD1-CD1 3.91Å; L248-F358 HydrophobicContact CD1-CE1 3.89Å; N251-F358 HydrophobicContact CB-CE1 4.14Å; N251-F358 HydrophobicContact CB-CZ 3.96Å; L252-F358 HydrophobicContact CD1-CE1 4.39Å; L252-F358 HydrophobicContact CD1-CZ 4.34Å; F255-F358 HydrophobicContact CB-CE2 4.3Å; F255-F358 HydrophobicContact CB-CZ 4.39Å; F327-F358 HydrophobicContact CD1-CB 4.26Å; F327-F358 HydrophobicContact CD1-CD1 4.49Å; F327-F358 HydrophobicContact CD1-CG 4.19Å; F327-F358 HydrophobicContact CE1-CB 3.84Å; F327-F358 AromaticContact CE1-CD1 3.73Å; F327-F358 HydrophobicContact CE1-CD1 3.73Å; F327-F358 AromaticContact CE1-CD2 3.36Å; F327-F358 HydrophobicContact CE1-CD2 3.36Å; F327-F358 HydrophobicContact CE1-CE1 4.06Å; F327-F358 AromaticContact CE1-CE2 3.74Å; F327-F358 HydrophobicContact CE1-CE2 3.74Å; F327-F358 AromaticContact CE1-CG 3.35Å; F327-F358 HydrophobicContact CE1-CG 3.35Å; F327-F358 HydrophobicContact CE1-CZ 4.06Å; F327-F358 HydrophobicContact CZ-CB 4.46Å; F327-F358 AromaticContact CZ-CD2 3.42Å; F327-F358 HydrophobicContact CZ-CD2 3.42Å; F327-F358 VanDerWaalsContact CZ-CD2 3.42Å; F327-F358 AromaticContact CZ-CE2 3.67Å; F327-F358 HydrophobicContact CZ-CE2 3.67Å; F327-F358 AromaticContact CZ-CG 3.92Å; F327-F358 HydrophobicContact CZ-CG 3.92Å; F327-F358 HydrophobicContact CZ-CZ 4.34Å; T328-F358 HydrophobicContact CG2-CB 3.83Å; A354-F358 HydrophobicContact CB-CE2 4.5Å; A354-F358 WeakPolarHBondContact O-CD2 3.48Å; A354-F358 PolarHBondContact O-N 3.5Å; R355-F358 PolarHBondContact O-N 2.69Å; F358-K360 PolarHBondContact O-N 2.82Å; F358-K360 VanDerWaalsContact O-N 3.14Å; F358-L361 HydrophobicContact CD1-CD1 4.05Å; F358-L361 HydrophobicContact CE1-CD1 4.4Å; F358-L361 HydrophobicContact CG-CD1 4.39Å; F358-L361 PolarHBondContact O-N 3.49Å; F358-L361 VanDerWaalsContact O-N 3.09Å; F358-E362 PolarHBondContact O-N 3.5Å; F358-E362 VanDerWaalsContact O-N 3.17Å
359	E	88.2	Confident	75.1	Confident	56 Å²	56	84.8 Å²	84.8	26%	0.262	41%	0.406	S	S	.	.	H	α-helix	trans	-60.8	-18.4	169.7	-82.1	-172.8	-146.6	0	0	114.3	T328 R355 H357 R363	T328-E359 HydrophobicContact CG2-CG 4.13Å; R355-E359 HydrophobicContact CG-CG 4.33Å; R355-E359 VanDerWaalsContact CG-OE1 3.23Å; R355-E359 WeakPolarHBondContact CG-OE1 3.28Å; R355-E359 WeakPolarHBondContact O-CB 3.19Å; R355-E359 WeakPolarHBondContact O-CG 3.07Å; R355-E359 PolarHBondContact O-N 3.01Å; H357-E359 PolarHBondContact O-N 3.48Å; E359-R363 WeakPolarHBondContact O-CD 3.37Å; E359-R363 VanDerWaalsContact O-CG 3.28Å; E359-R363 WeakPolarHBondContact O-CG 3.32Å; E359-R363 PolarHBondContact O-NE 3.33Å; E359-R363 IonicContact OE2-NH2 3.54Å; E359-R363 PolarHBondContact OE2-NH2 3.27Å
360	K	84.8	Confident	72.3	Confident	142 Å²	142	85.3 Å²	85.3	62%	0.617	42%	0.417	S	S	*	.	H	α-helix	trans	-84.9	-41.1	171.8	-66	174.7	-179.1	-176.9	0	111	K356 H357 F358 E362 R363 V364	K356-K360 WeakPolarHBondContact O-CG 3.24Å; H357-K360 WeakPolarHBondContact O-CB 3.34Å; H357-K360 PolarHBondContact O-N 3.03Å; F358-K360 PolarHBondContact O-N 2.82Å; F358-K360 VanDerWaalsContact O-N 3.14Å; K360-E362 VanDerWaalsContact C-N 3.32Å; K360-E362 PolarHBondContact O-N 2.61Å; K360-R363 PolarHBondContact O-N 3.31Å; K360-V364 VanDerWaalsContact O-CG2 3.3Å; K360-V364 WeakPolarHBondContact O-CG2 3.39Å; K360-V364 PolarHBondContact O-N 3.24Å
361	L	79.1	Confident	69.5	Low	40 Å²	40	89.7 Å²	89.7	21%	0.209	44%	0.44	C	S	.	.	H	α-helix	trans	-56.3	-46.1	177.9	-61.8	175.7	0	0	0	111.1	N251 H357 F358 R363 V364	N251-L361 HydrophobicContact CB-CD1 4.03Å; H357-L361 PolarHBondContact O-N 3.46Å; F358-L361 HydrophobicContact CD1-CD1 4.05Å; F358-L361 HydrophobicContact CE1-CD1 4.4Å; F358-L361 HydrophobicContact CG-CD1 4.39Å; F358-L361 PolarHBondContact O-N 3.49Å; F358-L361 VanDerWaalsContact O-N 3.09Å; L361-R363 PolarHBondContact O-N 3.37Å; L361-V364 PolarHBondContact O-N 3.36Å
362	E	74.4	Confident	66.7	Low	32 Å²	32	96.8 Å²	96.8	15%	0.15	48%	0.477	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-15.6	176.1	-69.2	-176.9	-173.8	0	0	114.9	T328 N330 F358 K360	T328-E362 VanDerWaalsContact CB-OE1 3.28Å; T328-E362 WeakPolarHBondContact CB-OE1 3.31Å; T328-E362 WeakPolarHBondContact CG2-OE1 3.37Å; T328-E362 VanDerWaalsContact OG1-CD 3.28Å; T328-E362 PolarHBondContact OG1-OE1 2.87Å; T328-E362 PolarHBondContact OG1-OE2 3.17Å; N330-E362 PolarHBondContact ND2-OE2 2.95Å; F358-E362 PolarHBondContact O-N 3.5Å; F358-E362 VanDerWaalsContact O-N 3.17Å; K360-E362 VanDerWaalsContact C-N 3.32Å; K360-E362 PolarHBondContact O-N 2.61Å
363	R	69.1	Low	63.9	Low	169 Å²	169	97.2 Å²	97.2	64%	0.638	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.4	-12.1	-177.6	-61.9	177.8	-158.6	-149.4	5.7	114.2	E359 K360 L361	E359-R363 WeakPolarHBondContact O-CD 3.37Å; E359-R363 VanDerWaalsContact O-CG 3.28Å; E359-R363 WeakPolarHBondContact O-CG 3.32Å; E359-R363 PolarHBondContact O-NE 3.33Å; E359-R363 IonicContact OE2-NH2 3.54Å; E359-R363 PolarHBondContact OE2-NH2 3.27Å; K360-R363 PolarHBondContact O-N 3.31Å; L361-R363 PolarHBondContact O-N 3.37Å
364	V	54.7	Low	61.1	Low	80 Å²	80	108.2 Å²	108.2	49%	0.485	52%	0.524	S	S	.	.			trans	-85.8	-10.8	-165.9	163	0	0	0	0	114.1	K360 L361 G366	K360-V364 VanDerWaalsContact O-CG2 3.3Å; K360-V364 WeakPolarHBondContact O-CG2 3.39Å; K360-V364 PolarHBondContact O-N 3.24Å; L361-V364 PolarHBondContact O-N 3.36Å; V364-G366 PolarHBondContact O-N 3.37Å
365	D	49.4	Very low	59.5	Low	50 Å²	50	113 Å²	113	27%	0.267	54%	0.544	S	S	.	.			trans	-76.8	26.4	176.9	-75.9	-33.1	0	0	0	115.2	M39 N116 N244	M39-D365 HydrophobicContact CE-CB 4.29Å; N116-D365 PolarHBondContact ND2-OD2 3.48Å; N244-D365 PolarHBondContact ND2-OD1 2.7Å; N244-D365 PolarHBondContact ND2-OD2 2.67Å
366	G	43.7	Very low	57.7	Low	30 Å²	30	115.9 Å²	115.9	31%	0.309	56%	0.562	S	S	.	*	S	Bend	trans	-70.3	146.3	152.9	0	0	0	0	0	109.5	V364 K368	V364-G366 PolarHBondContact O-N 3.37Å; G366-K368 PolarHBondContact O-N 2.91Å
367	P	36.5	Very low	55.9	Low	107 Å²	107	114.7 Å²	114.7	70%	0.695	56%	0.56	S	S	*	*			trans	-60.1	117.4	-177.9	24.4	-33.5	0	0	0	110.4	Q369	P367-Q369 PolarHBondContact O-N 3.44Å
368	K	38.8	Very low	53.9	Low	180 Å²	180	116.1 Å²	116.1	78%	0.783	57%	0.568	S	S	*	*			trans	-60.1	102.9	172.8	-71.4	-179.4	-177.5	170.8	0	108.4	G366 C370	G366-K368 PolarHBondContact O-N 2.91Å; K368-C370 PolarHBondContact O-N 3.12Å
369	Q	34.4	Very low	51.7	Low	169 Å²	169	122.8 Å²	122.8	79%	0.79	60%	0.601	S	S	*	*			trans	-63.6	103.7	176.7	-164.8	172.6	23.5	0	0	107.9	P367 L371	P367-Q369 PolarHBondContact O-N 3.44Å; Q369-L371 VanDerWaalsContact C-N 3.28Å; Q369-L371 PolarHBondContact O-N 3.5Å
370	C	34.4	Very low	49.3	Very low	110 Å²	110	127.3 Å²	127.3	74%	0.743	62%	0.623	S	S	*	*			trans	-72.6	88.9	-178.5	-166.1	0	0	0	0	108.3	K368 L372	K368-C370 PolarHBondContact O-N 3.12Å; C370-L372 PolarHBondContact O-N 3.42Å
371	L	36	Very low	46.7	Very low	148 Å²	148	126.2 Å²	126.2	78%	0.775	62%	0.624	S	S	*	*			trans	-69.3	76.1	172.7	-78.9	166.6	0	0	0	109.4	Q369 M373	Q369-L371 VanDerWaalsContact C-N 3.28Å; Q369-L371 PolarHBondContact O-N 3.5Å; L371-M373 VanDerWaalsContact C-N 3.31Å; L371-M373 PolarHBondContact O-N 3.16Å
372	L	33.8	Very low	44.3	Very low	149 Å²	149	132.8 Å²	132.8	78%	0.78	66%	0.656	S	S	*	*			trans	-56.8	97.2	156.4	-90.9	155.3	0	0	0	107.9	C370 R374	C370-L372 PolarHBondContact O-N 3.42Å; L372-R374 PolarHBondContact O-N 3.12Å
373	M	35.9	Very low	41.7	Very low	185 Å²	185	141.3 Å²	141.3	91%	0.911	70%	0.698	S	S	*	*			trans	-57.7	132.3	163.6	-71.2	-177.4	166.9	0	0	108.8	L371	L371-M373 VanDerWaalsContact C-N 3.31Å; L371-M373 PolarHBondContact O-N 3.16Å
374	R	34.1	Very low	39.3	Very low	318 Å²	318	138.7 Å²	138.7	100%	1.2	70%	0.703	S	S	*	*			trans	-126.1	0	165.6	-87.8	-171.6	167	-165.7	-2.5	107.7	L372	L372-R374 PolarHBondContact O-N 3.12Å

Retrieved 374 of 374 residues in 1165.1 ms (Link to these results)

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