A0A087XQR4_POEFO Loading...

Peroxiredoxin like 2C

AlphaFold DB (A0A3B3TNX5), UniProt , Accession A0A087XQR4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 225 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38	Very low	35	Very low	251 Å²	251	155.9 Å²	155.9	100%	1.236	84%	0.836	S	S	*	*				0	103.5	0	-66.7	-168.8	174.1	0	0	106.3
2	A	35.3	Very low	34.8	Very low	98 Å²	98	154.6 Å²	154.6	81%	0.81	84%	0.837	S	S	*	*			trans	-103.8	127.3	-176.6	0	0	0	0	0	108.2	L4	A2-L4 PolarHBondContact O-N 2.81Å
3	E	33.1	Very low	34.4	Very low	188 Å²	188	147.8 Å²	147.8	88%	0.879	81%	0.809	S	S	*	*			trans	-64	123.9	-177.8	-68.2	-178	143.9	0	0	110.9	V5	E3-V5 PolarHBondContact O-N 2.93Å; E3-V5 VanDerWaalsContact O-N 3.11Å
4	L	35.5	Very low	34.5	Very low	173 Å²	173	147.4 Å²	147.4	91%	0.906	81%	0.813	S	S	*	*			trans	-72.3	95.7	169.1	-89.8	147.2	0	0	0	108.3	A2 S6	A2-L4 PolarHBondContact O-N 2.81Å; L4-S6 PolarHBondContact O-N 2.58Å; L4-S6 VanDerWaalsContact O-N 3.1Å
5	V	37.4	Very low	34.2	Very low	129 Å²	129	147.5 Å²	147.5	78%	0.782	81%	0.805	S	S	*	*			trans	-68.4	105.6	166.5	-176.2	0	0	0	0	107.2	E3	E3-V5 PolarHBondContact O-N 2.93Å; E3-V5 VanDerWaalsContact O-N 3.11Å
6	S	36.7	Very low	34.2	Very low	92 Å²	92	150.1 Å²	150.1	64%	0.643	81%	0.806	S	S	*	*			trans	-59.9	133.2	172.5	45.8	0	0	0	0	109.3	L4 I8	L4-S6 PolarHBondContact O-N 2.58Å; L4-S6 VanDerWaalsContact O-N 3.1Å; S6-I8 PolarHBondContact O-N 3.06Å; S6-I8 VanDerWaalsContact O-N 3.15Å
7	P	35.1	Very low	34.5	Very low	113 Å²	113	150.1 Å²	150.1	73%	0.734	79%	0.792	S	S	*	*			trans	-63.6	123.1	176.1	24.3	-30	0	0	0	108.2	T9	P7-T9 VanDerWaalsContact C-N 3.3Å; P7-T9 PolarHBondContact O-N 3.48Å
8	I	33.2	Very low	34.4	Very low	154 Å²	154	152.6 Å²	152.6	79%	0.79	80%	0.795	S	S	*	*			trans	-61.2	93.8	174.2	-61.2	168.5	0	0	0	107.2	S6 R10	S6-I8 PolarHBondContact O-N 3.06Å; S6-I8 VanDerWaalsContact O-N 3.15Å; I8-R10 HydrophobicContact CG2-CB 4.25Å; I8-R10 PolarHBondContact O-N 3.47Å
9	T	38.3	Very low	34.6	Very low	131 Å²	131	150.3 Å²	150.3	80%	0.804	80%	0.801	S	S	*	*			trans	-71.7	80.3	162.9	35.3	0	0	0	0	107.1	P7 Q11	P7-T9 VanDerWaalsContact C-N 3.3Å; P7-T9 PolarHBondContact O-N 3.48Å; T9-Q11 PolarHBondContact O-N 3.2Å
10	R	32.8	Very low	34.6	Very low	210 Å²	210	146.1 Å²	146.1	79%	0.792	80%	0.795	S	S	*	*			trans	-69.9	83.8	163.9	-162.1	175.2	-178.7	-177.8	-1.8	106.4	I8 V12	I8-R10 HydrophobicContact CG2-CB 4.25Å; I8-R10 PolarHBondContact O-N 3.47Å; R10-V12 PolarHBondContact O-N 3.03Å
11	Q	29.3	Very low	34.9	Very low	176 Å²	176	143.3 Å²	143.3	82%	0.822	78%	0.783	S	S	*	*			trans	-43.6	115.3	165.1	-160.7	172.5	-4	0	0	105.7	T9 S13	T9-Q11 PolarHBondContact O-N 3.2Å; Q11-S13 PolarHBondContact O-N 3.16Å
12	V	33	Very low	35	Very low	140 Å²	140	136.6 Å²	136.6	85%	0.848	76%	0.758	S	S	*	*			trans	-61.7	95.1	173.9	176.9	0	0	0	0	104.6	R10 T14	R10-V12 PolarHBondContact O-N 3.03Å; V12-T14 PolarHBondContact O-N 3.28Å
13	S	29.3	Very low	35.5	Very low	67 Å²	67	138.5 Å²	138.5	47%	0.469	76%	0.76	S	S	.	*			trans	-51.5	138.1	170.6	33.5	0	0	0	0	106.5	Q11 E15	Q11-S13 PolarHBondContact O-N 3.16Å; S13-E15 PolarHBondContact O-N 3.03Å
14	T	35.5	Very low	36.4	Very low	141 Å²	141	133.5 Å²	133.5	87%	0.865	74%	0.742	S	S	*	*			trans	-56.3	71.3	168	-27.8	0	0	0	0	108.5	V12 K16	V12-T14 PolarHBondContact O-N 3.28Å; T14-K16 PolarHBondContact O-N 2.91Å
15	E	30.9	Very low	38	Very low	150 Å²	150	132.9 Å²	132.9	70%	0.701	74%	0.74	S	S	*	*			trans	-69.3	94.1	171	-67.9	-157.8	-169.6	0	0	104.3	S13 W17	S13-E15 PolarHBondContact O-N 3.03Å; E15-W17 VanDerWaalsContact C-N 3.33Å; E15-W17 PolarHBondContact O-N 3.03Å
16	K	34.3	Very low	40.2	Very low	189 Å²	189	127.4 Å²	127.4	82%	0.822	71%	0.706	S	S	*	*			trans	-38.4	104.7	164.3	-78.1	176.1	172.2	177.9	0	106.4	T14 K18	T14-K16 PolarHBondContact O-N 2.91Å; K16-K18 VanDerWaalsContact C-N 3.28Å; K16-K18 PolarHBondContact O-N 2.8Å
17	W	38.1	Very low	42.6	Very low	150 Å²	150	126.9 Å²	126.9	57%	0.568	70%	0.696	S	S	*	*			trans	-49.9	105.4	160.1	-95.6	52.4	0	0	0	105.1	E15 A19	E15-W17 VanDerWaalsContact C-N 3.33Å; E15-W17 PolarHBondContact O-N 3.03Å; W17-A19 PolarHBondContact O-N 3.26Å
18	K	33.8	Very low	45.4	Very low	194 Å²	194	121.6 Å²	121.6	84%	0.843	66%	0.661	S	S	*	*			trans	-60.8	117.1	-176.7	-83.4	-177.8	175.1	178.1	0	106	K16 G20	K16-K18 VanDerWaalsContact C-N 3.28Å; K16-K18 PolarHBondContact O-N 2.8Å; K18-G20 PolarHBondContact O-N 2.96Å
19	A	37.8	Very low	48.2	Very low	109 Å²	109	120.8 Å²	120.8	90%	0.901	65%	0.652	S	S	*	*	S	Bend	trans	-56.5	92.8	167.2	0	0	0	0	0	108.1	W17	W17-A19 PolarHBondContact O-N 3.26Å
20	G	34.4	Very low	50.7	Low	66 Å²	66	119.5 Å²	119.5	68%	0.68	64%	0.64	S	S	*	*			trans	-160.1	13.5	-175.7	0	0	0	0	0	111.7	K18	K18-G20 PolarHBondContact O-N 2.96Å
21	T	41.9	Very low	53.7	Low	88 Å²	88	109.5 Å²	109.5	54%	0.54	60%	0.603	S	S	.	*	S	Bend	trans	-68.4	131.1	160.3	18.1	0	0	0	0	107.5	T23	T21-T23 PolarHBondContact O-N 3.14Å
22	P	38.8	Very low	56.9	Low	111 Å²	111	103 Å²	103	72%	0.721	57%	0.572	S	S	*	*			trans	-54.9	121.5	171.9	18.3	-24.7	0	0	0	107.2	V24	P22-V24 PolarHBondContact O-N 3.49Å
23	T	45.6	Very low	59.9	Low	138 Å²	138	101.8 Å²	101.8	85%	0.847	56%	0.561	S	S	*	*			trans	-62.5	96.1	169.4	49.8	0	0	0	0	105.8	T21 D25	T21-T23 PolarHBondContact O-N 3.14Å; T23-D25 PolarHBondContact O-N 3.07Å
24	V	53.6	Low	63.2	Low	83 Å²	83	99.1 Å²	99.1	50%	0.503	54%	0.542	S	S	.	.			trans	-62.3	108.2	168.4	-174.6	0	0	0	0	104.2	P22 I26	P22-V24 PolarHBondContact O-N 3.49Å; V24-I26 VanDerWaalsContact C-N 3.26Å; V24-I26 HydrophobicContact CB-CD1 4.35Å; V24-I26 HydrophobicContact CB-CG1 4.1Å; V24-I26 HydrophobicContact CG1-CD1 4.15Å; V24-I26 HydrophobicContact CG1-CG1 3.59Å; V24-I26 PolarHBondContact O-N 3.02Å
25	D	68.3	Low	66.1	Low	160 Å²	160	96.1 Å²	96.1	86%	0.856	52%	0.52	S	S	*	.			trans	-70.5	91	174.8	-171	14.8	0	0	0	107	T23	T23-D25 PolarHBondContact O-N 3.07Å
26	I	83.8	Confident	69.3	Low	13 Å²	13	89 Å²	89	7%	0.067	49%	0.487	C	S	.	.			trans	-90.6	121.1	-178.1	-67.6	168.6	0	0	0	108.2	V24 L28 L126 I178 V186 C189 F191	V24-I26 VanDerWaalsContact C-N 3.26Å; V24-I26 HydrophobicContact CB-CD1 4.35Å; V24-I26 HydrophobicContact CB-CG1 4.1Å; V24-I26 HydrophobicContact CG1-CD1 4.15Å; V24-I26 HydrophobicContact CG1-CG1 3.59Å; V24-I26 PolarHBondContact O-N 3.02Å; I26-L28 HydrophobicContact CG2-CD2 3.98Å; I26-L126 HydrophobicContact CG2-CD2 3.56Å; I26-I178 HydrophobicContact CD1-CD1 4.48Å; I26-V186 WeakPolarHBondContact O-CG2 3.22Å; I26-C189 HydrophobicContact CD1-CB 3.51Å; I26-C189 WeakPolarHBondContact CD1-SG 3.43Å; I26-F191 HydrophobicContact CD1-CE1 3.95Å; I26-F191 HydrophobicContact CD1-CE2 3.76Å; I26-F191 HydrophobicContact CD1-CZ 3.25Å; I26-F191 HydrophobicContact CG1-CE2 4.49Å; I26-F191 HydrophobicContact CG1-CZ 4.25Å
27	N	86.3	Confident	72.4	Confident	82 Å²	82	83.1 Å²	83.1	44%	0.439	46%	0.46	S	S	.	.			trans	-90.5	114.3	170.4	-175.3	2.3	0	0	0	110	K29	N27-K29 PolarHBondContact O-N 3.39Å; N27-K29 VanDerWaalsContact OD1-CB 3.22Å; N27-K29 WeakPolarHBondContact OD1-CB 3.34Å; N27-K29 WeakPolarHBondContact OD1-CG 3.3Å; N27-K29 PolarHBondContact OD1-N 2.9Å
28	L	93.7	Very high	75.2	Confident	1 Å²	1	77.3 Å²	77.3	1%	0.005	44%	0.44	C	S	.	.	G	3₁₀ helix	trans	-74.1	-13.9	178.3	-63.8	-178.2	0	0	0	113.7	I26 D30 V31 E32 F46 Y50 L126 A180 V186	I26-L28 HydrophobicContact CG2-CD2 3.98Å; L28-D30 PolarHBondContact O-N 2.78Å; L28-D30 VanDerWaalsContact O-N 3.14Å; L28-V31 HydrophobicContact CB-CG2 4.36Å; L28-V31 HydrophobicContact CD2-CG2 4.13Å; L28-V31 WeakPolarHBondContact O-CG2 3.18Å; L28-V31 PolarHBondContact O-N 2.75Å; L28-E32 WeakPolarHBondContact O-CG 3.06Å; L28-E32 PolarHBondContact O-N 2.89Å; L28-F46 HydrophobicContact CD2-CE1 4.28Å; L28-Y50 HydrophobicContact CD1-CD1 4.36Å; L28-Y50 HydrophobicContact CD1-CD2 4.38Å; L28-Y50 HydrophobicContact CD1-CE1 3.99Å; L28-Y50 HydrophobicContact CD1-CE2 3.99Å; L28-L126 HydrophobicContact CD2-CD2 4.25Å; L28-A180 HydrophobicContact CD1-CB 3.61Å; L28-V186 HydrophobicContact CD1-CG2 3.7Å; L28-V186 HydrophobicContact CD2-CG2 4.28Å; L28-V186 HydrophobicContact CG-CG2 3.63Å
29	K	92.4	Very high	78.1	Confident	137 Å²	137	74.7 Å²	74.7	60%	0.596	43%	0.425	S	S	*	.	G	3₁₀ helix	trans	-54.8	-36.9	-177.1	-70.5	177.9	179.9	-178.7	0	113	N27 V31 E32	N27-K29 PolarHBondContact O-N 3.39Å; N27-K29 VanDerWaalsContact OD1-CB 3.22Å; N27-K29 WeakPolarHBondContact OD1-CB 3.34Å; N27-K29 WeakPolarHBondContact OD1-CG 3.3Å; N27-K29 PolarHBondContact OD1-N 2.9Å; K29-V31 PolarHBondContact O-N 3.37Å; K29-E32 PolarHBondContact O-N 2.86Å
30	D	91.6	Very high	80.8	Confident	104 Å²	104	79.1 Å²	79.1	56%	0.556	42%	0.419	S	S	*	.	G	3₁₀ helix	trans	-70.2	-20	-177.6	-62.9	-37.4	0	0	0	112.9	L28 K125	L28-D30 PolarHBondContact O-N 2.78Å; L28-D30 VanDerWaalsContact O-N 3.14Å; D30-K125 VanDerWaalsContact O-CD 3.26Å; D30-K125 WeakPolarHBondContact O-CD 3.31Å; D30-K125 PolarHBondContact O-NZ 2.93Å
31	V	95.6	Very high	83.7	Confident	1 Å²	1	77.2 Å²	77.2	1%	0.006	40%	0.398	C	S	.	.	G	3₁₀ helix	trans	-111.6	-4	-177.7	-65.8	0	0	0	0	114	L28 K29 D33 C34 F46 I122 K125 L126	L28-V31 HydrophobicContact CB-CG2 4.36Å; L28-V31 HydrophobicContact CD2-CG2 4.13Å; L28-V31 WeakPolarHBondContact O-CG2 3.18Å; L28-V31 PolarHBondContact O-N 2.75Å; K29-V31 PolarHBondContact O-N 3.37Å; V31-D33 VanDerWaalsContact C-N 3.29Å; V31-D33 PolarHBondContact O-N 2.82Å; V31-C34 VanDerWaalsContact O-CB 3.3Å; V31-C34 WeakPolarHBondContact O-CB 3.35Å; V31-C34 PolarHBondContact O-N 2.9Å; V31-F46 HydrophobicContact CB-CD1 3.98Å; V31-F46 HydrophobicContact CB-CE1 4.33Å; V31-F46 HydrophobicContact CG2-CD1 3.63Å; V31-F46 HydrophobicContact CG2-CE1 3.59Å; V31-F46 WeakPolarHBondContact O-CB 3.2Å; V31-I122 HydrophobicContact CB-CG2 4.34Å; V31-I122 HydrophobicContact CG1-CG2 4.23Å; V31-K125 HydrophobicContact CG1-CB 3.43Å; V31-K125 VanDerWaalsContact CG1-CB 3.43Å; V31-K125 HydrophobicContact CG1-CD 3.85Å; V31-K125 HydrophobicContact CG1-CG 4.33Å; V31-L126 HydrophobicContact CG1-CD2 4.08Å; V31-L126 HydrophobicContact CG1-CG 4.12Å; V31-L126 HydrophobicContact CG2-CD2 3.92Å
32	E	96.1	Very high	86.4	Confident	39 Å²	39	76 Å²	76	18%	0.182	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.9	-44.4	-176.6	-86.7	178.1	-163.8	0	0	113.7	L28 K29 F46 K47 Y50 S184	L28-E32 WeakPolarHBondContact O-CG 3.06Å; L28-E32 PolarHBondContact O-N 2.89Å; K29-E32 PolarHBondContact O-N 2.86Å; E32-F46 PolarHBondContact O-N 2.91Å; E32-K47 HydrophobicContact CB-CB 4.1Å; E32-K47 HydrophobicContact CB-CD 4.15Å; E32-K47 HydrophobicContact CG-CB 4.01Å; E32-K47 HydrophobicContact CG-CD 4.48Å; E32-K47 PolarHBondContact O-N 2.96Å; E32-Y50 WeakPolarHBondContact CG-OH 3.4Å; E32-S184 WeakPolarHBondContact OE1-CB 3.26Å; E32-S184 PolarHBondContact OE1-OG 2.9Å
33	D	96.7	Very high	89.2	Confident	114 Å²	114	73.5 Å²	73.5	61%	0.61	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.6	4.9	-177.4	-59.9	-39.5	0	0	0	113.4	V31 L35 K47	V31-D33 VanDerWaalsContact C-N 3.29Å; V31-D33 PolarHBondContact O-N 2.82Å; D33-L35 PolarHBondContact O-N 2.92Å; D33-K47 IonicContact OD1-NZ 2.81Å; D33-K47 PolarHBondContact OD1-NZ 2.96Å
34	C	97.2	Very high	91.7	Very high	11 Å²	11	70.2 Å²	70.2	7%	0.074	35%	0.35	C	S	.	.			trans	-63.8	136.1	171.5	-74.9	0	0	0	0	110.2	V31 P45 F46 I122	V31-C34 VanDerWaalsContact O-CB 3.3Å; V31-C34 WeakPolarHBondContact O-CB 3.35Å; V31-C34 PolarHBondContact O-N 2.9Å; C34-P45 CarbonylContact O-C 3.57Å; C34-F46 WeakPolarHBondContact O-CB 3.28Å; C34-F46 PolarHBondContact O-N 3.3Å; C34-I122 HydrophobicContact CB-CD1 4.13Å; C34-I122 HydrophobicContact CB-CG1 3.51Å
35	L	97.8	Very high	93.8	Very high	79 Å²	79	68.5 Å²	68.5	41%	0.414	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	128.1	-177.6	-61.6	-179.6	0	0	0	111.5	D33 Y37 F44	D33-L35 PolarHBondContact O-N 2.92Å; L35-Y37 HydrophobicContact CB-CE2 4.19Å; L35-F44 WeakPolarHBondContact CA-O 3.5Å
36	I	98	Very high	95.2	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	153.2	167.3	58.5	175.9	0	0	0	109.5	S43 F44 F46 L49 I93 Y115 V116 I122	I36-S43 CarbonylContact O-C 3.58Å; I36-S43 VanDerWaalsContact O-CA 3.28Å; I36-S43 WeakPolarHBondContact O-CA 3.21Å; I36-F44 HydrophobicContact CG1-CB 4.1Å; I36-F44 WeakPolarHBondContact CG1-O 3.33Å; I36-F44 PolarHBondContact N-O 2.74Å; I36-F44 PolarHBondContact O-N 2.92Å; I36-F46 HydrophobicContact CG2-CD2 4.26Å; I36-L49 HydrophobicContact CD1-CD1 3.61Å; I36-L49 HydrophobicContact CD1-CD2 3.66Å; I36-L49 HydrophobicContact CD1-CG 3.6Å; I36-I93 HydrophobicContact CG2-CD1 4.46Å; I36-Y115 HydrophobicContact CD1-CD1 3.94Å; I36-Y115 HydrophobicContact CD1-CD2 4.14Å; I36-Y115 HydrophobicContact CD1-CE1 4.4Å; I36-Y115 HydrophobicContact CD1-CG 3.81Å; I36-Y115 HydrophobicContact CG1-CD1 4.18Å; I36-Y115 HydrophobicContact CG1-CG 4.34Å; I36-V116 WeakPolarHBondContact CA-O 3.43Å; I36-I122 HydrophobicContact CG2-CD1 3.42Å; I36-I122 VanDerWaalsContact CG2-CD1 3.42Å
37	Y	97.9	Very high	95.9	Very high	65 Å²	65	63.1 Å²	63.1	26%	0.255	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	134	-175.5	-55.7	-100.2	0	0	0	110.9	L35 V42 Y115 V116 P118	L35-Y37 HydrophobicContact CB-CE2 4.19Å; Y37-V42 WeakPolarHBondContact CA-O 3.33Å; Y37-Y115 CarbonylContact O-C 3.56Å; Y37-Y115 WeakPolarHBondContact O-CA 3.43Å; Y37-Y115 WeakPolarHBondContact O-CB 3.32Å; Y37-V116 PolarHBondContact N-O 3.13Å; Y37-V116 PolarHBondContact O-N 2.88Å; Y37-P118 HydrophobicContact CD2-CG 4.11Å; Y37-P118 HydrophobicContact CE2-CG 4.42Å
38	D	97.2	Very high	96.4	Very high	28 Å²	28	60.8 Å²	60.8	15%	0.15	30%	0.299	C	S	.	.			trans	-79	-178	174.8	78.8	-3.8	0	0	0	112	R40 G41 V42 F44 H98 Y115	D38-R40 PolarHBondContact O-N 3.02Å; D38-R40 VanDerWaalsContact O-N 3.1Å; D38-R40 WeakPolarHBondContact OD1-CA 3.11Å; D38-R40 WeakPolarHBondContact OD1-CB 3.23Å; D38-R40 PolarHBondContact OD1-N 3.08Å; D38-G41 PolarHBondContact O-N 2.8Å; D38-G41 PolarHBondContact OD1-N 2.76Å; D38-V42 PolarHBondContact N-O 3.3Å; D38-V42 PolarHBondContact OD1-N 3.05Å; D38-F44 HydrophobicContact CB-CE2 3.99Å; D38-H98 WeakPolarHBondContact O-CB 3.33Å; D38-Y115 HydrophobicContact CB-CD1 4.02Å; D38-Y115 HydrophobicContact CB-CE1 3.97Å
39	R	94.5	Very high	96.6	Very high	140 Å²	140	60.7 Å²	60.7	53%	0.528	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-22.2	177.7	72.2	-177.7	67.6	-179.3	-0.8	114.9	I101	R39-I101 HydrophobicContact CB-CB 4.23Å; R39-I101 HydrophobicContact CB-CD1 4.46Å; R39-I101 HydrophobicContact CB-CG2 3.78Å
40	R	96	Very high	96.8	Very high	202 Å²	202	54.3 Å²	54.3	76%	0.762	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.5	-0.8	179.6	-61.3	174.2	63.2	-166	-1.1	111.9	D38 V42	D38-R40 PolarHBondContact O-N 3.02Å; D38-R40 VanDerWaalsContact O-N 3.1Å; D38-R40 WeakPolarHBondContact OD1-CA 3.11Å; D38-R40 WeakPolarHBondContact OD1-CB 3.23Å; D38-R40 PolarHBondContact OD1-N 3.08Å; R40-V42 VanDerWaalsContact C-N 3.28Å; R40-V42 HydrophobicContact CB-CG2 4.1Å
41	G	95.4	Very high	97.1	Very high	25 Å²	25	54.1 Å²	54.1	26%	0.258	27%	0.267	S	S	.	.			trans	76.7	13.1	-174.1	0	0	0	0	0	113.7	D38	D38-G41 PolarHBondContact O-N 2.8Å; D38-G41 PolarHBondContact OD1-N 2.76Å
42	V	97.7	Very high	97.1	Very high	62 Å²	62	60.5 Å²	60.5	38%	0.376	30%	0.301	S	S	.	.			trans	-75.7	130.5	175.1	-178.2	0	0	0	0	108.7	Y37 D38 R40 F44	Y37-V42 WeakPolarHBondContact CA-O 3.33Å; D38-V42 PolarHBondContact N-O 3.3Å; D38-V42 PolarHBondContact OD1-N 3.05Å; R40-V42 VanDerWaalsContact C-N 3.28Å; R40-V42 HydrophobicContact CB-CG2 4.1Å; V42-F44 HydrophobicContact CB-CE2 3.87Å; V42-F44 HydrophobicContact CB-CZ 4.22Å; V42-F44 HydrophobicContact CG1-CD2 4.49Å; V42-F44 HydrophobicContact CG1-CE1 4.45Å; V42-F44 HydrophobicContact CG1-CE2 3.68Å; V42-F44 HydrophobicContact CG1-CZ 3.66Å; V42-F44 WeakPolarHBondContact O-CD2 3.41Å; V42-F44 WeakPolarHBondContact O-CE2 3.49Å
43	S	97.5	Very high	97	Very high	59 Å²	59	60 Å²	60	41%	0.413	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	139.5	-178.2	61.9	0	0	0	0	112.7	I36	I36-S43 CarbonylContact O-C 3.58Å; I36-S43 VanDerWaalsContact O-CA 3.28Å; I36-S43 WeakPolarHBondContact O-CA 3.21Å
44	F	97.6	Very high	97	Very high	70 Å²	70	57 Å²	57	31%	0.307	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	147.8	174.8	-59.3	-91.7	0	0	0	110	L35 I36 D38 V42 Y115	L35-F44 WeakPolarHBondContact CA-O 3.5Å; I36-F44 HydrophobicContact CG1-CB 4.1Å; I36-F44 WeakPolarHBondContact CG1-O 3.33Å; I36-F44 PolarHBondContact N-O 2.74Å; I36-F44 PolarHBondContact O-N 2.92Å; D38-F44 HydrophobicContact CB-CE2 3.99Å; V42-F44 HydrophobicContact CB-CE2 3.87Å; V42-F44 HydrophobicContact CB-CZ 4.22Å; V42-F44 HydrophobicContact CG1-CD2 4.49Å; V42-F44 HydrophobicContact CG1-CE1 4.45Å; V42-F44 HydrophobicContact CG1-CE2 3.68Å; V42-F44 HydrophobicContact CG1-CZ 3.66Å; V42-F44 WeakPolarHBondContact O-CD2 3.41Å; V42-F44 WeakPolarHBondContact O-CE2 3.49Å; F44-Y115 HydrophobicContact CD2-CD1 4.48Å; F44-Y115 HydrophobicContact CD2-CE1 4Å; F44-Y115 HydrophobicContact CE2-CE1 4.35Å
45	P	98	Very high	97	Very high	47 Å²	47	56.4 Å²	56.4	31%	0.305	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	137.1	170.5	30.7	-33.4	0	0	0	109.6	C34 K47 S48	C34-P45 CarbonylContact O-C 3.57Å; P45-K47 HydrophobicContact CB-CG 4.25Å; P45-K47 HydrophobicContact CG-CG 4.44Å; P45-K47 PolarHBondContact O-N 2.52Å; P45-K47 VanDerWaalsContact O-N 3.08Å; P45-S48 VanDerWaalsContact O-CB 3.3Å; P45-S48 WeakPolarHBondContact O-CB 3.37Å; P45-S48 PolarHBondContact O-N 3.08Å; P45-S48 PolarHBondContact O-OG 3.02Å
46	F	98.1	Very high	97.1	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-54.5	-33.3	-176.6	177.4	-120.4	0	0	0	113.2	L28 V31 E32 C34 I36 S48 L49 Y50 I57 F59 I93 I122	L28-F46 HydrophobicContact CD2-CE1 4.28Å; V31-F46 HydrophobicContact CB-CD1 3.98Å; V31-F46 HydrophobicContact CB-CE1 4.33Å; V31-F46 HydrophobicContact CG2-CD1 3.63Å; V31-F46 HydrophobicContact CG2-CE1 3.59Å; V31-F46 WeakPolarHBondContact O-CB 3.2Å; E32-F46 PolarHBondContact O-N 2.91Å; C34-F46 WeakPolarHBondContact O-CB 3.28Å; C34-F46 PolarHBondContact O-N 3.3Å; I36-F46 HydrophobicContact CG2-CD2 4.26Å; F46-S48 PolarHBondContact O-N 3.4Å; F46-S48 VanDerWaalsContact O-N 3.16Å; F46-L49 HydrophobicContact CD2-CD1 3.76Å; F46-L49 HydrophobicContact CD2-CG 4.43Å; F46-L49 HydrophobicContact CE2-CD1 3.77Å; F46-L49 WeakPolarHBondContact O-CB 3.37Å; F46-L49 WeakPolarHBondContact O-CG 3.3Å; F46-L49 PolarHBondContact O-N 3.29Å; F46-Y50 AromaticContact CD1-CE1 3.74Å; F46-Y50 HydrophobicContact CD1-CE1 3.74Å; F46-Y50 AromaticContact CE1-CE1 3.61Å; F46-Y50 HydrophobicContact CE1-CE1 3.61Å; F46-Y50 HydrophobicContact CG-CE1 4.32Å; F46-Y50 HydrophobicContact CZ-CE1 4.07Å; F46-Y50 WeakPolarHBondContact O-CE1 3.38Å; F46-I57 HydrophobicContact CE2-CD1 4.2Å; F46-I57 HydrophobicContact CE2-CG2 4.23Å; F46-I57 HydrophobicContact CZ-CD1 4.09Å; F46-F59 HydrophobicContact CE2-CZ 4.05Å; F46-F59 AromaticContact CZ-CZ 3.88Å; F46-F59 HydrophobicContact CZ-CZ 3.88Å; F46-I93 HydrophobicContact CD2-CD1 4.01Å; F46-I93 HydrophobicContact CE2-CD1 3.56Å; F46-I122 HydrophobicContact CB-CD1 3.96Å; F46-I122 HydrophobicContact CD1-CD1 4.44Å; F46-I122 HydrophobicContact CD2-CD1 3.63Å; F46-I122 HydrophobicContact CE1-CG2 4.27Å; F46-I122 HydrophobicContact CE2-CD1 4.24Å; F46-I122 HydrophobicContact CG-CD1 3.76Å; F46-I122 HydrophobicContact CG-CG1 4.41Å; F46-I122 HydrophobicContact CZ-CG2 4.27Å
47	K	97.6	Very high	97.1	Very high	60 Å²	60	52.7 Å²	52.7	26%	0.261	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-58	-26.3	175.1	73.6	-171.7	173.5	-151.6	0	114.6	E32 D33 P45 L49 Y50 Q51	E32-K47 HydrophobicContact CB-CB 4.1Å; E32-K47 HydrophobicContact CB-CD 4.15Å; E32-K47 HydrophobicContact CG-CB 4.01Å; E32-K47 HydrophobicContact CG-CD 4.48Å; E32-K47 PolarHBondContact O-N 2.96Å; D33-K47 IonicContact OD1-NZ 2.81Å; D33-K47 PolarHBondContact OD1-NZ 2.96Å; P45-K47 HydrophobicContact CB-CG 4.25Å; P45-K47 HydrophobicContact CG-CG 4.44Å; P45-K47 PolarHBondContact O-N 2.52Å; P45-K47 VanDerWaalsContact O-N 3.08Å; K47-L49 PolarHBondContact O-N 3.4Å; K47-Y50 VanDerWaalsContact CA-CZ 3.47Å; K47-Y50 HydrophobicContact CB-CE2 4.1Å; K47-Y50 PolarHBondContact O-N 2.82Å; K47-Q51 VanDerWaalsContact O-CB 3.31Å; K47-Q51 WeakPolarHBondContact O-CB 3.37Å; K47-Q51 PolarHBondContact O-N 3.03Å
48	S	97.8	Very high	97	Very high	32 Å²	32	49.8 Å²	49.8	22%	0.224	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-62.9	-15	177.2	77.5	0	0	0	0	112.7	P45 F46 R89	P45-S48 VanDerWaalsContact O-CB 3.3Å; P45-S48 WeakPolarHBondContact O-CB 3.37Å; P45-S48 PolarHBondContact O-N 3.08Å; P45-S48 PolarHBondContact O-OG 3.02Å; F46-S48 PolarHBondContact O-N 3.4Å; F46-S48 VanDerWaalsContact O-N 3.16Å; S48-R89 PolarHBondContact O-NH1 2.97Å
49	L	97.6	Very high	97	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-73.1	-28.6	174.8	-62.1	-171.9	0	0	0	112.8	I36 F46 K47 S55 I57 R89 V91 I93 Y115	I36-L49 HydrophobicContact CD1-CD1 3.61Å; I36-L49 HydrophobicContact CD1-CD2 3.66Å; I36-L49 HydrophobicContact CD1-CG 3.6Å; F46-L49 HydrophobicContact CD2-CD1 3.76Å; F46-L49 HydrophobicContact CD2-CG 4.43Å; F46-L49 HydrophobicContact CE2-CD1 3.77Å; F46-L49 WeakPolarHBondContact O-CB 3.37Å; F46-L49 WeakPolarHBondContact O-CG 3.3Å; F46-L49 PolarHBondContact O-N 3.29Å; K47-L49 PolarHBondContact O-N 3.4Å; L49-S55 VanDerWaalsContact O-CB 3.3Å; L49-S55 WeakPolarHBondContact O-CB 3.36Å; L49-S55 PolarHBondContact O-OG 3.33Å; L49-I57 HydrophobicContact CB-CD1 4.14Å; L49-I57 HydrophobicContact CD1-CD1 4.36Å; L49-I57 HydrophobicContact CD1-CG2 4.5Å; L49-R89 VanDerWaalsContact C-NH1 3.31Å; L49-R89 VanDerWaalsContact CA-NH1 3.34Å; L49-R89 PolarHBondContact O-NH1 2.92Å; L49-V91 HydrophobicContact CD1-CG1 3.95Å; L49-V91 HydrophobicContact CD2-CG1 4.18Å; L49-V91 HydrophobicContact CD2-CG2 4.44Å; L49-I93 HydrophobicContact CD1-CD1 3.81Å; L49-I93 HydrophobicContact CD1-CG1 4.49Å; L49-Y115 HydrophobicContact CD2-CD2 3.99Å; L49-Y115 HydrophobicContact CD2-CE2 3.53Å
50	Y	97.1	Very high	96.8	Very high	2 Å²	2	41.9 Å²	41.9	1%	0.008	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-135	1	-170.1	54.4	-100.7	0	0	0	114.2	L28 E32 F46 K47 S53 I57 A180 G181 P182 G183	L28-Y50 HydrophobicContact CD1-CD1 4.36Å; L28-Y50 HydrophobicContact CD1-CD2 4.38Å; L28-Y50 HydrophobicContact CD1-CE1 3.99Å; L28-Y50 HydrophobicContact CD1-CE2 3.99Å; E32-Y50 WeakPolarHBondContact CG-OH 3.4Å; F46-Y50 AromaticContact CD1-CE1 3.74Å; F46-Y50 HydrophobicContact CD1-CE1 3.74Å; F46-Y50 AromaticContact CE1-CE1 3.61Å; F46-Y50 HydrophobicContact CE1-CE1 3.61Å; F46-Y50 HydrophobicContact CG-CE1 4.32Å; F46-Y50 HydrophobicContact CZ-CE1 4.07Å; F46-Y50 WeakPolarHBondContact O-CE1 3.38Å; K47-Y50 VanDerWaalsContact CA-CZ 3.47Å; K47-Y50 HydrophobicContact CB-CE2 4.1Å; K47-Y50 PolarHBondContact O-N 2.82Å; Y50-S53 CarbonylContact C-O 3.51Å; Y50-S53 WeakPolarHBondContact CA-O 3.45Å; Y50-I57 HydrophobicContact CD1-CD1 3.89Å; Y50-A180 HydrophobicContact CD1-CB 4.3Å; Y50-A180 HydrophobicContact CG-CB 4.03Å; Y50-G181 WeakPolarHBondContact O-CA 3.13Å; Y50-P182 CarbonylContact O-C 3.6Å; Y50-P182 WeakPolarHBondContact O-CA 3.45Å; Y50-G183 VanDerWaalsContact CD2-O 3.23Å; Y50-G183 WeakPolarHBondContact CD2-O 3.48Å; Y50-G183 PolarHBondContact O-N 3.04Å
51	Q	96.9	Very high	96.2	Very high	100 Å²	100	32.8 Å²	32.8	47%	0.467	18%	0.183	S	C	.	.	S	Bend	trans	-60.3	-49.3	-177.7	-178.7	171.5	-7.4	0	0	112.4	K47 G183	K47-Q51 VanDerWaalsContact O-CB 3.31Å; K47-Q51 WeakPolarHBondContact O-CB 3.37Å; K47-Q51 PolarHBondContact O-N 3.03Å; Q51-G183 PolarHBondContact O-N 2.93Å
52	D	96	Very high	95.3	Very high	135 Å²	135	31.8 Å²	31.8	72%	0.722	17%	0.171	S	C	*	.	S	Bend	trans	-100.4	-19.4	-171.5	-55.3	-46.8	0	0	0	113.7
53	S	94.8	Very high	94.2	Very high	28 Å²	28	29.1 Å²	29.1	20%	0.196	16%	0.155	C	C	.	.	S	Bend	trans	-144.3	158.7	-174.1	64.9	0	0	0	0	111.3	Y50 R89	Y50-S53 CarbonylContact C-O 3.51Å; Y50-S53 WeakPolarHBondContact CA-O 3.45Å; S53-R89 WeakPolarHBondContact OG-CD 3.35Å
54	K	96.6	Very high	92.8	Very high	51 Å²	51	27 Å²	27	22%	0.222	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	140.2	170	-169.3	-175.5	-64.9	-179.3	0	110.2	I88 R89 I179 A180 A208	K54-I88 HydrophobicContact CB-CG1 4.47Å; K54-I88 HydrophobicContact CD-CG1 4.49Å; K54-I88 WeakPolarHBondContact O-CA 3.37Å; K54-R89 PolarHBondContact O-N 3.03Å; K54-I179 HydrophobicContact CD-CG2 3.87Å; K54-I179 HydrophobicContact CG-CG2 3.94Å; K54-A180 CarbonylContact C-O 3.52Å; K54-A180 WeakPolarHBondContact CA-O 3.43Å; K54-A208 HydrophobicContact CD-CB 4.35Å; K54-A208 WeakPolarHBondContact CD-O 3.11Å; K54-A208 PolarHBondContact NZ-O 3.5Å
55	S	97.9	Very high	91.5	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	132.8	-176.5	-62.9	0	0	0	0	111.4	L49 R89 I179 A180	L49-S55 VanDerWaalsContact O-CB 3.3Å; L49-S55 WeakPolarHBondContact O-CB 3.36Å; L49-S55 PolarHBondContact O-OG 3.33Å; S55-R89 CarbonylContact C-O 3.59Å; S55-R89 WeakPolarHBondContact CA-O 3.48Å; S55-R89 WeakPolarHBondContact OG-CB 3.34Å; S55-I179 WeakPolarHBondContact O-CA 3.3Å; S55-A180 PolarHBondContact N-O 2.86Å; S55-A180 PolarHBondContact O-N 3.4Å
56	V	98	Very high	90.4	Very high	1 Å²	1	25 Å²	25	1%	0.006	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	108.9	165.4	-177.7	0	0	0	0	107	I58 I88 R89 L90 V91 I179 L204 A208	V56-I58 HydrophobicContact CG1-CD1 3.83Å; V56-I58 HydrophobicContact CG1-CG1 4.45Å; V56-I88 HydrophobicContact CG2-CG2 3.97Å; V56-R89 PolarHBondContact N-O 3.32Å; V56-L90 HydrophobicContact CB-CD1 3.89Å; V56-L90 HydrophobicContact CG1-CD1 3.84Å; V56-V91 PolarHBondContact O-N 3.35Å; V56-I179 HydrophobicContact CG2-CG1 4.3Å; V56-L204 HydrophobicContact CG1-CB 4.18Å; V56-L204 HydrophobicContact CG1-CD1 4.23Å; V56-A208 HydrophobicContact CG2-CB 3.53Å
57	I	98.3	Very high	89.4	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	113.8	-175.5	-55.6	168.6	0	0	0	108.1	F46 L49 Y50 F59 V91 I93 A177 I178	F46-I57 HydrophobicContact CE2-CD1 4.2Å; F46-I57 HydrophobicContact CE2-CG2 4.23Å; F46-I57 HydrophobicContact CZ-CD1 4.09Å; L49-I57 HydrophobicContact CB-CD1 4.14Å; L49-I57 HydrophobicContact CD1-CD1 4.36Å; L49-I57 HydrophobicContact CD1-CG2 4.5Å; Y50-I57 HydrophobicContact CD1-CD1 3.89Å; I57-F59 HydrophobicContact CB-CE2 4.42Å; I57-F59 HydrophobicContact CG2-CD2 4.26Å; I57-F59 HydrophobicContact CG2-CE2 3.64Å; I57-F59 HydrophobicContact CG2-CZ 3.9Å; I57-V91 WeakPolarHBondContact CA-O 3.28Å; I57-I93 HydrophobicContact CG2-CD1 3.62Å; I57-I93 HydrophobicContact CG2-CG1 4.14Å; I57-A177 CarbonylContact O-C 3.55Å; I57-A177 WeakPolarHBondContact O-CA 3.35Å; I57-I178 PolarHBondContact N-O 2.79Å; I57-I178 PolarHBondContact O-N 3.32Å
58	I	97.4	Very high	88.7	Confident	4 Å²	4	22.3 Å²	22.3	2%	0.021	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	121	-178.9	-52.8	-57.6	0	0	0	109	V56 V60 Y71 L75 L90 V91 V92 I93 A177 L204	V56-I58 HydrophobicContact CG1-CD1 3.83Å; V56-I58 HydrophobicContact CG1-CG1 4.45Å; I58-V60 HydrophobicContact CG2-CG1 4.33Å; I58-Y71 HydrophobicContact CD1-CE1 4.48Å; I58-Y71 HydrophobicContact CG2-CD1 4.28Å; I58-Y71 HydrophobicContact CG2-CE1 3.8Å; I58-L75 HydrophobicContact CB-CD1 4.47Å; I58-L75 HydrophobicContact CG1-CD1 4.01Å; I58-L75 HydrophobicContact CG2-CD1 4.23Å; I58-L90 HydrophobicContact CG1-CD1 4.34Å; I58-V91 PolarHBondContact N-O 2.86Å; I58-V92 HydrophobicContact CB-CG2 4.14Å; I58-V92 CarbonylContact O-C 3.5Å; I58-V92 WeakPolarHBondContact O-CA 3.44Å; I58-I93 PolarHBondContact O-N 2.92Å; I58-A177 HydrophobicContact CD1-CB 3.79Å; I58-L204 HydrophobicContact CD1-CD1 3.56Å
59	F	95.6	Very high	88.1	Confident	1 Å²	1	23 Å²	23	0%	0.004	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	110.3	172.7	-66.2	-93.3	0	0	0	109	F46 I57 I93 I122 Y123 L126 M128 G175 G176 I178	F46-F59 HydrophobicContact CE2-CZ 4.05Å; F46-F59 AromaticContact CZ-CZ 3.88Å; F46-F59 HydrophobicContact CZ-CZ 3.88Å; I57-F59 HydrophobicContact CB-CE2 4.42Å; I57-F59 HydrophobicContact CG2-CD2 4.26Å; I57-F59 HydrophobicContact CG2-CE2 3.64Å; I57-F59 HydrophobicContact CG2-CZ 3.9Å; F59-I93 HydrophobicContact CD1-CB 4.06Å; F59-I93 HydrophobicContact CD1-CD1 4.44Å; F59-I93 HydrophobicContact CD1-CG2 4.16Å; F59-I93 HydrophobicContact CE1-CB 4.27Å; F59-I93 HydrophobicContact CE1-CD1 3.82Å; F59-I93 HydrophobicContact CE1-CG2 4.26Å; F59-I93 HydrophobicContact CZ-CD1 4.06Å; F59-I122 HydrophobicContact CE1-CB 4.37Å; F59-I122 HydrophobicContact CE1-CG2 3.59Å; F59-I122 HydrophobicContact CZ-CG2 3.81Å; F59-Y123 HydrophobicContact CB-CE1 3.91Å; F59-Y123 HydrophobicContact CD1-CD2 4.35Å; F59-Y123 HydrophobicContact CD1-CE1 4.1Å; F59-Y123 AromaticContact CD1-CE2 3.89Å; F59-Y123 HydrophobicContact CD1-CE2 3.89Å; F59-Y123 AromaticContact CD1-CZ 3.76Å; F59-Y123 HydrophobicContact CG-CE1 4.47Å; F59-L126 HydrophobicContact CE1-CD1 4.47Å; F59-L126 HydrophobicContact CE2-CD1 4.33Å; F59-L126 HydrophobicContact CZ-CD1 3.92Å; F59-M128 HydrophobicContact CB-CE 3.96Å; F59-M128 HydrophobicContact CB-SD 4.23Å; F59-M128 HydrophobicContact CD1-CE 3.99Å; F59-M128 HydrophobicContact CD1-SD 4.39Å; F59-M128 HydrophobicContact CD2-CE 3.55Å; F59-M128 HydrophobicContact CE1-CE 4.35Å; F59-M128 HydrophobicContact CE2-CE 3.96Å; F59-M128 HydrophobicContact CG-CE 3.55Å; F59-M128 HydrophobicContact CG-SD 4.24Å; F59-M128 HydrophobicContact CZ-CE 4.33Å; F59-G175 CarbonylContact O-C 3.42Å; F59-G175 WeakPolarHBondContact O-CA 3.22Å; F59-G176 PolarHBondContact N-O 2.87Å; F59-G176 PolarHBondContact O-N 3.32Å; F59-I178 HydrophobicContact CE2-CB 4.48Å; F59-I178 HydrophobicContact CE2-CD1 3.8Å; F59-I178 HydrophobicContact CE2-CG1 4.02Å; F59-I178 HydrophobicContact CZ-CD1 4.47Å
60	V	91	Very high	87.5	Confident	1 Å²	1	23.9 Å²	23.9	1%	0.006	12%	0.117	C	C	.	.			trans	-86	147.2	172.4	-61.5	0	0	0	0	110.3	I58 F63 C68 V72 V92 I93 Y123	I58-V60 HydrophobicContact CG2-CG1 4.33Å; V60-F63 HydrophobicContact CG2-CD1 3.79Å; V60-F63 HydrophobicContact CG2-CE1 3.74Å; V60-C68 HydrophobicContact CB-CB 4.05Å; V60-C68 HydrophobicContact CG1-CB 4.14Å; V60-V72 HydrophobicContact CG1-CG2 3.86Å; V60-V92 HydrophobicContact CG1-CG1 4.04Å; V60-V92 HydrophobicContact CG2-CG1 4.28Å; V60-I93 WeakPolarHBondContact CG2-O 3.37Å; V60-I93 PolarHBondContact N-O 3.08Å; V60-Y123 PolarHBondContact O-OH 3.4Å
61	R	83.5	Confident	87.2	Confident	11 Å²	11	24 Å²	24	4%	0.042	12%	0.117	C	C	.	.	S	Bend	trans	-60.6	-48.8	-178.1	-55.7	-176.9	72.8	-152.7	6.4	111.6	C65 Q95 E132 L171 Q173	R61-C65 HydrophobicContact CB-CB 4.45Å; R61-Q95 PolarHBondContact O-OE1 3.05Å; R61-E132 IonicContact CZ-OE1 3.9Å; R61-E132 VanDerWaalsContact CZ-OE1 3.24Å; R61-E132 IonicContact NH1-OE1 3.76Å; R61-E132 PolarHBondContact NH1-OE1 3.37Å; R61-E132 IonicContact NH2-OE1 3.39Å; R61-E132 PolarHBondContact NH2-OE1 3.07Å; R61-L171 VanDerWaalsContact CZ-O 3.31Å; R61-L171 PolarHBondContact NH1-O 3.47Å; R61-L171 PolarHBondContact NH2-O 3.43Å; R61-Q173 WeakPolarHBondContact CB-O 3.49Å; R61-Q173 VanDerWaalsContact CG-O 3.3Å; R61-Q173 WeakPolarHBondContact CG-O 3.38Å; R61-Q173 PolarHBondContact NE-O 2.88Å; R61-Q173 PolarHBondContact NH2-O 3.31Å
62	N	75.8	Confident	86.9	Confident	4 Å²	4	19.2 Å²	19.2	2%	0.021	10%	0.095	C	C	.	.			trans	-169.6	161.6	171.5	55.6	74.2	0	0	0	108.2	L64 C65 D170	N62-L64 PolarHBondContact O-N 3.12Å; N62-L64 WeakPolarHBondContact OD1-CA 3.42Å; N62-L64 WeakPolarHBondContact OD1-CB 3.24Å; N62-L64 PolarHBondContact OD1-N 3.42Å; N62-L64 VanDerWaalsContact OD1-N 3.15Å; N62-C65 WeakPolarHBondContact O-CB 3.36Å; N62-C65 PolarHBondContact O-N 2.97Å; N62-C65 PolarHBondContact OD1-N 2.81Å; N62-D170 PolarHBondContact ND2-O 3.48Å
63	F	75.4	Confident	86.7	Confident	6 Å²	6	14.8 Å²	14.8	3%	0.026	7%	0.071	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-11.8	-179.2	-68.1	-15.1	0	0	0	114.4	V60 G94 S96 H100 I101 F104 I114 V116 M160	V60-F63 HydrophobicContact CG2-CD1 3.79Å; V60-F63 HydrophobicContact CG2-CE1 3.74Å; F63-G94 VanDerWaalsContact CE1-CA 3.47Å; F63-S96 WeakPolarHBondContact CD2-OG 3.32Å; F63-S96 WeakPolarHBondContact CE2-OG 3.39Å; F63-H100 HydrophobicContact CD2-CB 3.8Å; F63-H100 HydrophobicContact CE2-CB 4.3Å; F63-I101 HydrophobicContact CE2-CG1 4.02Å; F63-I101 HydrophobicContact CZ-CG1 4.28Å; F63-F104 HydrophobicContact CB-CD2 3.81Å; F63-F104 HydrophobicContact CB-CE2 4.19Å; F63-F104 HydrophobicContact CB-CG 4.2Å; F63-F104 AromaticContact CD1-CD1 3.9Å; F63-F104 HydrophobicContact CD1-CD1 3.9Å; F63-F104 HydrophobicContact CD1-CD2 4.21Å; F63-F104 AromaticContact CD1-CE1 3.91Å; F63-F104 HydrophobicContact CD1-CE1 3.91Å; F63-F104 HydrophobicContact CD1-CE2 4.25Å; F63-F104 HydrophobicContact CD1-CG 4.04Å; F63-F104 HydrophobicContact CD1-CZ 4.1Å; F63-F104 HydrophobicContact CD2-CB 4.08Å; F63-F104 HydrophobicContact CD2-CG 4.21Å; F63-F104 AromaticContact CE1-CD1 3.95Å; F63-F104 HydrophobicContact CE1-CD1 3.95Å; F63-F104 HydrophobicContact CE1-CE1 4.03Å; F63-F104 HydrophobicContact CE1-CG 4.45Å; F63-F104 HydrophobicContact CE2-CB 4.45Å; F63-F104 HydrophobicContact CG-CB 4.26Å; F63-F104 HydrophobicContact CG-CD1 4.22Å; F63-F104 HydrophobicContact CG-CD2 4.02Å; F63-F104 HydrophobicContact CG-CE2 4.42Å; F63-F104 AromaticContact CG-CG 3.91Å; F63-F104 HydrophobicContact CG-CG 3.91Å; F63-F104 HydrophobicContact CZ-CD1 4.34Å; F63-I114 HydrophobicContact CE1-CD1 4.18Å; F63-I114 HydrophobicContact CZ-CD1 3.9Å; F63-I114 HydrophobicContact CZ-CG1 4.34Å; F63-V116 HydrophobicContact CE2-CG1 3.83Å; F63-V116 HydrophobicContact CZ-CG1 3.75Å; F63-M160 WeakPolarHBondContact O-CE 3.47Å
64	L	68.1	Low	86.5	Confident	14 Å²	14	13.5 Å²	13.5	7%	0.073	6%	0.062	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-19.8	174.1	-58.4	179.6	0	0	0	111.9	N62 Y66 W157 M160 F165 F167	N62-L64 PolarHBondContact O-N 3.12Å; N62-L64 WeakPolarHBondContact OD1-CA 3.42Å; N62-L64 WeakPolarHBondContact OD1-CB 3.24Å; N62-L64 PolarHBondContact OD1-N 3.42Å; N62-L64 VanDerWaalsContact OD1-N 3.15Å; L64-Y66 PolarHBondContact O-N 3.41Å; L64-W157 HydrophobicContact CB-CH2 4.41Å; L64-W157 HydrophobicContact CB-CZ3 4.47Å; L64-W157 WeakPolarHBondContact O-CZ3 3.42Å; L64-M160 HydrophobicContact CD2-CB 3.68Å; L64-M160 HydrophobicContact CD2-CE 3.77Å; L64-M160 VanDerWaalsContact CD2-O 3.31Å; L64-M160 WeakPolarHBondContact CD2-O 3.36Å; L64-F165 HydrophobicContact CD2-CD1 4.09Å; L64-F167 HydrophobicContact CD1-CD2 3.35Å; L64-F167 HydrophobicContact CD1-CE2 3.57Å; L64-F167 HydrophobicContact CD1-CG 4.44Å
65	C	70.6	Confident	86.4	Confident	10 Å²	10	11.1 Å²	11.1	7%	0.068	5%	0.052	C	C	.	.			trans	-64.1	120.8	-175.4	-178.1	0	0	0	0	111.4	R61 N62 S67 C68 K69	R61-C65 HydrophobicContact CB-CB 4.45Å; N62-C65 WeakPolarHBondContact O-CB 3.36Å; N62-C65 PolarHBondContact O-N 2.97Å; N62-C65 PolarHBondContact OD1-N 2.81Å; C65-S67 PolarHBondContact O-N 3.06Å; C65-S67 PolarHBondContact SG-OG 2.86Å; C65-C68 HydrophobicContact CB-CB 3.82Å; C65-C68 WeakPolarHBondContact O-CB 3.39Å; C65-C68 PolarHBondContact O-N 3Å; C65-C68 PolarHBondContact SG-SG 3.39Å; C65-K69 PolarHBondContact O-N 2.74Å
66	Y	74.8	Confident	86.2	Confident	65 Å²	65	12.5 Å²	12.5	26%	0.255	6%	0.061	S	C	.	.	H	α-helix	trans	-60.9	-48.4	-175.8	177.5	-97.8	0	0	0	113.5	L64 C68 K69 E70 S146 I153	L64-Y66 PolarHBondContact O-N 3.41Å; Y66-C68 VanDerWaalsContact C-N 3.26Å; Y66-C68 PolarHBondContact O-N 2.82Å; Y66-K69 WeakPolarHBondContact O-CB 3.37Å; Y66-K69 PolarHBondContact O-N 2.88Å; Y66-K69 VanDerWaalsContact O-N 3.09Å; Y66-E70 HydrophobicContact CE1-CG 3.78Å; Y66-E70 WeakPolarHBondContact CE1-OE2 3.21Å; Y66-E70 HydrophobicContact CE2-CG 4.23Å; Y66-E70 VanDerWaalsContact CZ-OE1 3.32Å; Y66-E70 PolarHBondContact O-N 3.05Å; Y66-E70 PolarHBondContact OH-OE1 3.03Å; Y66-S146 WeakPolarHBondContact CE1-OG 3.34Å; Y66-S146 VanDerWaalsContact CZ-OG 3.28Å; Y66-S146 WeakPolarHBondContact OH-CB 3.37Å; Y66-S146 PolarHBondContact OH-OG 2.93Å; Y66-S146 VanDerWaalsContact OH-OG 3.1Å; Y66-I153 HydrophobicContact CD2-CB 4.32Å; Y66-I153 HydrophobicContact CD2-CD1 4.33Å; Y66-I153 HydrophobicContact CD2-CG1 4.17Å; Y66-I153 HydrophobicContact CD2-CG2 3.33Å; Y66-I153 HydrophobicContact CE1-CD1 3.98Å; Y66-I153 HydrophobicContact CE2-CB 4.04Å; Y66-I153 HydrophobicContact CE2-CD1 3.54Å; Y66-I153 HydrophobicContact CE2-CG1 3.41Å; Y66-I153 VanDerWaalsContact CE2-CG1 3.41Å; Y66-I153 HydrophobicContact CE2-CG2 3.52Å; Y66-I153 HydrophobicContact CG-CG2 3.97Å; Y66-I153 VanDerWaalsContact OH-CD1 3.22Å; Y66-I153 WeakPolarHBondContact OH-CD1 3.44Å
67	S	76.9	Confident	86	Confident	4 Å²	4	17.3 Å²	17.3	3%	0.028	8%	0.082	C	C	.	.	H	α-helix	trans	-65.3	-33.8	179.4	55.5	0	0	0	0	111.6	C65 E70 Y71 R195	C65-S67 PolarHBondContact O-N 3.06Å; C65-S67 PolarHBondContact SG-OG 2.86Å; S67-E70 PolarHBondContact O-N 3.14Å; S67-Y71 VanDerWaalsContact O-CB 3.27Å; S67-Y71 WeakPolarHBondContact O-CB 3.03Å; S67-Y71 PolarHBondContact O-N 2.92Å; S67-R195 WeakPolarHBondContact CB-O 3.34Å; S67-R195 PolarHBondContact OG-O 2.89Å
68	C	82.4	Confident	85.8	Confident	0 Å²	0	17.4 Å²	17.4	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-66.8	-37.4	172.3	-61.7	0	0	0	0	112	V60 C65 Y66 Y71 V72 H198	V60-C68 HydrophobicContact CB-CB 4.05Å; V60-C68 HydrophobicContact CG1-CB 4.14Å; C65-C68 HydrophobicContact CB-CB 3.82Å; C65-C68 WeakPolarHBondContact O-CB 3.39Å; C65-C68 PolarHBondContact O-N 3Å; C65-C68 PolarHBondContact SG-SG 3.39Å; Y66-C68 VanDerWaalsContact C-N 3.26Å; Y66-C68 PolarHBondContact O-N 2.82Å; C68-Y71 PolarHBondContact O-N 2.69Å; C68-V72 WeakPolarHBondContact O-CB 3.32Å; C68-V72 VanDerWaalsContact O-CG2 3.26Å; C68-V72 WeakPolarHBondContact O-CG2 3.38Å; C68-V72 PolarHBondContact O-N 3.34Å; C68-H198 VanDerWaalsContact SG-CE1 3.57Å
69	K	85.9	Confident	85.6	Confident	45 Å²	45	19.6 Å²	19.6	20%	0.196	10%	0.097	C	C	.	.	H	α-helix	trans	-59.8	-51.5	173.4	-174.5	-83	168.4	-161.5	0	110.5	C65 Y66 Y71 V72 D73 L107 T108	C65-K69 PolarHBondContact O-N 2.74Å; Y66-K69 WeakPolarHBondContact O-CB 3.37Å; Y66-K69 PolarHBondContact O-N 2.88Å; Y66-K69 VanDerWaalsContact O-N 3.09Å; K69-Y71 VanDerWaalsContact C-N 3.31Å; K69-Y71 PolarHBondContact O-N 3.1Å; K69-V72 PolarHBondContact O-N 3.22Å; K69-D73 IonicContact NZ-OD1 2.6Å; K69-D73 PolarHBondContact NZ-OD1 2.88Å; K69-D73 WeakPolarHBondContact O-CB 3.29Å; K69-D73 PolarHBondContact O-N 3.26Å; K69-L107 VanDerWaalsContact CE-O 3.24Å; K69-L107 WeakPolarHBondContact CE-O 3.34Å; K69-L107 HydrophobicContact CG-CD2 3.99Å; K69-L107 HydrophobicContact CG-CG 4.27Å; K69-L107 PolarHBondContact NZ-O 3.35Å; K69-T108 HydrophobicContact CD-CG2 4.43Å; K69-T108 HydrophobicContact CG-CG2 3.94Å
70	E	85.7	Confident	85.5	Confident	19 Å²	19	27.7 Å²	27.7	9%	0.089	13%	0.128	C	C	.	.	H	α-helix	trans	-61.9	-40.8	179.6	-72.5	-169.1	136.5	0	0	111.8	Y66 S67 V72 D73 D74 V144 K145 S146	Y66-E70 HydrophobicContact CE1-CG 3.78Å; Y66-E70 WeakPolarHBondContact CE1-OE2 3.21Å; Y66-E70 HydrophobicContact CE2-CG 4.23Å; Y66-E70 VanDerWaalsContact CZ-OE1 3.32Å; Y66-E70 PolarHBondContact O-N 3.05Å; Y66-E70 PolarHBondContact OH-OE1 3.03Å; S67-E70 PolarHBondContact O-N 3.14Å; E70-V72 PolarHBondContact O-N 3.21Å; E70-D73 WeakPolarHBondContact O-CB 3.4Å; E70-D73 PolarHBondContact O-N 2.95Å; E70-D74 PolarHBondContact O-N 2.83Å; E70-V144 WeakPolarHBondContact OE2-CA 3.24Å; E70-V144 WeakPolarHBondContact OE2-CG1 3.26Å; E70-K145 PolarHBondContact OE1-N 2.86Å; E70-K145 PolarHBondContact OE2-N 3.47Å; E70-K145 VanDerWaalsContact OE2-N 3.1Å; E70-S146 PolarHBondContact OE1-N 2.59Å
71	Y	89.1	Confident	85.6	Confident	4 Å²	4	34.3 Å²	34.3	2%	0.016	16%	0.156	C	C	.	.	H	α-helix	trans	-61.8	-44.6	176.1	-170.8	-107.2	0	0	0	112	I58 S67 C68 K69 D74 L75 H143 H198 M199 I201 L204	I58-Y71 HydrophobicContact CD1-CE1 4.48Å; I58-Y71 HydrophobicContact CG2-CD1 4.28Å; I58-Y71 HydrophobicContact CG2-CE1 3.8Å; S67-Y71 VanDerWaalsContact O-CB 3.27Å; S67-Y71 WeakPolarHBondContact O-CB 3.03Å; S67-Y71 PolarHBondContact O-N 2.92Å; C68-Y71 PolarHBondContact O-N 2.69Å; K69-Y71 VanDerWaalsContact C-N 3.31Å; K69-Y71 PolarHBondContact O-N 3.1Å; Y71-D74 PolarHBondContact O-N 3.48Å; Y71-L75 HydrophobicContact CD1-CD1 3.79Å; Y71-L75 HydrophobicContact CD1-CG 4.31Å; Y71-L75 HydrophobicContact CE1-CD1 3.67Å; Y71-L75 HydrophobicContact CE1-CD2 4.47Å; Y71-L75 HydrophobicContact CE1-CG 4.14Å; Y71-L75 WeakPolarHBondContact O-CG 3.39Å; Y71-L75 PolarHBondContact O-N 3.35Å; Y71-H143 HydrophobicContact CD2-CB 3.93Å; Y71-H143 AromaticContact CD2-CG 3.86Å; Y71-H198 HydrophobicContact CD2-CB 3.65Å; Y71-H198 HydrophobicContact CE2-CB 3.66Å; Y71-H198 HydrophobicContact CG-CB 4.1Å; Y71-H198 AromaticContact CG-CD2 3.98Å; Y71-M199 VanDerWaalsContact CE2-O 3.26Å; Y71-M199 WeakPolarHBondContact CE2-O 3.4Å; Y71-M199 PolarHBondContact OH-O 3.16Å; Y71-I201 HydrophobicContact CD2-CD1 4.35Å; Y71-I201 HydrophobicContact CD2-CG1 4.32Å; Y71-I201 HydrophobicContact CE2-CD1 4.09Å; Y71-I201 HydrophobicContact CE2-CG1 3.57Å; Y71-L204 VanDerWaalsContact OH-CD1 3.32Å; Y71-L204 WeakPolarHBondContact OH-CD1 3.21Å
72	V	92.2	Very high	86.1	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-70.7	-31.9	177.4	175.7	0	0	0	0	112.4	V60 C68 K69 E70 D74 L75 S76 V92 F104 T108 Y110	V60-V72 HydrophobicContact CG1-CG2 3.86Å; C68-V72 WeakPolarHBondContact O-CB 3.32Å; C68-V72 VanDerWaalsContact O-CG2 3.26Å; C68-V72 WeakPolarHBondContact O-CG2 3.38Å; C68-V72 PolarHBondContact O-N 3.34Å; K69-V72 PolarHBondContact O-N 3.22Å; E70-V72 PolarHBondContact O-N 3.21Å; V72-D74 VanDerWaalsContact C-N 3.27Å; V72-D74 PolarHBondContact O-N 3.21Å; V72-L75 HydrophobicContact CG2-CD1 4.26Å; V72-L75 PolarHBondContact O-N 2.86Å; V72-S76 PolarHBondContact O-N 3.47Å; V72-V92 HydrophobicContact CG2-CG1 4.46Å; V72-V92 HydrophobicContact CG2-CG2 4.3Å; V72-F104 HydrophobicContact CB-CE1 4.1Å; V72-F104 HydrophobicContact CB-CZ 3.99Å; V72-F104 HydrophobicContact CG1-CE1 3.76Å; V72-F104 HydrophobicContact CG1-CZ 4.14Å; V72-F104 HydrophobicContact CG2-CE1 4Å; V72-F104 HydrophobicContact CG2-CZ 3.93Å; V72-T108 HydrophobicContact CB-CG2 4.15Å; V72-T108 HydrophobicContact CG1-CG2 3.94Å; V72-Y110 HydrophobicContact CG1-CD1 4.48Å; V72-Y110 HydrophobicContact CG1-CD2 3.78Å; V72-Y110 HydrophobicContact CG1-CG 3.74Å
73	D	90.7	Very high	87	Confident	42 Å²	42	34.1 Å²	34.1	23%	0.225	16%	0.157	C	C	.	.	H	α-helix	trans	-62.7	-33.7	169.9	-171.2	96.8	0	0	0	112.3	K69 E70 S76 K77	K69-D73 IonicContact NZ-OD1 2.6Å; K69-D73 PolarHBondContact NZ-OD1 2.88Å; K69-D73 WeakPolarHBondContact O-CB 3.29Å; K69-D73 PolarHBondContact O-N 3.26Å; E70-D73 WeakPolarHBondContact O-CB 3.4Å; E70-D73 PolarHBondContact O-N 2.95Å; D73-S76 PolarHBondContact O-OG 3Å; D73-K77 WeakPolarHBondContact O-CE 3.49Å; D73-K77 PolarHBondContact O-NZ 3.33Å; D73-K77 IonicContact OD2-NZ 3.13Å; D73-K77 PolarHBondContact OD2-NZ 3.27Å
74	D	90.8	Very high	87.9	Confident	2 Å²	2	39.2 Å²	39.2	1%	0.011	18%	0.181	C	C	.	.	H	α-helix	trans	-77.6	-36.7	171.9	-77.7	-18.8	0	0	0	112.1	E70 Y71 V72 S76 K77 H143 K145 I201 F216	E70-D74 PolarHBondContact O-N 2.83Å; Y71-D74 PolarHBondContact O-N 3.48Å; V72-D74 VanDerWaalsContact C-N 3.27Å; V72-D74 PolarHBondContact O-N 3.21Å; D74-S76 PolarHBondContact O-N 2.92Å; D74-K77 WeakPolarHBondContact O-CB 3.42Å; D74-K77 PolarHBondContact O-N 2.79Å; D74-K77 VanDerWaalsContact O-N 3.11Å; D74-K77 IonicContact OD1-NZ 3.91Å; D74-K77 PolarHBondContact OD1-NZ 2.97Å; D74-H143 IonicContact OD2-CD2 3.39Å; D74-K145 VanDerWaalsContact CG-NZ 3.28Å; D74-K145 IonicContact OD1-NZ 3.97Å; D74-K145 PolarHBondContact OD1-NZ 3.33Å; D74-K145 VanDerWaalsContact OD2-CE 3.23Å; D74-K145 WeakPolarHBondContact OD2-CE 3.13Å; D74-K145 IonicContact OD2-NZ 3.75Å; D74-K145 PolarHBondContact OD2-NZ 2.78Å; D74-K145 VanDerWaalsContact OD2-NZ 3.13Å; D74-I201 HydrophobicContact CB-CD1 3.6Å; D74-F216 HydrophobicContact CB-CD1 4.4Å; D74-F216 WeakPolarHBondContact O-CE1 3.15Å
75	L	94.3	Very high	89.1	Confident	1 Å²	1	44.3 Å²	44.3	1%	0.005	20%	0.204	C	C	.	.	H	α-helix	trans	-60.5	-30.8	172.2	-72.1	170.2	0	0	0	112.3	I58 Y71 V72 K77 V78 L90 V92 Y110 I201	I58-L75 HydrophobicContact CB-CD1 4.47Å; I58-L75 HydrophobicContact CG1-CD1 4.01Å; I58-L75 HydrophobicContact CG2-CD1 4.23Å; Y71-L75 HydrophobicContact CD1-CD1 3.79Å; Y71-L75 HydrophobicContact CD1-CG 4.31Å; Y71-L75 HydrophobicContact CE1-CD1 3.67Å; Y71-L75 HydrophobicContact CE1-CD2 4.47Å; Y71-L75 HydrophobicContact CE1-CG 4.14Å; Y71-L75 WeakPolarHBondContact O-CG 3.39Å; Y71-L75 PolarHBondContact O-N 3.35Å; V72-L75 HydrophobicContact CG2-CD1 4.26Å; V72-L75 PolarHBondContact O-N 2.86Å; L75-K77 PolarHBondContact O-N 2.79Å; L75-V78 WeakPolarHBondContact O-CB 3.45Å; L75-V78 VanDerWaalsContact O-CG2 3.31Å; L75-V78 WeakPolarHBondContact O-CG2 2.84Å; L75-V78 PolarHBondContact O-N 3.42Å; L75-L90 HydrophobicContact CD2-CD1 4.18Å; L75-L90 HydrophobicContact CD2-CD2 4.16Å; L75-V92 HydrophobicContact CD1-CG2 4.06Å; L75-Y110 HydrophobicContact CB-CD2 4.12Å; L75-Y110 HydrophobicContact CB-CE2 3.84Å; L75-I201 HydrophobicContact CB-CD1 4.42Å; L75-I201 HydrophobicContact CD2-CB 4.39Å; L75-I201 HydrophobicContact CD2-CD1 3.73Å; L75-I201 HydrophobicContact CD2-CG1 3.7Å; L75-I201 HydrophobicContact CD2-CG2 3.86Å; L75-I201 HydrophobicContact CG-CD1 3.74Å; L75-I201 HydrophobicContact CG-CG1 4.18Å
76	S	94.3	Very high	90.1	Very high	28 Å²	28	45.7 Å²	45.7	20%	0.196	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-15.4	178.1	77.3	0	0	0	0	113.7	V72 D73 D74 V78 T108	V72-S76 PolarHBondContact O-N 3.47Å; D73-S76 PolarHBondContact O-OG 3Å; D74-S76 PolarHBondContact O-N 2.92Å; S76-V78 VanDerWaalsContact C-N 3.32Å; S76-T108 WeakPolarHBondContact CB-O 3.33Å; S76-T108 PolarHBondContact OG-O 3.13Å
77	K	94.4	Very high	91.1	Very high	102 Å²	102	44.8 Å²	44.8	44%	0.443	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-7.5	178.1	-62.6	161.8	-165.5	150	0	112.4	D73 D74 L75 P79 F216	D73-K77 WeakPolarHBondContact O-CE 3.49Å; D73-K77 PolarHBondContact O-NZ 3.33Å; D73-K77 IonicContact OD2-NZ 3.13Å; D73-K77 PolarHBondContact OD2-NZ 3.27Å; D74-K77 WeakPolarHBondContact O-CB 3.42Å; D74-K77 PolarHBondContact O-N 2.79Å; D74-K77 VanDerWaalsContact O-N 3.11Å; D74-K77 IonicContact OD1-NZ 3.91Å; D74-K77 PolarHBondContact OD1-NZ 2.97Å; L75-K77 PolarHBondContact O-N 2.79Å; K77-P79 VanDerWaalsContact O-CD 3.32Å; K77-P79 WeakPolarHBondContact O-CD 3.26Å; K77-F216 HydrophobicContact CB-CE1 4.48Å
78	V	93.4	Very high	92	Very high	3 Å²	3	45.1 Å²	45.1	2%	0.018	23%	0.228	C	C	.	.	S	Bend	trans	-67.7	120	176.7	179.9	0	0	0	0	109.1	L75 S76 R80 L83 L90 H112 I201 L205 L214 F216	L75-V78 WeakPolarHBondContact O-CB 3.45Å; L75-V78 VanDerWaalsContact O-CG2 3.31Å; L75-V78 WeakPolarHBondContact O-CG2 2.84Å; L75-V78 PolarHBondContact O-N 3.42Å; S76-V78 VanDerWaalsContact C-N 3.32Å; V78-R80 PolarHBondContact O-N 3.34Å; V78-L83 HydrophobicContact CG1-CD1 3.93Å; V78-L83 HydrophobicContact CG1-CD2 4.03Å; V78-L83 HydrophobicContact CG1-CG 3.9Å; V78-L90 HydrophobicContact CB-CD2 4.08Å; V78-L90 HydrophobicContact CG1-CD2 4.24Å; V78-L90 HydrophobicContact CG2-CD2 4.14Å; V78-H112 PolarHBondContact O-CE1 3.49Å; V78-H112 PolarHBondContact O-NE2 3.26Å; V78-H112 VanDerWaalsContact O-NE2 3.08Å; V78-I201 HydrophobicContact CG2-CG2 3.93Å; V78-L205 HydrophobicContact CG1-CD1 3.92Å; V78-L205 HydrophobicContact CG1-CD2 4.29Å; V78-L205 HydrophobicContact CG2-CD1 3.8Å; V78-L214 HydrophobicContact CG1-CD1 4.2Å; V78-L214 HydrophobicContact CG2-CD1 4.42Å; V78-F216 HydrophobicContact CG2-CZ 4.14Å
79	P	93	Very high	92.7	Very high	50 Å²	50	47.8 Å²	47.8	33%	0.325	24%	0.238	S	C	.	.			trans	-66.5	126.4	-178.3	-21	33.2	0	0	0	111.2	K77 K81 A82 L83 L214	K77-P79 VanDerWaalsContact O-CD 3.32Å; K77-P79 WeakPolarHBondContact O-CD 3.26Å; P79-K81 PolarHBondContact O-N 2.99Å; P79-A82 HydrophobicContact CB-CB 4.21Å; P79-A82 WeakPolarHBondContact O-CB 3.25Å; P79-A82 PolarHBondContact O-N 3.46Å; P79-L83 PolarHBondContact O-N 3.45Å; P79-L214 VanDerWaalsContact CD-CD2 3.45Å; P79-L214 HydrophobicContact CG-CD2 3.87Å
80	R	94.2	Very high	93.3	Very high	171 Å²	171	45.9 Å²	45.9	65%	0.645	23%	0.23	S	C	*	.	H	α-helix	trans	-53.7	-40.3	175.8	-178.8	173	170.9	162.2	0.9	112.6	V78 A82 L83 E84	V78-R80 PolarHBondContact O-N 3.34Å; R80-A82 VanDerWaalsContact C-N 3.29Å; R80-A82 PolarHBondContact O-N 2.85Å; R80-L83 WeakPolarHBondContact O-CB 3.4Å; R80-L83 PolarHBondContact O-N 2.85Å; R80-L83 VanDerWaalsContact O-N 3.16Å; R80-E84 HydrophobicContact CG-CG 4.27Å; R80-E84 WeakPolarHBondContact CG-OE1 3.35Å; R80-E84 IonicContact CZ-OE1 3.96Å; R80-E84 IonicContact NE-OE1 3.63Å; R80-E84 PolarHBondContact NE-OE1 3.37Å; R80-E84 IonicContact NH2-OE1 3.97Å; R80-E84 PolarHBondContact NH2-OE1 2.95Å; R80-E84 WeakPolarHBondContact O-CG 3.49Å; R80-E84 PolarHBondContact O-N 3.31Å
81	K	93.2	Very high	93.9	Very high	139 Å²	139	45 Å²	45	60%	0.604	23%	0.226	S	C	*	.	H	α-helix	trans	-58.3	-38.6	176.8	-176.6	174.1	172.7	177.7	0	112.8	P79 L83 E84 E85	P79-K81 PolarHBondContact O-N 2.99Å; K81-L83 VanDerWaalsContact C-N 3.32Å; K81-L83 PolarHBondContact O-N 2.9Å; K81-E84 PolarHBondContact O-N 3.15Å; K81-E85 WeakPolarHBondContact CE-OE1 3.33Å; K81-E85 HydrophobicContact CG-CG 4.33Å; K81-E85 IonicContact NZ-OE1 3.61Å; K81-E85 WeakPolarHBondContact O-CB 3.23Å; K81-E85 VanDerWaalsContact O-CG 3.29Å; K81-E85 WeakPolarHBondContact O-CG 3.37Å; K81-E85 PolarHBondContact O-N 2.79Å
82	A	92.4	Very high	94.3	Very high	3 Å²	3	44.8 Å²	44.8	3%	0.025	23%	0.225	C	C	.	.	H	α-helix	trans	-66	-36.8	178.9	0	0	0	0	0	112.1	P79 R80 A86 V210 Q212	P79-A82 HydrophobicContact CB-CB 4.21Å; P79-A82 WeakPolarHBondContact O-CB 3.25Å; P79-A82 PolarHBondContact O-N 3.46Å; R80-A82 VanDerWaalsContact C-N 3.29Å; R80-A82 PolarHBondContact O-N 2.85Å; A82-A86 WeakPolarHBondContact O-CB 3.38Å; A82-A86 PolarHBondContact O-N 3.05Å; A82-V210 HydrophobicContact CB-CG1 4.23Å; A82-Q212 VanDerWaalsContact CB-OE1 3.22Å
83	L	94.9	Very high	94.5	Very high	8 Å²	8	44.8 Å²	44.8	4%	0.042	23%	0.225	C	C	.	.	H	α-helix	trans	-70.8	-43.9	176	-65	174.5	0	0	0	111.4	V78 P79 R80 K81 A86 G87 I88 L90 L205 V210	V78-L83 HydrophobicContact CG1-CD1 3.93Å; V78-L83 HydrophobicContact CG1-CD2 4.03Å; V78-L83 HydrophobicContact CG1-CG 3.9Å; P79-L83 PolarHBondContact O-N 3.45Å; R80-L83 WeakPolarHBondContact O-CB 3.4Å; R80-L83 PolarHBondContact O-N 2.85Å; R80-L83 VanDerWaalsContact O-N 3.16Å; K81-L83 VanDerWaalsContact C-N 3.32Å; K81-L83 PolarHBondContact O-N 2.9Å; L83-A86 CarbonylContact O-C 3.55Å; L83-A86 PolarHBondContact O-N 2.97Å; L83-G87 PolarHBondContact O-N 3.1Å; L83-I88 WeakPolarHBondContact CB-O 3.41Å; L83-I88 HydrophobicContact CD2-CG2 4.32Å; L83-I88 PolarHBondContact O-N 2.87Å; L83-L90 HydrophobicContact CD1-CB 3.61Å; L83-L90 HydrophobicContact CD1-CD2 4.2Å; L83-L90 HydrophobicContact CD2-CB 4.26Å; L83-L205 HydrophobicContact CD2-CD2 3.91Å; L83-V210 HydrophobicContact CD2-CG2 4.37Å
84	E	94.2	Very high	94.6	Very high	114 Å²	114	42.8 Å²	42.8	53%	0.533	21%	0.214	S	C	.	.	H	α-helix	trans	-62.9	-46.6	177.9	-72.7	173	172.1	0	0	112.1	R80 K81 A86 G87	R80-E84 HydrophobicContact CG-CG 4.27Å; R80-E84 WeakPolarHBondContact CG-OE1 3.35Å; R80-E84 IonicContact CZ-OE1 3.96Å; R80-E84 IonicContact NE-OE1 3.63Å; R80-E84 PolarHBondContact NE-OE1 3.37Å; R80-E84 IonicContact NH2-OE1 3.97Å; R80-E84 PolarHBondContact NH2-OE1 2.95Å; R80-E84 WeakPolarHBondContact O-CG 3.49Å; R80-E84 PolarHBondContact O-N 3.31Å; K81-E84 PolarHBondContact O-N 3.15Å; E84-A86 PolarHBondContact O-N 2.88Å; E84-G87 PolarHBondContact O-N 3.08Å; E84-G87 VanDerWaalsContact O-N 3.08Å
85	E	93.2	Very high	94.4	Very high	120 Å²	120	43.1 Å²	43.1	56%	0.561	22%	0.216	S	C	*	.	H	α-helix	trans	-61.1	-32	176.5	-75.1	174.3	172.2	0	0	112.5	K81 Q212	K81-E85 WeakPolarHBondContact CE-OE1 3.33Å; K81-E85 HydrophobicContact CG-CG 4.33Å; K81-E85 IonicContact NZ-OE1 3.61Å; K81-E85 WeakPolarHBondContact O-CB 3.23Å; K81-E85 VanDerWaalsContact O-CG 3.29Å; K81-E85 WeakPolarHBondContact O-CG 3.37Å; K81-E85 PolarHBondContact O-N 2.79Å; E85-Q212 PolarHBondContact OE2-NE2 3.19Å
86	A	92.7	Very high	93.9	Very high	39 Å²	39	43.4 Å²	43.4	32%	0.322	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-6.1	178	0	0	0	0	0	113.6	A82 L83 E84 I88 V210	A82-A86 WeakPolarHBondContact O-CB 3.38Å; A82-A86 PolarHBondContact O-N 3.05Å; L83-A86 CarbonylContact O-C 3.55Å; L83-A86 PolarHBondContact O-N 2.97Å; E84-A86 PolarHBondContact O-N 2.88Å; A86-I88 VanDerWaalsContact C-N 3.26Å; A86-I88 HydrophobicContact CB-CB 4.5Å; A86-I88 HydrophobicContact CB-CD1 3.56Å; A86-I88 HydrophobicContact CB-CG1 4.08Å; A86-I88 PolarHBondContact O-N 2.86Å; A86-V210 HydrophobicContact CB-CG2 4.16Å
87	G	94.9	Very high	93.7	Very high	47 Å²	47	43.7 Å²	43.7	49%	0.485	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.7	31.9	-175.3	0	0	0	0	0	113.4	L83 E84	L83-G87 PolarHBondContact O-N 3.1Å; E84-G87 PolarHBondContact O-N 3.08Å; E84-G87 VanDerWaalsContact O-N 3.08Å
88	I	95.8	Very high	93.6	Very high	10 Å²	10	41.8 Å²	41.8	5%	0.051	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	137.7	-175.5	-65.9	159.4	0	0	0	109.7	K54 V56 L83 A86 A208 V210	K54-I88 HydrophobicContact CB-CG1 4.47Å; K54-I88 HydrophobicContact CD-CG1 4.49Å; K54-I88 WeakPolarHBondContact O-CA 3.37Å; V56-I88 HydrophobicContact CG2-CG2 3.97Å; L83-I88 WeakPolarHBondContact CB-O 3.41Å; L83-I88 HydrophobicContact CD2-CG2 4.32Å; L83-I88 PolarHBondContact O-N 2.87Å; A86-I88 VanDerWaalsContact C-N 3.26Å; A86-I88 HydrophobicContact CB-CB 4.5Å; A86-I88 HydrophobicContact CB-CD1 3.56Å; A86-I88 HydrophobicContact CB-CG1 4.08Å; A86-I88 PolarHBondContact O-N 2.86Å; I88-A208 VanDerWaalsContact CD1-C 3.47Å; I88-A208 HydrophobicContact CD1-CB 3.71Å; I88-A208 VanDerWaalsContact CD1-O 3.24Å; I88-A208 WeakPolarHBondContact CD1-O 3.47Å; I88-A208 HydrophobicContact CG1-CB 4.41Å; I88-A208 HydrophobicContact CG2-CB 4.19Å; I88-V210 HydrophobicContact CD1-CG2 3.64Å
89	R	97.3	Very high	93.4	Very high	56 Å²	56	48.2 Å²	48.2	21%	0.211	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	144	169.1	-59.7	166.5	63.8	-170.3	0.9	110.3	S48 L49 S53 K54 S55 V56 V91 E113	S48-R89 PolarHBondContact O-NH1 2.97Å; L49-R89 VanDerWaalsContact C-NH1 3.31Å; L49-R89 VanDerWaalsContact CA-NH1 3.34Å; L49-R89 PolarHBondContact O-NH1 2.92Å; S53-R89 WeakPolarHBondContact OG-CD 3.35Å; K54-R89 PolarHBondContact O-N 3.03Å; S55-R89 CarbonylContact C-O 3.59Å; S55-R89 WeakPolarHBondContact CA-O 3.48Å; S55-R89 WeakPolarHBondContact OG-CB 3.34Å; V56-R89 PolarHBondContact N-O 3.32Å; R89-V91 HydrophobicContact CB-CG2 4.2Å; R89-E113 IonicContact CZ-OE1 3.43Å; R89-E113 IonicContact CZ-OE2 2.71Å; R89-E113 IonicContact NE-OE1 2.74Å; R89-E113 PolarHBondContact NE-OE1 3.19Å; R89-E113 IonicContact NE-OE2 2.78Å; R89-E113 IonicContact NH2-OE1 3.3Å; R89-E113 PolarHBondContact NH2-OE1 3.39Å; R89-E113 IonicContact NH2-OE2 3.25Å; R89-E113 PolarHBondContact NH2-OE2 3.04Å
90	L	97.9	Very high	93.1	Very high	5 Å²	5	46.8 Å²	46.8	3%	0.026	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	116.8	170.6	-179.8	61	0	0	0	108	V56 I58 L75 V78 L83 Y110 E113	V56-L90 HydrophobicContact CB-CD1 3.89Å; V56-L90 HydrophobicContact CG1-CD1 3.84Å; I58-L90 HydrophobicContact CG1-CD1 4.34Å; L75-L90 HydrophobicContact CD2-CD1 4.18Å; L75-L90 HydrophobicContact CD2-CD2 4.16Å; V78-L90 HydrophobicContact CB-CD2 4.08Å; V78-L90 HydrophobicContact CG1-CD2 4.24Å; V78-L90 HydrophobicContact CG2-CD2 4.14Å; L83-L90 HydrophobicContact CD1-CB 3.61Å; L83-L90 HydrophobicContact CD1-CD2 4.2Å; L83-L90 HydrophobicContact CD2-CB 4.26Å; L90-Y110 PolarHBondContact O-OH 2.96Å; L90-E113 PolarHBondContact O-N 2.75Å
91	V	98.3	Very high	93	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	132.7	-171.1	-172	0	0	0	0	110.2	L49 V56 I57 I58 R89 I93 E113 Y115	L49-V91 HydrophobicContact CD1-CG1 3.95Å; L49-V91 HydrophobicContact CD2-CG1 4.18Å; L49-V91 HydrophobicContact CD2-CG2 4.44Å; V56-V91 PolarHBondContact O-N 3.35Å; I57-V91 WeakPolarHBondContact CA-O 3.28Å; I58-V91 PolarHBondContact N-O 2.86Å; R89-V91 HydrophobicContact CB-CG2 4.2Å; V91-I93 HydrophobicContact CG1-CG1 4.45Å; V91-E113 CarbonylContact C-O 3.58Å; V91-E113 WeakPolarHBondContact CA-O 3.38Å; V91-E113 HydrophobicContact CG1-CB 4.32Å; V91-E113 HydrophobicContact CG2-CB 4.12Å; V91-Y115 HydrophobicContact CG1-CD2 3.58Å; V91-Y115 HydrophobicContact CG1-CE2 3.83Å
92	V	98	Very high	92.9	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	134.1	168.8	169.3	0	0	0	0	110	I58 V60 V72 L75 Y110 E113 I114 Y115	I58-V92 HydrophobicContact CB-CG2 4.14Å; I58-V92 CarbonylContact O-C 3.5Å; I58-V92 WeakPolarHBondContact O-CA 3.44Å; V60-V92 HydrophobicContact CG1-CG1 4.04Å; V60-V92 HydrophobicContact CG2-CG1 4.28Å; V72-V92 HydrophobicContact CG2-CG1 4.46Å; V72-V92 HydrophobicContact CG2-CG2 4.3Å; L75-V92 HydrophobicContact CD1-CG2 4.06Å; V92-Y110 HydrophobicContact CB-CE1 4.1Å; V92-Y110 HydrophobicContact CG2-CE1 3.93Å; V92-Y110 HydrophobicContact CG2-CE2 4.03Å; V92-Y110 WeakPolarHBondContact CG2-OH 3.41Å; V92-E113 PolarHBondContact N-O 3.08Å; V92-I114 HydrophobicContact CB-CB 4.46Å; V92-I114 HydrophobicContact CB-CD1 4.3Å; V92-I114 HydrophobicContact CB-CG1 4.14Å; V92-I114 HydrophobicContact CG1-CD1 3.96Å; V92-I114 HydrophobicContact CG1-CG1 4.09Å; V92-I114 CarbonylContact O-C 3.53Å; V92-I114 VanDerWaalsContact O-CA 3.28Å; V92-I114 WeakPolarHBondContact O-CA 3.36Å; V92-Y115 PolarHBondContact O-N 3.03Å
93	I	97.3	Very high	92.7	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	123.7	172	-59.9	-179.6	0	0	0	108.2	I36 F46 L49 I57 I58 F59 V60 V91 Y115 D117 Y123	I36-I93 HydrophobicContact CG2-CD1 4.46Å; F46-I93 HydrophobicContact CD2-CD1 4.01Å; F46-I93 HydrophobicContact CE2-CD1 3.56Å; L49-I93 HydrophobicContact CD1-CD1 3.81Å; L49-I93 HydrophobicContact CD1-CG1 4.49Å; I57-I93 HydrophobicContact CG2-CD1 3.62Å; I57-I93 HydrophobicContact CG2-CG1 4.14Å; I58-I93 PolarHBondContact O-N 2.92Å; F59-I93 HydrophobicContact CD1-CB 4.06Å; F59-I93 HydrophobicContact CD1-CD1 4.44Å; F59-I93 HydrophobicContact CD1-CG2 4.16Å; F59-I93 HydrophobicContact CE1-CB 4.27Å; F59-I93 HydrophobicContact CE1-CD1 3.82Å; F59-I93 HydrophobicContact CE1-CG2 4.26Å; F59-I93 HydrophobicContact CZ-CD1 4.06Å; V60-I93 WeakPolarHBondContact CG2-O 3.37Å; V60-I93 PolarHBondContact N-O 3.08Å; V91-I93 HydrophobicContact CG1-CG1 4.45Å; I93-Y115 WeakPolarHBondContact CA-O 3.31Å; I93-D117 HydrophobicContact CG2-CB 4.16Å; I93-Y123 HydrophobicContact CG2-CE2 4.21Å; I93-Y123 PolarHBondContact O-OH 3.36Å
94	G	92.2	Very high	92.4	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	153.9	174.9	0	0	0	0	0	114.1	F63 S96 Y115 V116 D117	F63-G94 VanDerWaalsContact CE1-CA 3.47Å; G94-S96 PolarHBondContact O-N 3.28Å; G94-Y115 PolarHBondContact N-O 3.17Å; G94-V116 CarbonylContact O-C 3.49Å; G94-V116 WeakPolarHBondContact O-CA 3.38Å; G94-V116 WeakPolarHBondContact O-CB 3.47Å; G94-D117 PolarHBondContact O-N 3.29Å
95	Q	86.9	Confident	92.2	Very high	9 Å²	9	36.1 Å²	36.1	4%	0.042	20%	0.195	C	C	.	.	S	Bend	trans	-90	83.2	164.2	-176.6	-162.7	-13.8	0	0	109.6	R61 R120 Q168	R61-Q95 PolarHBondContact O-OE1 3.05Å; Q95-R120 HydrophobicContact CB-CG 4.32Å; Q95-R120 HydrophobicContact CG-CG 3.49Å; Q95-R120 VanDerWaalsContact CG-CG 3.49Å; Q95-R120 VanDerWaalsContact NE2-CD 3.27Å; Q95-R120 VanDerWaalsContact NE2-NE 3.16Å; Q95-Q168 VanDerWaalsContact O-O 3.1Å
96	S	84.2	Confident	92	Very high	7 Å²	7	37.1 Å²	37.1	5%	0.049	20%	0.203	C	C	.	.	S	Bend	trans	-158.5	-179.9	166.3	78.4	0	0	0	0	110.2	F63 G94 V116 P118	F63-S96 WeakPolarHBondContact CD2-OG 3.32Å; F63-S96 WeakPolarHBondContact CE2-OG 3.39Å; G94-S96 PolarHBondContact O-N 3.28Å; S96-V116 WeakPolarHBondContact O-CB 3.33Å; S96-V116 WeakPolarHBondContact O-CG2 3.13Å; S96-P118 WeakPolarHBondContact O-CG 3.32Å
97	T	88.4	Confident	91.6	Very high	34 Å²	34	37.9 Å²	37.9	21%	0.209	20%	0.202	C	C	.	.			trans	-74.8	153.2	165.3	48.5	0	0	0	0	111.7	Q99 H100 Q168	T97-Q99 PolarHBondContact O-N 3.41Å; T97-H100 PolarHBondContact O-N 2.95Å; T97-H100 VanDerWaalsContact O-N 3.08Å; T97-H100 PolarHBondContact OG1-CD2 2.76Å; T97-H100 VanDerWaalsContact OG1-CD2 3.26Å; T97-H100 PolarHBondContact OG1-NE2 3.02Å; T97-Q168 PolarHBondContact OG1-OE1 2.92Å
98	H	92.3	Very high	91.3	Very high	63 Å²	63	35.8 Å²	35.8	29%	0.292	18%	0.18	S	C	.	.	G	3₁₀ helix	trans	-57.7	-25.9	-175.3	65.1	-87	0	0	0	114	D38 H100 I101 V116	D38-H98 WeakPolarHBondContact O-CB 3.33Å; H98-H100 PolarHBondContact O-N 3.2Å; H98-H100 VanDerWaalsContact O-N 3.14Å; H98-I101 HydrophobicContact CB-CD1 4.26Å; H98-I101 VanDerWaalsContact O-CB 3.3Å; H98-I101 WeakPolarHBondContact O-CB 3.18Å; H98-I101 WeakPolarHBondContact O-CG1 3.41Å; H98-I101 PolarHBondContact O-N 2.79Å; H98-V116 HydrophobicContact CB-CG2 4.11Å
99	Q	89.9	Confident	91.1	Very high	137 Å²	137	37.6 Å²	37.6	64%	0.64	20%	0.201	S	C	*	.	G	3₁₀ helix	trans	-58.7	-24.5	178.5	-65.3	174.6	-26	0	0	112.9	T97 P103	T97-Q99 PolarHBondContact O-N 3.41Å; Q99-P103 WeakPolarHBondContact O-CD 3.41Å
100	H	87.4	Confident	91	Very high	20 Å²	20	35.2 Å²	35.2	9%	0.093	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-87.4	-8.7	178.7	-59.5	-63	0	0	0	114	F63 T97 H98 F104 F165	F63-H100 HydrophobicContact CD2-CB 3.8Å; F63-H100 HydrophobicContact CE2-CB 4.3Å; T97-H100 PolarHBondContact O-N 2.95Å; T97-H100 VanDerWaalsContact O-N 3.08Å; T97-H100 PolarHBondContact OG1-CD2 2.76Å; T97-H100 VanDerWaalsContact OG1-CD2 3.26Å; T97-H100 PolarHBondContact OG1-NE2 3.02Å; H98-H100 PolarHBondContact O-N 3.2Å; H98-H100 VanDerWaalsContact O-N 3.14Å; H100-F104 VanDerWaalsContact O-CB 3.25Å; H100-F104 WeakPolarHBondContact O-CB 3.2Å; H100-F104 PolarHBondContact O-N 3.44Å; H100-F104 VanDerWaalsContact O-N 3.13Å; H100-F165 HydrophobicContact CB-CE1 4.11Å; H100-F165 AromaticContact CE1-CD1 3.57Å; H100-F165 AromaticContact CE1-CE1 3.83Å; H100-F165 AromaticContact CG-CE1 3.8Å; H100-F165 AromaticContact ND1-CD1 3.29Å; H100-F165 VanDerWaalsContact ND1-CD1 3.29Å; H100-F165 WeakPolarHBondContact ND1-CD1 3.47Å; H100-F165 AromaticContact ND1-CE1 3.05Å; H100-F165 WeakPolarHBondContact ND1-CE1 3.47Å; H100-F165 AromaticContact ND1-CG 4Å; H100-F165 AromaticContact ND1-CZ 3.58Å
101	I	91.9	Very high	90.9	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-60.3	-49.8	178.8	-70.7	173.4	0	0	0	110.4	R39 F63 H98 F104 C105 I114 V116	R39-I101 HydrophobicContact CB-CB 4.23Å; R39-I101 HydrophobicContact CB-CD1 4.46Å; R39-I101 HydrophobicContact CB-CG2 3.78Å; F63-I101 HydrophobicContact CE2-CG1 4.02Å; F63-I101 HydrophobicContact CZ-CG1 4.28Å; H98-I101 HydrophobicContact CB-CD1 4.26Å; H98-I101 VanDerWaalsContact O-CB 3.3Å; H98-I101 WeakPolarHBondContact O-CB 3.18Å; H98-I101 WeakPolarHBondContact O-CG1 3.41Å; H98-I101 PolarHBondContact O-N 2.79Å; I101-F104 PolarHBondContact O-N 2.95Å; I101-C105 PolarHBondContact O-N 2.89Å; I101-I114 HydrophobicContact CG2-CB 4.46Å; I101-I114 HydrophobicContact CG2-CD1 4.46Å; I101-I114 HydrophobicContact CG2-CG1 4.34Å; I101-I114 HydrophobicContact CG2-CG2 3.4Å; I101-I114 VanDerWaalsContact CG2-CG2 3.4Å; I101-V116 HydrophobicContact CD1-CG1 3.9Å; I101-V116 HydrophobicContact CD1-CG2 4.28Å; I101-V116 HydrophobicContact CG1-CG1 3.79Å
102	E	90.9	Very high	90.8	Very high	136 Å²	136	40.2 Å²	40.2	64%	0.636	23%	0.225	S	C	*	.	H	α-helix	trans	-64.9	-49.3	-174.6	176.2	164.2	-142.6	0	0	112.9	F104 C105 L106	E102-F104 VanDerWaalsContact C-N 3.27Å; E102-F104 PolarHBondContact O-N 2.8Å; E102-C105 PolarHBondContact O-N 2.65Å; E102-L106 HydrophobicContact CG-CD1 4.35Å; E102-L106 WeakPolarHBondContact O-CG 3.21Å; E102-L106 PolarHBondContact O-N 2.79Å
103	P	87.4	Confident	90.8	Very high	51 Å²	51	42.9 Å²	42.9	33%	0.331	24%	0.237	S	C	.	.	H	α-helix	trans	-54.8	-40	170.7	-28.6	35.5	0	0	0	114	Q99 L106 L107 F165	Q99-P103 WeakPolarHBondContact O-CD 3.41Å; P103-L106 PolarHBondContact O-N 3.39Å; P103-L107 WeakPolarHBondContact O-CB 3.42Å; P103-L107 PolarHBondContact O-N 3.36Å; P103-F165 HydrophobicContact CB-CE2 4.35Å; P103-F165 HydrophobicContact CB-CZ 3.72Å; P103-F165 HydrophobicContact CG-CZ 4.11Å
104	F	88.2	Confident	90.8	Very high	6 Å²	6	43.2 Å²	43.2	3%	0.026	24%	0.239	C	C	.	.	H	α-helix	trans	-69	-40.5	-179.5	-173.5	-109.3	0	0	0	112.1	F63 V72 H100 I101 E102 L107 T108 I114	F63-F104 HydrophobicContact CB-CD2 3.81Å; F63-F104 HydrophobicContact CB-CE2 4.19Å; F63-F104 HydrophobicContact CB-CG 4.2Å; F63-F104 AromaticContact CD1-CD1 3.9Å; F63-F104 HydrophobicContact CD1-CD1 3.9Å; F63-F104 HydrophobicContact CD1-CD2 4.21Å; F63-F104 AromaticContact CD1-CE1 3.91Å; F63-F104 HydrophobicContact CD1-CE1 3.91Å; F63-F104 HydrophobicContact CD1-CE2 4.25Å; F63-F104 HydrophobicContact CD1-CG 4.04Å; F63-F104 HydrophobicContact CD1-CZ 4.1Å; F63-F104 HydrophobicContact CD2-CB 4.08Å; F63-F104 HydrophobicContact CD2-CG 4.21Å; F63-F104 AromaticContact CE1-CD1 3.95Å; F63-F104 HydrophobicContact CE1-CD1 3.95Å; F63-F104 HydrophobicContact CE1-CE1 4.03Å; F63-F104 HydrophobicContact CE1-CG 4.45Å; F63-F104 HydrophobicContact CE2-CB 4.45Å; F63-F104 HydrophobicContact CG-CB 4.26Å; F63-F104 HydrophobicContact CG-CD1 4.22Å; F63-F104 HydrophobicContact CG-CD2 4.02Å; F63-F104 HydrophobicContact CG-CE2 4.42Å; F63-F104 AromaticContact CG-CG 3.91Å; F63-F104 HydrophobicContact CG-CG 3.91Å; F63-F104 HydrophobicContact CZ-CD1 4.34Å; V72-F104 HydrophobicContact CB-CE1 4.1Å; V72-F104 HydrophobicContact CB-CZ 3.99Å; V72-F104 HydrophobicContact CG1-CE1 3.76Å; V72-F104 HydrophobicContact CG1-CZ 4.14Å; V72-F104 HydrophobicContact CG2-CE1 4Å; V72-F104 HydrophobicContact CG2-CZ 3.93Å; H100-F104 VanDerWaalsContact O-CB 3.25Å; H100-F104 WeakPolarHBondContact O-CB 3.2Å; H100-F104 PolarHBondContact O-N 3.44Å; H100-F104 VanDerWaalsContact O-N 3.13Å; I101-F104 PolarHBondContact O-N 2.95Å; E102-F104 VanDerWaalsContact C-N 3.27Å; E102-F104 PolarHBondContact O-N 2.8Å; F104-L107 PolarHBondContact O-N 3.38Å; F104-T108 HydrophobicContact CD2-CG2 4.41Å; F104-T108 HydrophobicContact CE1-CG2 4.34Å; F104-T108 HydrophobicContact CE2-CG2 4.08Å; F104-T108 HydrophobicContact CZ-CG2 4.04Å; F104-T108 WeakPolarHBondContact O-CB 3.28Å; F104-T108 WeakPolarHBondContact O-CG2 3.42Å; F104-T108 PolarHBondContact O-N 3.39Å; F104-T108 VanDerWaalsContact O-N 3.09Å; F104-T108 PolarHBondContact O-OG1 2.81Å; F104-I114 HydrophobicContact CD1-CD1 3.77Å; F104-I114 HydrophobicContact CE1-CD1 4.19Å
105	C	90.9	Very high	91	Very high	18 Å²	18	44.5 Å²	44.5	12%	0.122	24%	0.244	C	C	.	.	H	α-helix	trans	-60.6	-45.1	171.3	-78.9	0	0	0	0	111.9	I101 E102 L107 T108 G109 Y110	I101-C105 PolarHBondContact O-N 2.89Å; E102-C105 PolarHBondContact O-N 2.65Å; C105-L107 VanDerWaalsContact C-N 3.29Å; C105-L107 PolarHBondContact O-N 3.04Å; C105-T108 PolarHBondContact O-N 3.25Å; C105-T108 PolarHBondContact O-OG1 3.28Å; C105-G109 WeakPolarHBondContact O-CA 3.18Å; C105-G109 PolarHBondContact O-N 3.27Å; C105-Y110 PolarHBondContact O-N 3.31Å; C105-Y110 PolarHBondContact SG-O 3.29Å
106	L	88.6	Confident	91.5	Very high	141 Å²	141	44 Å²	44	74%	0.738	24%	0.242	S	C	*	.	H	α-helix	trans	-60.7	-39.7	177	-71	171.1	0	0	0	112	E102 P103	E102-L106 HydrophobicContact CG-CD1 4.35Å; E102-L106 WeakPolarHBondContact O-CG 3.21Å; E102-L106 PolarHBondContact O-N 2.79Å; P103-L106 PolarHBondContact O-N 3.39Å
107	L	85.2	Confident	92	Very high	56 Å²	56	43.9 Å²	43.9	29%	0.293	24%	0.241	S	C	.	.	H	α-helix	trans	-71	-30.6	-179.7	-178.8	64.1	0	0	0	113.8	K69 P103 F104 C105 I156 M160	K69-L107 VanDerWaalsContact CE-O 3.24Å; K69-L107 WeakPolarHBondContact CE-O 3.34Å; K69-L107 HydrophobicContact CG-CD2 3.99Å; K69-L107 HydrophobicContact CG-CG 4.27Å; K69-L107 PolarHBondContact NZ-O 3.35Å; P103-L107 WeakPolarHBondContact O-CB 3.42Å; P103-L107 PolarHBondContact O-N 3.36Å; F104-L107 PolarHBondContact O-N 3.38Å; C105-L107 VanDerWaalsContact C-N 3.29Å; C105-L107 PolarHBondContact O-N 3.04Å; L107-I156 HydrophobicContact CD1-CG2 4.09Å; L107-I156 HydrophobicContact CD2-CG2 4.36Å; L107-M160 HydrophobicContact CD2-CE 3.92Å; L107-M160 HydrophobicContact CD2-SD 3.48Å; L107-M160 WeakPolarHBondContact CD2-SD 3.41Å
108	T	88.1	Confident	92.1	Very high	3 Å²	3	44.7 Å²	44.7	2%	0.018	25%	0.246	C	C	.	.	H	α-helix	trans	-105.7	-13.7	-173.5	55.4	0	0	0	0	113.8	K69 V72 S76 F104 C105 Y110	K69-T108 HydrophobicContact CD-CG2 4.43Å; K69-T108 HydrophobicContact CG-CG2 3.94Å; V72-T108 HydrophobicContact CB-CG2 4.15Å; V72-T108 HydrophobicContact CG1-CG2 3.94Å; S76-T108 WeakPolarHBondContact CB-O 3.33Å; S76-T108 PolarHBondContact OG-O 3.13Å; F104-T108 HydrophobicContact CD2-CG2 4.41Å; F104-T108 HydrophobicContact CE1-CG2 4.34Å; F104-T108 HydrophobicContact CE2-CG2 4.08Å; F104-T108 HydrophobicContact CZ-CG2 4.04Å; F104-T108 WeakPolarHBondContact O-CB 3.28Å; F104-T108 WeakPolarHBondContact O-CG2 3.42Å; F104-T108 PolarHBondContact O-N 3.39Å; F104-T108 VanDerWaalsContact O-N 3.09Å; F104-T108 PolarHBondContact O-OG1 2.81Å; C105-T108 PolarHBondContact O-N 3.25Å; C105-T108 PolarHBondContact O-OG1 3.28Å; T108-Y110 PolarHBondContact O-N 2.83Å; T108-Y110 VanDerWaalsContact OG1-CB 3.29Å; T108-Y110 WeakPolarHBondContact OG1-CB 3.44Å; T108-Y110 PolarHBondContact OG1-N 2.83Å
109	G	91.9	Very high	91.9	Very high	48 Å²	48	49.3 Å²	49.3	50%	0.495	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	68	9.4	-168.3	0	0	0	0	0	113.7	C105 S111	C105-G109 WeakPolarHBondContact O-CA 3.18Å; C105-G109 PolarHBondContact O-N 3.27Å; G109-S111 PolarHBondContact O-N 2.82Å
110	Y	95.4	Very high	91.9	Very high	5 Å²	5	44.8 Å²	44.8	2%	0.02	24%	0.243	C	C	.	.			trans	-68.9	118.1	-175.5	-171	-100.6	0	0	0	111.4	V72 L75 L90 V92 C105 T108 H112 E113 I114	V72-Y110 HydrophobicContact CG1-CD1 4.48Å; V72-Y110 HydrophobicContact CG1-CD2 3.78Å; V72-Y110 HydrophobicContact CG1-CG 3.74Å; L75-Y110 HydrophobicContact CB-CD2 4.12Å; L75-Y110 HydrophobicContact CB-CE2 3.84Å; L90-Y110 PolarHBondContact O-OH 2.96Å; V92-Y110 HydrophobicContact CB-CE1 4.1Å; V92-Y110 HydrophobicContact CG2-CE1 3.93Å; V92-Y110 HydrophobicContact CG2-CE2 4.03Å; V92-Y110 WeakPolarHBondContact CG2-OH 3.41Å; C105-Y110 PolarHBondContact O-N 3.31Å; C105-Y110 PolarHBondContact SG-O 3.29Å; T108-Y110 PolarHBondContact O-N 2.83Å; T108-Y110 VanDerWaalsContact OG1-CB 3.29Å; T108-Y110 WeakPolarHBondContact OG1-CB 3.44Å; T108-Y110 PolarHBondContact OG1-N 2.83Å; Y110-H112 HydrophobicContact CE1-CB 3.93Å; Y110-H112 HydrophobicContact CE2-CB 4.06Å; Y110-H112 AromaticContact CE2-CD2 3.6Å; Y110-H112 WeakPolarHBondContact OH-CB 3.5Å; Y110-E113 WeakPolarHBondContact CE1-O 3.37Å; Y110-E113 PolarHBondContact OH-O 3.14Å; Y110-I114 HydrophobicContact CD1-CB 4.32Å; Y110-I114 HydrophobicContact CE1-CB 4.08Å
111	S	95.3	Very high	92.2	Very high	90 Å²	90	45.9 Å²	45.9	63%	0.629	25%	0.253	S	S	*	.			trans	-115.8	-2.4	-173.1	61.4	0	0	0	0	114.2	G109	G109-S111 PolarHBondContact O-N 2.82Å
112	H	96.4	Very high	92.3	Very high	20 Å²	20	45.9 Å²	45.9	9%	0.093	25%	0.253	C	S	.	.	S	Bend	trans	-80.9	-169.3	173.3	-48.2	-74.6	0	0	0	111.1	V78 Y110	V78-H112 PolarHBondContact O-CE1 3.49Å; V78-H112 PolarHBondContact O-NE2 3.26Å; V78-H112 VanDerWaalsContact O-NE2 3.08Å; Y110-H112 HydrophobicContact CE1-CB 3.93Å; Y110-H112 HydrophobicContact CE2-CB 4.06Å; Y110-H112 AromaticContact CE2-CD2 3.6Å; Y110-H112 WeakPolarHBondContact OH-CB 3.5Å
113	E	97.1	Very high	92.3	Very high	56 Å²	56	39.4 Å²	39.4	26%	0.262	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	131.8	-175.2	-65	-172.7	-108	0	0	111.7	R89 L90 V91 V92 Y110 Y115	R89-E113 IonicContact CZ-OE1 3.43Å; R89-E113 IonicContact CZ-OE2 2.71Å; R89-E113 IonicContact NE-OE1 2.74Å; R89-E113 PolarHBondContact NE-OE1 3.19Å; R89-E113 IonicContact NE-OE2 2.78Å; R89-E113 IonicContact NH2-OE1 3.3Å; R89-E113 PolarHBondContact NH2-OE1 3.39Å; R89-E113 IonicContact NH2-OE2 3.25Å; R89-E113 PolarHBondContact NH2-OE2 3.04Å; L90-E113 PolarHBondContact O-N 2.75Å; V91-E113 CarbonylContact C-O 3.58Å; V91-E113 WeakPolarHBondContact CA-O 3.38Å; V91-E113 HydrophobicContact CG1-CB 4.32Å; V91-E113 HydrophobicContact CG2-CB 4.12Å; V92-E113 PolarHBondContact N-O 3.08Å; Y110-E113 WeakPolarHBondContact CE1-O 3.37Å; Y110-E113 PolarHBondContact OH-O 3.14Å; E113-Y115 HydrophobicContact CB-CE2 3.99Å; E113-Y115 PolarHBondContact OE2-OH 3.23Å
114	I	97.4	Very high	92.5	Very high	7 Å²	7	41.5 Å²	41.5	4%	0.036	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	134.2	178.2	-175.8	163.9	0	0	0	109.8	F63 V92 I101 F104 Y110	F63-I114 HydrophobicContact CE1-CD1 4.18Å; F63-I114 HydrophobicContact CZ-CD1 3.9Å; F63-I114 HydrophobicContact CZ-CG1 4.34Å; V92-I114 HydrophobicContact CB-CB 4.46Å; V92-I114 HydrophobicContact CB-CD1 4.3Å; V92-I114 HydrophobicContact CB-CG1 4.14Å; V92-I114 HydrophobicContact CG1-CD1 3.96Å; V92-I114 HydrophobicContact CG1-CG1 4.09Å; V92-I114 CarbonylContact O-C 3.53Å; V92-I114 VanDerWaalsContact O-CA 3.28Å; V92-I114 WeakPolarHBondContact O-CA 3.36Å; I101-I114 HydrophobicContact CG2-CB 4.46Å; I101-I114 HydrophobicContact CG2-CD1 4.46Å; I101-I114 HydrophobicContact CG2-CG1 4.34Å; I101-I114 HydrophobicContact CG2-CG2 3.4Å; I101-I114 VanDerWaalsContact CG2-CG2 3.4Å; F104-I114 HydrophobicContact CD1-CD1 3.77Å; F104-I114 HydrophobicContact CE1-CD1 4.19Å; Y110-I114 HydrophobicContact CD1-CB 4.32Å; Y110-I114 HydrophobicContact CE1-CB 4.08Å
115	Y	97.9	Very high	92.6	Very high	27 Å²	27	46.9 Å²	46.9	11%	0.106	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	170.3	178.6	-58.1	-92.1	0	0	0	110.1	I36 Y37 D38 F44 L49 V91 V92 I93 G94 E113	I36-Y115 HydrophobicContact CD1-CD1 3.94Å; I36-Y115 HydrophobicContact CD1-CD2 4.14Å; I36-Y115 HydrophobicContact CD1-CE1 4.4Å; I36-Y115 HydrophobicContact CD1-CG 3.81Å; I36-Y115 HydrophobicContact CG1-CD1 4.18Å; I36-Y115 HydrophobicContact CG1-CG 4.34Å; Y37-Y115 CarbonylContact O-C 3.56Å; Y37-Y115 WeakPolarHBondContact O-CA 3.43Å; Y37-Y115 WeakPolarHBondContact O-CB 3.32Å; D38-Y115 HydrophobicContact CB-CD1 4.02Å; D38-Y115 HydrophobicContact CB-CE1 3.97Å; F44-Y115 HydrophobicContact CD2-CD1 4.48Å; F44-Y115 HydrophobicContact CD2-CE1 4Å; F44-Y115 HydrophobicContact CE2-CE1 4.35Å; L49-Y115 HydrophobicContact CD2-CD2 3.99Å; L49-Y115 HydrophobicContact CD2-CE2 3.53Å; V91-Y115 HydrophobicContact CG1-CD2 3.58Å; V91-Y115 HydrophobicContact CG1-CE2 3.83Å; V92-Y115 PolarHBondContact O-N 3.03Å; I93-Y115 WeakPolarHBondContact CA-O 3.31Å; G94-Y115 PolarHBondContact N-O 3.17Å; E113-Y115 HydrophobicContact CB-CE2 3.99Å; E113-Y115 PolarHBondContact OE2-OH 3.23Å
116	V	95.7	Very high	92.6	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	148.9	171.4	-68	0	0	0	0	112.5	I36 Y37 F63 G94 S96 H98 I101 P118	I36-V116 WeakPolarHBondContact CA-O 3.43Å; Y37-V116 PolarHBondContact N-O 3.13Å; Y37-V116 PolarHBondContact O-N 2.88Å; F63-V116 HydrophobicContact CE2-CG1 3.83Å; F63-V116 HydrophobicContact CZ-CG1 3.75Å; G94-V116 CarbonylContact O-C 3.49Å; G94-V116 WeakPolarHBondContact O-CA 3.38Å; G94-V116 WeakPolarHBondContact O-CB 3.47Å; S96-V116 WeakPolarHBondContact O-CB 3.33Å; S96-V116 WeakPolarHBondContact O-CG2 3.13Å; H98-V116 HydrophobicContact CB-CG2 4.11Å; I101-V116 HydrophobicContact CD1-CG1 3.9Å; I101-V116 HydrophobicContact CD1-CG2 4.28Å; I101-V116 HydrophobicContact CG1-CG1 3.79Å; V116-P118 HydrophobicContact CG2-CG 4.07Å
117	D	94.8	Very high	92.6	Very high	3 Å²	3	42.3 Å²	42.3	2%	0.016	24%	0.24	C	C	.	.			trans	-117.3	82.6	166.5	174.9	13	0	0	0	108.6	I93 G94 K119 R120 S121 I122 Y123	I93-D117 HydrophobicContact CG2-CB 4.16Å; G94-D117 PolarHBondContact O-N 3.29Å; D117-K119 PolarHBondContact O-N 3.29Å; D117-R120 PolarHBondContact O-N 3.28Å; D117-R120 PolarHBondContact OD1-N 3.27Å; D117-R120 WeakPolarHBondContact OD2-CA 3.08Å; D117-S121 PolarHBondContact OD1-N 3.03Å; D117-S121 VanDerWaalsContact OD1-N 3.1Å; D117-S121 PolarHBondContact OD2-N 2.82Å; D117-I122 HydrophobicContact CB-CD1 4.35Å; D117-I122 WeakPolarHBondContact OD2-CB 3.32Å; D117-I122 PolarHBondContact OD2-N 3.25Å; D117-Y123 HydrophobicContact CB-CD2 4.48Å; D117-Y123 HydrophobicContact CB-CE2 4.24Å
118	P	90.7	Very high	92.6	Very high	51 Å²	51	39.9 Å²	39.9	33%	0.331	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-30.8	-173.3	-19.9	29.2	0	0	0	112.9	Y37 S96 V116	Y37-P118 HydrophobicContact CD2-CG 4.11Å; Y37-P118 HydrophobicContact CE2-CG 4.42Å; S96-P118 WeakPolarHBondContact O-CG 3.32Å; V116-P118 HydrophobicContact CG2-CG 4.07Å
119	K	89.5	Confident	92	Very high	161 Å²	161	45.6 Å²	45.6	70%	0.7	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-4	-179.4	-67	-174.9	-179.5	178.1	0	112.9	D117 S121	D117-K119 PolarHBondContact O-N 3.29Å; K119-S121 PolarHBondContact O-N 2.71Å; K119-S121 VanDerWaalsContact O-N 3.14Å
120	R	90.1	Very high	90.7	Very high	42 Å²	42	49.2 Å²	49.2	16%	0.158	25%	0.25	C	S	.	.			trans	53.6	27.5	-174.3	-64.6	-179.9	-85.4	-173	-6.7	113.9	Q95 D117 I122 Y123 L124 R130 D170	Q95-R120 HydrophobicContact CB-CG 4.32Å; Q95-R120 HydrophobicContact CG-CG 3.49Å; Q95-R120 VanDerWaalsContact CG-CG 3.49Å; Q95-R120 VanDerWaalsContact NE2-CD 3.27Å; Q95-R120 VanDerWaalsContact NE2-NE 3.16Å; D117-R120 PolarHBondContact O-N 3.28Å; D117-R120 PolarHBondContact OD1-N 3.27Å; D117-R120 WeakPolarHBondContact OD2-CA 3.08Å; R120-I122 PolarHBondContact O-N 2.93Å; R120-Y123 HydrophobicContact CB-CD2 4.28Å; R120-Y123 HydrophobicContact CB-CG 4.46Å; R120-Y123 HydrophobicContact CG-CD2 4.35Å; R120-Y123 PolarHBondContact O-N 3.17Å; R120-L124 HydrophobicContact CB-CG 4.42Å; R120-L124 WeakPolarHBondContact O-CB 3.42Å; R120-L124 VanDerWaalsContact O-CG 3.26Å; R120-L124 WeakPolarHBondContact O-CG 3.38Å; R120-L124 PolarHBondContact O-N 3.49Å; R120-R130 VanDerWaalsContact NH1-CZ 3.3Å; R120-R130 VanDerWaalsContact NH1-NE 3.16Å; R120-R130 VanDerWaalsContact NH1-NH2 3.14Å; R120-D170 IonicContact CZ-OD2 2.68Å; R120-D170 IonicContact NH1-OD2 3.24Å; R120-D170 PolarHBondContact NH1-OD2 3.43Å; R120-D170 IonicContact NH2-OD2 3.06Å
121	S	92.3	Very high	88.9	Confident	42 Å²	42	54.6 Å²	54.6	29%	0.294	28%	0.276	S	S	.	.	H	α-helix	trans	-62.1	-34.3	-175.7	-63	0	0	0	0	111.2	D117 K119 K125	D117-S121 PolarHBondContact OD1-N 3.03Å; D117-S121 VanDerWaalsContact OD1-N 3.1Å; D117-S121 PolarHBondContact OD2-N 2.82Å; K119-S121 PolarHBondContact O-N 2.71Å; K119-S121 VanDerWaalsContact O-N 3.14Å; S121-K125 WeakPolarHBondContact O-CB 3.32Å; S121-K125 VanDerWaalsContact O-CG 3.24Å; S121-K125 WeakPolarHBondContact O-CG 3.46Å; S121-K125 PolarHBondContact O-N 3.2Å
122	I	94.7	Very high	86.9	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-73.7	-51.1	178	-59.3	165.7	0	0	0	109.6	V31 C34 I36 F46 F59 D117 R120 L124 K125 L126	V31-I122 HydrophobicContact CB-CG2 4.34Å; V31-I122 HydrophobicContact CG1-CG2 4.23Å; C34-I122 HydrophobicContact CB-CD1 4.13Å; C34-I122 HydrophobicContact CB-CG1 3.51Å; I36-I122 HydrophobicContact CG2-CD1 3.42Å; I36-I122 VanDerWaalsContact CG2-CD1 3.42Å; F46-I122 HydrophobicContact CB-CD1 3.96Å; F46-I122 HydrophobicContact CD1-CD1 4.44Å; F46-I122 HydrophobicContact CD2-CD1 3.63Å; F46-I122 HydrophobicContact CE1-CG2 4.27Å; F46-I122 HydrophobicContact CE2-CD1 4.24Å; F46-I122 HydrophobicContact CG-CD1 3.76Å; F46-I122 HydrophobicContact CG-CG1 4.41Å; F46-I122 HydrophobicContact CZ-CG2 4.27Å; F59-I122 HydrophobicContact CE1-CB 4.37Å; F59-I122 HydrophobicContact CE1-CG2 3.59Å; F59-I122 HydrophobicContact CZ-CG2 3.81Å; D117-I122 HydrophobicContact CB-CD1 4.35Å; D117-I122 WeakPolarHBondContact OD2-CB 3.32Å; D117-I122 PolarHBondContact OD2-N 3.25Å; R120-I122 PolarHBondContact O-N 2.93Å; I122-L124 VanDerWaalsContact C-N 3.28Å; I122-L124 PolarHBondContact O-N 3.31Å; I122-K125 PolarHBondContact O-N 2.89Å; I122-L126 HydrophobicContact CG2-CD1 3.54Å; I122-L126 HydrophobicContact CG2-CG 4Å; I122-L126 WeakPolarHBondContact O-CB 3.42Å; I122-L126 VanDerWaalsContact O-CG 3.25Å; I122-L126 WeakPolarHBondContact O-CG 3.47Å; I122-L126 PolarHBondContact O-N 3.19Å
123	Y	91.6	Very high	84.6	Confident	0 Å²	0	54 Å²	54	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-52.5	-46.9	178.3	-67.9	-106.2	0	0	0	111.8	F59 V60 I93 D117 R120 G127 M128 Q173	F59-Y123 HydrophobicContact CB-CE1 3.91Å; F59-Y123 HydrophobicContact CD1-CD2 4.35Å; F59-Y123 HydrophobicContact CD1-CE1 4.1Å; F59-Y123 AromaticContact CD1-CE2 3.89Å; F59-Y123 HydrophobicContact CD1-CE2 3.89Å; F59-Y123 AromaticContact CD1-CZ 3.76Å; F59-Y123 HydrophobicContact CG-CE1 4.47Å; V60-Y123 PolarHBondContact O-OH 3.4Å; I93-Y123 HydrophobicContact CG2-CE2 4.21Å; I93-Y123 PolarHBondContact O-OH 3.36Å; D117-Y123 HydrophobicContact CB-CD2 4.48Å; D117-Y123 HydrophobicContact CB-CE2 4.24Å; R120-Y123 HydrophobicContact CB-CD2 4.28Å; R120-Y123 HydrophobicContact CB-CG 4.46Å; R120-Y123 HydrophobicContact CG-CD2 4.35Å; R120-Y123 PolarHBondContact O-N 3.17Å; Y123-G127 PolarHBondContact O-N 3.2Å; Y123-M128 HydrophobicContact CD1-CB 4.47Å; Y123-M128 HydrophobicContact CD1-SD 3.37Å; Y123-M128 WeakPolarHBondContact CD1-SD 3.15Å; Y123-M128 HydrophobicContact CE1-SD 4.03Å; Y123-M128 HydrophobicContact CG-SD 3.93Å; Y123-M128 WeakPolarHBondContact O-CB 3.23Å; Y123-M128 PolarHBondContact O-N 3.26Å; Y123-Q173 HydrophobicContact CD1-CG 3.87Å; Y123-Q173 HydrophobicContact CE1-CG 4.18Å
124	L	90.1	Very high	82.1	Confident	95 Å²	95	58.7 Å²	58.7	50%	0.497	29%	0.287	S	S	.	.	H	α-helix	trans	-64.9	-47.3	-179.7	-70.6	171.2	0	0	0	112.3	R120 I122 L126 G127	R120-L124 HydrophobicContact CB-CG 4.42Å; R120-L124 WeakPolarHBondContact O-CB 3.42Å; R120-L124 VanDerWaalsContact O-CG 3.26Å; R120-L124 WeakPolarHBondContact O-CG 3.38Å; R120-L124 PolarHBondContact O-N 3.49Å; I122-L124 VanDerWaalsContact C-N 3.28Å; I122-L124 PolarHBondContact O-N 3.31Å; L124-L126 VanDerWaalsContact C-N 3.33Å; L124-L126 PolarHBondContact O-N 3.18Å; L124-G127 PolarHBondContact O-N 2.89Å; L124-G127 VanDerWaalsContact O-N 3.13Å
125	K	92	Very high	79.4	Confident	120 Å²	120	61.5 Å²	61.5	52%	0.522	31%	0.305	S	S	.	.	H	α-helix	trans	-70.5	-29.6	-178.4	-75	178	169.4	-167.7	0	113.1	D30 V31 S121 I122 G127	D30-K125 VanDerWaalsContact O-CD 3.26Å; D30-K125 WeakPolarHBondContact O-CD 3.31Å; D30-K125 PolarHBondContact O-NZ 2.93Å; V31-K125 HydrophobicContact CG1-CB 3.43Å; V31-K125 VanDerWaalsContact CG1-CB 3.43Å; V31-K125 HydrophobicContact CG1-CD 3.85Å; V31-K125 HydrophobicContact CG1-CG 4.33Å; S121-K125 WeakPolarHBondContact O-CB 3.32Å; S121-K125 VanDerWaalsContact O-CG 3.24Å; S121-K125 WeakPolarHBondContact O-CG 3.46Å; S121-K125 PolarHBondContact O-N 3.2Å; I122-K125 PolarHBondContact O-N 2.89Å; K125-G127 PolarHBondContact O-N 3.28Å
126	L	90.8	Very high	76.7	Confident	15 Å²	15	69.3 Å²	69.3	8%	0.079	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-3.7	172.9	-66.7	-175.8	0	0	0	113.2	I26 L28 V31 F59 I122 L124 M128 I178 F191	I26-L126 HydrophobicContact CG2-CD2 3.56Å; L28-L126 HydrophobicContact CD2-CD2 4.25Å; V31-L126 HydrophobicContact CG1-CD2 4.08Å; V31-L126 HydrophobicContact CG1-CG 4.12Å; V31-L126 HydrophobicContact CG2-CD2 3.92Å; F59-L126 HydrophobicContact CE1-CD1 4.47Å; F59-L126 HydrophobicContact CE2-CD1 4.33Å; F59-L126 HydrophobicContact CZ-CD1 3.92Å; I122-L126 HydrophobicContact CG2-CD1 3.54Å; I122-L126 HydrophobicContact CG2-CG 4Å; I122-L126 WeakPolarHBondContact O-CB 3.42Å; I122-L126 VanDerWaalsContact O-CG 3.25Å; I122-L126 WeakPolarHBondContact O-CG 3.47Å; I122-L126 PolarHBondContact O-N 3.19Å; L124-L126 VanDerWaalsContact C-N 3.33Å; L124-L126 PolarHBondContact O-N 3.18Å; L126-M128 VanDerWaalsContact C-N 3.34Å; L126-M128 HydrophobicContact CB-CE 4.47Å; L126-M128 HydrophobicContact CB-CG 4.43Å; L126-M128 HydrophobicContact CD1-CE 3.94Å; L126-I178 HydrophobicContact CD1-CD1 3.71Å; L126-F191 HydrophobicContact CB-CZ 4.01Å; L126-F191 VanDerWaalsContact O-CE2 3.23Å; L126-F191 WeakPolarHBondContact O-CE2 3.3Å; L126-F191 WeakPolarHBondContact O-CZ 3.14Å
127	G	86.8	Confident	74.1	Confident	47 Å²	47	74 Å²	74	49%	0.485	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.5	18.4	179.1	0	0	0	0	0	114.4	Y123 L124 K125 K129	Y123-G127 PolarHBondContact O-N 3.2Å; L124-G127 PolarHBondContact O-N 2.89Å; L124-G127 VanDerWaalsContact O-N 3.13Å; K125-G127 PolarHBondContact O-N 3.28Å; G127-K129 PolarHBondContact O-N 3.11Å
128	M	86	Confident	71.7	Confident	6 Å²	6	75.7 Å²	75.7	3%	0.03	40%	0.395	C	S	.	.			trans	-66.2	116.3	174.4	-63.8	179.2	-178	0	0	109.4	F59 Y123 L126 Q173 Q174 F191	F59-M128 HydrophobicContact CB-CE 3.96Å; F59-M128 HydrophobicContact CB-SD 4.23Å; F59-M128 HydrophobicContact CD1-CE 3.99Å; F59-M128 HydrophobicContact CD1-SD 4.39Å; F59-M128 HydrophobicContact CD2-CE 3.55Å; F59-M128 HydrophobicContact CE1-CE 4.35Å; F59-M128 HydrophobicContact CE2-CE 3.96Å; F59-M128 HydrophobicContact CG-CE 3.55Å; F59-M128 HydrophobicContact CG-SD 4.24Å; F59-M128 HydrophobicContact CZ-CE 4.33Å; Y123-M128 HydrophobicContact CD1-CB 4.47Å; Y123-M128 HydrophobicContact CD1-SD 3.37Å; Y123-M128 WeakPolarHBondContact CD1-SD 3.15Å; Y123-M128 HydrophobicContact CE1-SD 4.03Å; Y123-M128 HydrophobicContact CG-SD 3.93Å; Y123-M128 WeakPolarHBondContact O-CB 3.23Å; Y123-M128 PolarHBondContact O-N 3.26Å; L126-M128 VanDerWaalsContact C-N 3.34Å; L126-M128 HydrophobicContact CB-CE 4.47Å; L126-M128 HydrophobicContact CB-CG 4.43Å; L126-M128 HydrophobicContact CD1-CE 3.94Å; M128-Q173 PolarHBondContact O-NE2 2.68Å; M128-Q174 HydrophobicContact CB-CB 4.39Å; M128-F191 HydrophobicContact CE-CD1 3.64Å; M128-F191 HydrophobicContact CE-CE1 3.25Å; M128-F191 HydrophobicContact CE-CZ 4.14Å; M128-F191 HydrophobicContact CG-CD1 3.91Å; M128-F191 HydrophobicContact CG-CE1 3.87Å; M128-F191 HydrophobicContact CG-CE2 4.49Å; M128-F191 HydrophobicContact CG-CG 4.26Å; M128-F191 HydrophobicContact CG-CZ 4.14Å; M128-F191 HydrophobicContact SD-CD1 4.49Å; M128-F191 HydrophobicContact SD-CE1 4.41Å
129	K	76.3	Confident	69.7	Low	122 Å²	122	79.3 Å²	79.3	53%	0.53	41%	0.411	S	S	.	.			trans	-76.5	168.4	-170.5	-58.4	-178.9	177.9	-177.7	0	112.1	G127 E131 Q174	G127-K129 PolarHBondContact O-N 3.11Å; K129-E131 HydrophobicContact CB-CB 4.47Å; K129-Q174 HydrophobicContact CB-CG 4.44Å; K129-Q174 WeakPolarHBondContact O-CB 3.39Å; K129-Q174 WeakPolarHBondContact O-CG 3.18Å; K129-Q174 PolarHBondContact O-N 3.46Å
130	R	64.2	Low	67.9	Low	124 Å²	124	76.1 Å²	76.1	47%	0.468	41%	0.407	S	S	.	.	S	Bend	trans	-106.4	51.9	168.1	-65.7	-178.5	-176.5	176.1	5.3	110.6	R120 D170 H172	R120-R130 VanDerWaalsContact NH1-CZ 3.3Å; R120-R130 VanDerWaalsContact NH1-NE 3.16Å; R120-R130 VanDerWaalsContact NH1-NH2 3.14Å; R130-D170 WeakPolarHBondContact CD-OD2 3.2Å; R130-D170 IonicContact CZ-OD2 2.69Å; R130-D170 IonicContact NE-OD2 3.73Å; R130-D170 PolarHBondContact NE-OD2 3.34Å; R130-D170 IonicContact NH1-OD2 2.88Å; R130-H172 CarbonylContact C-O 3.51Å; R130-H172 VanDerWaalsContact CA-O 3.28Å; R130-H172 WeakPolarHBondContact CA-O 3.25Å; R130-H172 HydrophobicContact CB-CB 4.16Å
131	E	57	Low	66.1	Low	119 Å²	119	74.4 Å²	74.4	56%	0.556	40%	0.401	S	S	*	.			trans	-139	133.5	-177	-66.4	178.5	165.7	0	0	109.4	K129 H172 Q174	K129-E131 HydrophobicContact CB-CB 4.47Å; E131-H172 PolarHBondContact N-O 2.82Å; E131-Q174 PolarHBondContact O-NE2 3.45Å
132	E	54.2	Low	64.4	Low	41 Å²	41	77.3 Å²	77.3	19%	0.192	42%	0.419	C	S	.	.			trans	-95	113	164.6	-69.7	-165	157.9	0	0	107.5	R61 F134 R195	R61-E132 IonicContact CZ-OE1 3.9Å; R61-E132 VanDerWaalsContact CZ-OE1 3.24Å; R61-E132 IonicContact NH1-OE1 3.76Å; R61-E132 PolarHBondContact NH1-OE1 3.37Å; R61-E132 IonicContact NH2-OE1 3.39Å; R61-E132 PolarHBondContact NH2-OE1 3.07Å; E132-F134 HydrophobicContact CB-CD2 4.12Å; E132-F134 HydrophobicContact CB-CE2 3.72Å; E132-F134 HydrophobicContact CB-CZ 4.33Å; E132-F134 PolarHBondContact O-N 3.37Å; E132-F134 WeakPolarHBondContact OE2-CE2 3.46Å; E132-F134 WeakPolarHBondContact OE2-CZ 3.29Å; E132-R195 IonicContact OE1-NH1 3.79Å; E132-R195 IonicContact OE2-NH1 3.22Å; E132-R195 PolarHBondContact OE2-NH1 3.39Å
133	T	48	Very low	62.6	Low	57 Å²	57	77.6 Å²	77.6	35%	0.35	42%	0.42	S	S	.	.			trans	-84	98.6	170.3	-9.5	0	0	0	0	106.8	T135 M193	T133-T135 PolarHBondContact O-N 2.7Å; T133-T135 VanDerWaalsContact O-N 3.07Å; T133-M193 HydrophobicContact CG2-CE 4.27Å; T133-M193 PolarHBondContact N-O 2.85Å; T133-M193 WeakPolarHBondContact OG1-CE 3.28Å; T133-M193 PolarHBondContact OG1-O 2.8Å
134	F	43.9	Very low	61	Low	153 Å²	153	79.4 Å²	79.4	67%	0.671	43%	0.431	S	S	*	.			trans	-74.6	93.4	170.6	-72.8	-86.9	0	0	0	108.2	E132	E132-F134 HydrophobicContact CB-CD2 4.12Å; E132-F134 HydrophobicContact CB-CE2 3.72Å; E132-F134 HydrophobicContact CB-CZ 4.33Å; E132-F134 PolarHBondContact O-N 3.37Å; E132-F134 WeakPolarHBondContact OE2-CE2 3.46Å; E132-F134 WeakPolarHBondContact OE2-CZ 3.29Å
135	T	42.1	Very low	59.3	Low	67 Å²	67	79.7 Å²	79.7	41%	0.411	43%	0.429	S	S	.	.			trans	-95.3	128.1	165.5	52.6	0	0	0	0	108	T133 S137 A138	T133-T135 PolarHBondContact O-N 2.7Å; T133-T135 VanDerWaalsContact O-N 3.07Å; T135-S137 PolarHBondContact O-N 3.25Å; T135-A138 PolarHBondContact O-N 3.39Å; T135-A138 VanDerWaalsContact O-N 3.17Å
136	D	40.6	Very low	57.3	Low	190 Å²	190	75.9 Å²	75.9	100%	1.016	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-4.3	172.6	-87.4	-31.7	0	0	0	113.2
137	S	41.5	Very low	55.3	Low	99 Å²	99	78.8 Å²	78.8	69%	0.692	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.1	1.1	-177.6	65.8	0	0	0	0	114.7	T135 L139	T135-S137 PolarHBondContact O-N 3.25Å; S137-L139 PolarHBondContact O-N 2.78Å; S137-L139 VanDerWaalsContact O-N 3.08Å
138	A	43.7	Very low	53.2	Low	38 Å²	38	83.7 Å²	83.7	31%	0.314	47%	0.465	S	S	.	.			trans	-71.4	104.3	176.1	0	0	0	0	0	109.4	T135	T135-A138 PolarHBondContact O-N 3.39Å; T135-A138 VanDerWaalsContact O-N 3.17Å
139	L	48.1	Very low	51.2	Low	127 Å²	127	89.8 Å²	89.8	67%	0.665	49%	0.491	S	S	*	.	P	Polyproline II helix	trans	-55.4	128.7	170.8	-71.3	168.3	0	0	0	108.4	S137 S141	S137-L139 PolarHBondContact O-N 2.78Å; S137-L139 VanDerWaalsContact O-N 3.08Å; L139-S141 PolarHBondContact O-N 3.47Å
140	P	52.9	Low	49.9	Very low	95 Å²	95	90.6 Å²	90.6	62%	0.617	50%	0.499	S	S	*	.	P	Polyproline II helix	trans	-59.6	133.8	-179.2	20.8	-30.1	0	0	0	110.3
141	S	51.3	Low	49.1	Very low	6 Å²	6	87.2 Å²	87.2	4%	0.042	50%	0.502	C	S	.	.	P	Polyproline II helix	trans	-50.5	130.1	175.8	-179.8	0	0	0	0	110.2	L139 H143 V144 L196	L139-S141 PolarHBondContact O-N 3.47Å; S141-H143 PolarHBondContact O-N 3.01Å; S141-H143 PolarHBondContact OG-N 3.04Å; S141-H143 PolarHBondContact OG-ND1 3.46Å; S141-V144 PolarHBondContact O-N 3.04Å; S141-L196 WeakPolarHBondContact CA-O 3.5Å; S141-L196 WeakPolarHBondContact CB-O 3.16Å; S141-L196 PolarHBondContact N-O 3.27Å; S141-L196 VanDerWaalsContact N-O 3.07Å
142	P	57.7	Low	48.5	Very low	102 Å²	102	87.8 Å²	87.8	66%	0.662	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-16.1	176	-23.6	32.6	0	0	0	114.2
143	H	55.4	Low	48.3	Very low	6 Å²	6	87.5 Å²	87.5	3%	0.028	50%	0.504	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-10.5	-177.2	-54.2	81.3	0	0	0	112.4	Y71 D74 S141 K145 P200	Y71-H143 HydrophobicContact CD2-CB 3.93Å; Y71-H143 AromaticContact CD2-CG 3.86Å; D74-H143 IonicContact OD2-CD2 3.39Å; S141-H143 PolarHBondContact O-N 3.01Å; S141-H143 PolarHBondContact OG-N 3.04Å; S141-H143 PolarHBondContact OG-ND1 3.46Å; H143-K145 PolarHBondContact O-N 3.46Å; H143-P200 VanDerWaalsContact CE1-CA 3.47Å; H143-P200 WeakPolarHBondContact CE1-CA 3.42Å
144	V	58.4	Low	48.4	Very low	38 Å²	38	90.8 Å²	90.8	23%	0.23	51%	0.514	C	S	.	.			trans	-87.6	99.6	177.1	176.3	0	0	0	0	108.3	E70 S141 L196	E70-V144 WeakPolarHBondContact OE2-CA 3.24Å; E70-V144 WeakPolarHBondContact OE2-CG1 3.26Å; S141-V144 PolarHBondContact O-N 3.04Å; V144-L196 HydrophobicContact CB-CD2 4.3Å; V144-L196 HydrophobicContact CG1-CD2 4.03Å; V144-L196 HydrophobicContact CG2-CD2 3.8Å
145	K	55.1	Low	48.5	Very low	102 Å²	102	86.3 Å²	86.3	44%	0.443	50%	0.501	S	S	.	.			trans	-88.7	-16.4	-169.7	-68.2	175.2	-172.3	169.5	0	112.8	E70 D74 H143 G147	E70-K145 PolarHBondContact OE1-N 2.86Å; E70-K145 PolarHBondContact OE2-N 3.47Å; E70-K145 VanDerWaalsContact OE2-N 3.1Å; D74-K145 VanDerWaalsContact CG-NZ 3.28Å; D74-K145 IonicContact OD1-NZ 3.97Å; D74-K145 PolarHBondContact OD1-NZ 3.33Å; D74-K145 VanDerWaalsContact OD2-CE 3.23Å; D74-K145 WeakPolarHBondContact OD2-CE 3.13Å; D74-K145 IonicContact OD2-NZ 3.75Å; D74-K145 PolarHBondContact OD2-NZ 2.78Å; D74-K145 VanDerWaalsContact OD2-NZ 3.13Å; H143-K145 PolarHBondContact O-N 3.46Å; K145-G147 PolarHBondContact O-N 3.37Å; K145-G147 VanDerWaalsContact O-N 3.17Å
146	S	50.3	Low	49	Very low	40 Å²	40	87.1 Å²	87.1	28%	0.28	50%	0.502	S	S	.	.			trans	-89.7	83.4	-176.2	70.6	0	0	0	0	113.7	Y66 E70 I153	Y66-S146 WeakPolarHBondContact CE1-OG 3.34Å; Y66-S146 VanDerWaalsContact CZ-OG 3.28Å; Y66-S146 WeakPolarHBondContact OH-CB 3.37Å; Y66-S146 PolarHBondContact OH-OG 2.93Å; Y66-S146 VanDerWaalsContact OH-OG 3.1Å; E70-S146 PolarHBondContact OE1-N 2.59Å; S146-I153 VanDerWaalsContact CB-CD1 3.48Å; S146-I153 WeakPolarHBondContact OG-CD1 3.41Å
147	G	48.4	Very low	49.7	Very low	75 Å²	75	82.6 Å²	82.6	77%	0.773	47%	0.471	S	S	*	.	S	Bend	trans	-84	-7.4	151.9	0	0	0	0	0	113.9	K145	K145-G147 PolarHBondContact O-N 3.37Å; K145-G147 VanDerWaalsContact O-N 3.17Å
148	L	41.3	Very low	50.4	Low	150 Å²	150	86.1 Å²	86.1	79%	0.785	47%	0.469	S	S	*	.	S	Bend	trans	-138.5	-4.4	-159.6	-116	110.9	0	0	0	120.3
149	F	45.2	Very low	50.9	Low	134 Å²	134	87.5 Å²	87.5	59%	0.588	48%	0.481	S	S	*	.			trans	-138.1	63.6	175.7	-84.9	-83	0	0	0	113.8	G151 Q152 I153	F149-G151 PolarHBondContact O-N 3.43Å; F149-Q152 PolarHBondContact O-N 2.63Å; F149-I153 WeakPolarHBondContact O-CD1 3.43Å; F149-I153 WeakPolarHBondContact O-CG1 3.26Å
150	M	49.8	Very low	51.1	Low	140 Å²	140	82.7 Å²	82.7	69%	0.69	46%	0.455	S	S	*	.	H	α-helix	trans	-54.7	-21.3	174.8	-157.1	157.6	70.6	0	0	113.7	K154	M150-K154 WeakPolarHBondContact O-CB 3.47Å; M150-K154 VanDerWaalsContact O-CG 3.24Å; M150-K154 WeakPolarHBondContact O-CG 3.4Å; M150-K154 PolarHBondContact O-N 2.72Å
151	G	45.9	Very low	51	Low	52 Å²	52	81 Å²	81	54%	0.536	44%	0.443	S	S	.	.	H	α-helix	trans	-77.4	-39.7	-179.4	0	0	0	0	0	115.5	F149 I153 K154 S155	F149-G151 PolarHBondContact O-N 3.43Å; G151-I153 VanDerWaalsContact C-N 3.34Å; G151-K154 PolarHBondContact O-N 3.17Å; G151-S155 PolarHBondContact O-N 2.9Å
152	Q	44.7	Very low	51.3	Low	132 Å²	132	83 Å²	83	62%	0.617	46%	0.457	S	S	*	.	H	α-helix	trans	-71.6	-36.6	177.8	-69.2	-179	-43.8	0	0	110.8	F149 S155 I156	F149-Q152 PolarHBondContact O-N 2.63Å; Q152-S155 WeakPolarHBondContact O-CB 3.28Å; Q152-S155 PolarHBondContact O-N 3.29Å; Q152-I156 PolarHBondContact O-N 3.34Å; Q152-I156 VanDerWaalsContact O-N 3.12Å
153	I	49.3	Very low	50.9	Low	34 Å²	34	84 Å²	84	17%	0.174	46%	0.463	C	S	.	.	H	α-helix	trans	-62.7	-46.1	174.8	-60.1	168.4	0	0	0	110.7	Y66 S146 F149 G151 S155 I156 W157	Y66-I153 HydrophobicContact CD2-CB 4.32Å; Y66-I153 HydrophobicContact CD2-CD1 4.33Å; Y66-I153 HydrophobicContact CD2-CG1 4.17Å; Y66-I153 HydrophobicContact CD2-CG2 3.33Å; Y66-I153 HydrophobicContact CE1-CD1 3.98Å; Y66-I153 HydrophobicContact CE2-CB 4.04Å; Y66-I153 HydrophobicContact CE2-CD1 3.54Å; Y66-I153 HydrophobicContact CE2-CG1 3.41Å; Y66-I153 VanDerWaalsContact CE2-CG1 3.41Å; Y66-I153 HydrophobicContact CE2-CG2 3.52Å; Y66-I153 HydrophobicContact CG-CG2 3.97Å; Y66-I153 VanDerWaalsContact OH-CD1 3.22Å; Y66-I153 WeakPolarHBondContact OH-CD1 3.44Å; S146-I153 VanDerWaalsContact CB-CD1 3.48Å; S146-I153 WeakPolarHBondContact OG-CD1 3.41Å; F149-I153 WeakPolarHBondContact O-CD1 3.43Å; F149-I153 WeakPolarHBondContact O-CG1 3.26Å; G151-I153 VanDerWaalsContact C-N 3.34Å; I153-S155 PolarHBondContact O-N 3.01Å; I153-I156 PolarHBondContact O-N 3.4Å; I153-W157 WeakPolarHBondContact O-CB 3.3Å; I153-W157 PolarHBondContact O-N 3.39Å
154	K	50.1	Low	50.7	Low	127 Å²	127	87.7 Å²	87.7	55%	0.552	50%	0.495	S	S	*	.	H	α-helix	trans	-58.3	-33.8	174.8	-82.4	177	-179.9	-174.8	0	112.8	M150 G151 R158	M150-K154 WeakPolarHBondContact O-CB 3.47Å; M150-K154 VanDerWaalsContact O-CG 3.24Å; M150-K154 WeakPolarHBondContact O-CG 3.4Å; M150-K154 PolarHBondContact O-N 2.72Å; G151-K154 PolarHBondContact O-N 3.17Å; K154-R158 WeakPolarHBondContact O-CB 3.26Å; K154-R158 PolarHBondContact O-N 2.96Å
155	S	46.3	Very low	50.3	Low	59 Å²	59	88.3 Å²	88.3	41%	0.413	50%	0.495	S	S	.	.	H	α-helix	trans	-73.3	-43.9	179.8	-164.5	0	0	0	0	112.3	G151 Q152 I153 R158 A159	G151-S155 PolarHBondContact O-N 2.9Å; Q152-S155 WeakPolarHBondContact O-CB 3.28Å; Q152-S155 PolarHBondContact O-N 3.29Å; I153-S155 PolarHBondContact O-N 3.01Å; S155-R158 PolarHBondContact O-N 2.82Å; S155-A159 PolarHBondContact O-N 3.46Å
156	I	54	Low	50.1	Low	84 Å²	84	89 Å²	89	43%	0.431	50%	0.504	S	S	.	.	H	α-helix	trans	-67.6	-44.7	175.3	-64.7	171.3	0	0	0	110	L107 Q152 I153 R158 A159 M160	L107-I156 HydrophobicContact CD1-CG2 4.09Å; L107-I156 HydrophobicContact CD2-CG2 4.36Å; Q152-I156 PolarHBondContact O-N 3.34Å; Q152-I156 VanDerWaalsContact O-N 3.12Å; I153-I156 PolarHBondContact O-N 3.4Å; I156-R158 VanDerWaalsContact C-N 3.34Å; I156-R158 PolarHBondContact O-N 3.42Å; I156-A159 WeakPolarHBondContact O-CB 3.27Å; I156-A159 PolarHBondContact O-N 3.33Å; I156-A159 VanDerWaalsContact O-N 3.12Å; I156-M160 HydrophobicContact CG2-CG 4.37Å; I156-M160 HydrophobicContact CG2-SD 3.73Å; I156-M160 WeakPolarHBondContact O-CB 3.06Å; I156-M160 VanDerWaalsContact O-CG 3.28Å; I156-M160 WeakPolarHBondContact O-CG 3.38Å; I156-M160 PolarHBondContact O-N 3.28Å
157	W	54.2	Low	50.1	Low	94 Å²	94	92 Å²	92	36%	0.356	51%	0.512	S	S	.	.	H	α-helix	trans	-55.1	-48.1	172.2	-177.8	-84.3	0	0	0	111.3	L64 I153 A159 M160 T161	L64-W157 HydrophobicContact CB-CH2 4.41Å; L64-W157 HydrophobicContact CB-CZ3 4.47Å; L64-W157 WeakPolarHBondContact O-CZ3 3.42Å; I153-W157 WeakPolarHBondContact O-CB 3.3Å; I153-W157 PolarHBondContact O-N 3.39Å; W157-A159 VanDerWaalsContact C-N 3.28Å; W157-A159 PolarHBondContact O-N 3.15Å; W157-M160 CarbonylContact O-C 3.4Å; W157-M160 WeakPolarHBondContact O-CA 3.5Å; W157-M160 PolarHBondContact O-N 2.74Å; W157-T161 HydrophobicContact CD2-CG2 4.39Å; W157-T161 HydrophobicContact CG-CG2 4.36Å; W157-T161 HydrophobicContact CZ2-CG2 4.29Å; W157-T161 WeakPolarHBondContact O-CG2 3.05Å; W157-T161 PolarHBondContact O-N 3.09Å; W157-T161 PolarHBondContact O-OG1 2.81Å
158	R	55.3	Low	50.3	Low	173 Å²	173	92.4 Å²	92.4	65%	0.653	49%	0.494	S	S	*	.	H	α-helix	trans	-64	-31.2	178.1	-168.6	177.9	68.7	-144.6	-1.8	112.9	K154 S155 I156 T161 S162	K154-R158 WeakPolarHBondContact O-CB 3.26Å; K154-R158 PolarHBondContact O-N 2.96Å; S155-R158 PolarHBondContact O-N 2.82Å; I156-R158 VanDerWaalsContact C-N 3.34Å; I156-R158 PolarHBondContact O-N 3.42Å; R158-T161 WeakPolarHBondContact CA-OG1 3.29Å; R158-S162 PolarHBondContact O-N 3.21Å
159	A	55.8	Low	51	Low	68 Å²	68	85.7 Å²	85.7	56%	0.562	46%	0.461	S	S	*	.	H	α-helix	trans	-72	-36.2	172.3	0	0	0	0	0	111.9	S155 I156 W157 S162	S155-A159 PolarHBondContact O-N 3.46Å; I156-A159 WeakPolarHBondContact O-CB 3.27Å; I156-A159 PolarHBondContact O-N 3.33Å; I156-A159 VanDerWaalsContact O-N 3.12Å; W157-A159 VanDerWaalsContact C-N 3.28Å; W157-A159 PolarHBondContact O-N 3.15Å; A159-S162 WeakPolarHBondContact O-CB 3.39Å; A159-S162 PolarHBondContact O-N 3.09Å
160	M	52.3	Low	51.7	Low	25 Å²	25	80.6 Å²	80.6	12%	0.123	44%	0.439	C	S	.	.	H	α-helix	trans	-81.5	-14.6	176.8	-64.8	173.9	67	0	0	113.9	F63 L64 L107 I156 W157 F165	F63-M160 WeakPolarHBondContact O-CE 3.47Å; L64-M160 HydrophobicContact CD2-CB 3.68Å; L64-M160 HydrophobicContact CD2-CE 3.77Å; L64-M160 VanDerWaalsContact CD2-O 3.31Å; L64-M160 WeakPolarHBondContact CD2-O 3.36Å; L107-M160 HydrophobicContact CD2-CE 3.92Å; L107-M160 HydrophobicContact CD2-SD 3.48Å; L107-M160 WeakPolarHBondContact CD2-SD 3.41Å; I156-M160 HydrophobicContact CG2-CG 4.37Å; I156-M160 HydrophobicContact CG2-SD 3.73Å; I156-M160 WeakPolarHBondContact O-CB 3.06Å; I156-M160 VanDerWaalsContact O-CG 3.28Å; I156-M160 WeakPolarHBondContact O-CG 3.38Å; I156-M160 PolarHBondContact O-N 3.28Å; W157-M160 CarbonylContact O-C 3.4Å; W157-M160 WeakPolarHBondContact O-CA 3.5Å; W157-M160 PolarHBondContact O-N 2.74Å; M160-F165 WeakPolarHBondContact O-CB 3.35Å; M160-F165 WeakPolarHBondContact O-CG 2.84Å
161	T	50.6	Low	52.2	Low	60 Å²	60	78 Å²	78	37%	0.368	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.5	15.4	168.9	64.6	0	0	0	0	111.7	W157 R158	W157-T161 HydrophobicContact CD2-CG2 4.39Å; W157-T161 HydrophobicContact CG-CG2 4.36Å; W157-T161 HydrophobicContact CZ2-CG2 4.29Å; W157-T161 WeakPolarHBondContact O-CG2 3.05Å; W157-T161 PolarHBondContact O-N 3.09Å; W157-T161 PolarHBondContact O-OG1 2.81Å; R158-T161 WeakPolarHBondContact CA-OG1 3.29Å
162	S	56.6	Low	53.1	Low	48 Å²	48	80.6 Å²	80.6	34%	0.336	43%	0.426	S	S	.	.	S	Bend	trans	-57.4	147.6	166.2	176.5	0	0	0	0	108.6	R158 A159 A164 F165	R158-S162 PolarHBondContact O-N 3.21Å; A159-S162 WeakPolarHBondContact O-CB 3.39Å; A159-S162 PolarHBondContact O-N 3.09Å; S162-A164 PolarHBondContact O-N 3.38Å; S162-F165 CarbonylContact O-C 3.59Å; S162-F165 PolarHBondContact O-N 2.93Å
163	P	49.5	Very low	54.7	Low	122 Å²	122	74.3 Å²	74.3	79%	0.792	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	-14.9	175.3	-25.5	33.4	0	0	0	114.8	F165	P163-F165 VanDerWaalsContact C-N 3.35Å
164	A	51.2	Low	56.3	Low	85 Å²	85	73.2 Å²	73.2	70%	0.702	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	-20	172.2	0	0	0	0	0	114.4	S162	S162-A164 PolarHBondContact O-N 3.38Å
165	F	50.7	Low	58.2	Low	50 Å²	50	67.1 Å²	67.1	22%	0.219	36%	0.364	C	S	.	.	S	Bend	trans	-107.2	76.8	168.7	-98.4	-102.5	0	0	0	107.4	L64 H100 P103 M160 S162 P163 F167	L64-F165 HydrophobicContact CD2-CD1 4.09Å; H100-F165 HydrophobicContact CB-CE1 4.11Å; H100-F165 AromaticContact CE1-CD1 3.57Å; H100-F165 AromaticContact CE1-CE1 3.83Å; H100-F165 AromaticContact CG-CE1 3.8Å; H100-F165 AromaticContact ND1-CD1 3.29Å; H100-F165 VanDerWaalsContact ND1-CD1 3.29Å; H100-F165 WeakPolarHBondContact ND1-CD1 3.47Å; H100-F165 AromaticContact ND1-CE1 3.05Å; H100-F165 WeakPolarHBondContact ND1-CE1 3.47Å; H100-F165 AromaticContact ND1-CG 4Å; H100-F165 AromaticContact ND1-CZ 3.58Å; P103-F165 HydrophobicContact CB-CE2 4.35Å; P103-F165 HydrophobicContact CB-CZ 3.72Å; P103-F165 HydrophobicContact CG-CZ 4.11Å; M160-F165 WeakPolarHBondContact O-CB 3.35Å; M160-F165 WeakPolarHBondContact O-CG 2.84Å; S162-F165 CarbonylContact O-C 3.59Å; S162-F165 PolarHBondContact O-N 2.93Å; P163-F165 VanDerWaalsContact C-N 3.35Å; F165-F167 PolarHBondContact O-N 3.23Å
166	D	51.4	Low	60.4	Low	118 Å²	118	64.5 Å²	64.5	63%	0.631	35%	0.346	S	S	*	.			trans	-56.9	123.2	176.2	-135.9	-1.4	0	0	0	108.2	Q168	D166-Q168 WeakPolarHBondContact O-CG 3.41Å; D166-Q168 PolarHBondContact O-N 3.04Å
167	F	49.3	Very low	62.4	Low	102 Å²	102	60.6 Å²	60.6	45%	0.447	33%	0.326	S	S	.	.			trans	-64.1	102.2	-166.1	-174.1	-96.6	0	0	0	110.9	L64 F165 G169 L171	L64-F167 HydrophobicContact CD1-CD2 3.35Å; L64-F167 HydrophobicContact CD1-CE2 3.57Å; L64-F167 HydrophobicContact CD1-CG 4.44Å; F165-F167 PolarHBondContact O-N 3.23Å; F167-G169 WeakPolarHBondContact CE1-O 3.16Å; F167-G169 WeakPolarHBondContact CZ-O 3.48Å; F167-L171 HydrophobicContact CE1-CG 4.38Å; F167-L171 HydrophobicContact CE2-CD2 4.1Å; F167-L171 HydrophobicContact CE2-CG 4.5Å; F167-L171 HydrophobicContact CZ-CD1 4.29Å; F167-L171 HydrophobicContact CZ-CD2 3.65Å; F167-L171 HydrophobicContact CZ-CG 3.64Å
168	Q	53.3	Low	64.4	Low	83 Å²	83	56.1 Å²	56.1	39%	0.388	31%	0.309	S	S	.	.			trans	-116.6	35.1	-175.7	-73.2	179.5	12.7	0	0	113.4	Q95 T97 D166	Q95-Q168 VanDerWaalsContact O-O 3.1Å; T97-Q168 PolarHBondContact OG1-OE1 2.92Å; D166-Q168 WeakPolarHBondContact O-CG 3.41Å; D166-Q168 PolarHBondContact O-N 3.04Å
169	G	55.2	Low	66.4	Low	9 Å²	9	47.9 Å²	47.9	9%	0.093	28%	0.278	C	S	.	.	S	Bend	trans	-132.5	148.5	177.1	0	0	0	0	0	111.3	F167	F167-G169 WeakPolarHBondContact CE1-O 3.16Å; F167-G169 WeakPolarHBondContact CZ-O 3.48Å
170	D	60.8	Low	68.3	Low	27 Å²	27	44.6 Å²	44.6	14%	0.144	25%	0.252	C	S	.	.			trans	-92.9	119.8	173.8	-179.4	-18.1	0	0	0	108.9	N62 R120 R130 H172 Q173	N62-D170 PolarHBondContact ND2-O 3.48Å; R120-D170 IonicContact CZ-OD2 2.68Å; R120-D170 IonicContact NH1-OD2 3.24Å; R120-D170 PolarHBondContact NH1-OD2 3.43Å; R120-D170 IonicContact NH2-OD2 3.06Å; R130-D170 WeakPolarHBondContact CD-OD2 3.2Å; R130-D170 IonicContact CZ-OD2 2.69Å; R130-D170 IonicContact NE-OD2 3.73Å; R130-D170 PolarHBondContact NE-OD2 3.34Å; R130-D170 IonicContact NH1-OD2 2.88Å; D170-H172 PolarHBondContact O-N 3.31Å; D170-H172 PolarHBondContact OD1-N 2.99Å; D170-Q173 HydrophobicContact CB-CB 4.02Å; D170-Q173 WeakPolarHBondContact O-CB 3.38Å; D170-Q173 PolarHBondContact O-N 2.85Å; D170-Q173 VanDerWaalsContact O-N 3.17Å
171	L	59.1	Low	70.4	Confident	85 Å²	85	43.4 Å²	43.4	45%	0.445	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-21.8	-178.1	-69.4	177.6	0	0	0	113	R61 F167	R61-L171 VanDerWaalsContact CZ-O 3.31Å; R61-L171 PolarHBondContact NH1-O 3.47Å; R61-L171 PolarHBondContact NH2-O 3.43Å; F167-L171 HydrophobicContact CE1-CG 4.38Å; F167-L171 HydrophobicContact CE2-CD2 4.1Å; F167-L171 HydrophobicContact CE2-CG 4.5Å; F167-L171 HydrophobicContact CZ-CD1 4.29Å; F167-L171 HydrophobicContact CZ-CD2 3.65Å; F167-L171 HydrophobicContact CZ-CG 3.64Å
172	H	64.9	Low	72.5	Confident	107 Å²	107	44.2 Å²	44.2	50%	0.495	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.1	-7.8	-179	-62	-66.9	0	0	0	112.8	R130 E131 D170 Q174	R130-H172 CarbonylContact C-O 3.51Å; R130-H172 VanDerWaalsContact CA-O 3.28Å; R130-H172 WeakPolarHBondContact CA-O 3.25Å; R130-H172 HydrophobicContact CB-CB 4.16Å; E131-H172 PolarHBondContact N-O 2.82Å; D170-H172 PolarHBondContact O-N 3.31Å; D170-H172 PolarHBondContact OD1-N 2.99Å; H172-Q174 PolarHBondContact O-N 2.79Å
173	Q	79	Confident	74.3	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	25%	0.25	C	S	.	.			trans	-60.9	127	-178.7	-173.1	59	61.7	0	0	111.4	R61 Y123 M128 D170	R61-Q173 WeakPolarHBondContact CB-O 3.49Å; R61-Q173 VanDerWaalsContact CG-O 3.3Å; R61-Q173 WeakPolarHBondContact CG-O 3.38Å; R61-Q173 PolarHBondContact NE-O 2.88Å; R61-Q173 PolarHBondContact NH2-O 3.31Å; Y123-Q173 HydrophobicContact CD1-CG 3.87Å; Y123-Q173 HydrophobicContact CE1-CG 4.18Å; M128-Q173 PolarHBondContact O-NE2 2.68Å; D170-Q173 HydrophobicContact CB-CB 4.02Å; D170-Q173 WeakPolarHBondContact O-CB 3.38Å; D170-Q173 PolarHBondContact O-N 2.85Å; D170-Q173 VanDerWaalsContact O-N 3.17Å
174	Q	83.5	Confident	76.3	Confident	11 Å²	11	40.1 Å²	40.1	5%	0.051	23%	0.231	C	C	.	.			trans	-69.5	145.3	172.3	-73	-179.5	-24.9	0	0	111.7	M128 K129 E131 H172 D192	M128-Q174 HydrophobicContact CB-CB 4.39Å; K129-Q174 HydrophobicContact CB-CG 4.44Å; K129-Q174 WeakPolarHBondContact O-CB 3.39Å; K129-Q174 WeakPolarHBondContact O-CG 3.18Å; K129-Q174 PolarHBondContact O-N 3.46Å; E131-Q174 PolarHBondContact O-NE2 3.45Å; H172-Q174 PolarHBondContact O-N 2.79Å; Q174-D192 VanDerWaalsContact CG-O 3.32Å; Q174-D192 WeakPolarHBondContact CG-O 3.34Å
175	G	88.9	Confident	78.3	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.222	C	C	.	.			trans	-94	-171.2	167.4	0	0	0	0	0	110.4	F59 D192	F59-G175 CarbonylContact O-C 3.42Å; F59-G175 WeakPolarHBondContact O-CA 3.22Å; G175-D192 WeakPolarHBondContact CA-OD2 3.13Å; G175-D192 PolarHBondContact O-N 3.06Å
176	G	93.1	Very high	80.4	Confident	3 Å²	3	41.1 Å²	41.1	3%	0.031	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	170.4	-177.7	173.3	0	0	0	0	0	113.5	F59 H190 D192	F59-G176 PolarHBondContact N-O 2.87Å; F59-G176 PolarHBondContact O-N 3.32Å; G176-H190 CarbonylContact C-O 3.36Å; G176-H190 WeakPolarHBondContact CA-O 3.23Å; G176-D192 PolarHBondContact N-OD2 2.71Å
177	A	95.5	Very high	82.4	Confident	2 Å²	2	39.2 Å²	39.2	2%	0.017	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	136.3	176.9	0	0	0	0	0	110.3	I57 I58 C189 H190 M199 L204	I57-A177 CarbonylContact O-C 3.55Å; I57-A177 WeakPolarHBondContact O-CA 3.35Å; I58-A177 HydrophobicContact CD1-CB 3.79Å; A177-C189 CarbonylContact O-C 3.47Å; A177-C189 WeakPolarHBondContact O-CA 3.02Å; A177-H190 PolarHBondContact N-O 2.7Å; A177-H190 PolarHBondContact O-N 2.9Å; A177-M199 HydrophobicContact CB-CB 4.48Å; A177-L204 HydrophobicContact CB-CD1 3.84Å; A177-L204 HydrophobicContact CB-CD2 3.76Å; A177-L204 HydrophobicContact CB-CG 4.46Å
178	I	96.1	Very high	84.5	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	135.9	174.7	-59.6	-175.2	0	0	0	108.4	I26 I57 F59 L126 A180 V186 F188 C189 F191	I26-I178 HydrophobicContact CD1-CD1 4.48Å; I57-I178 PolarHBondContact N-O 2.79Å; I57-I178 PolarHBondContact O-N 3.32Å; F59-I178 HydrophobicContact CE2-CB 4.48Å; F59-I178 HydrophobicContact CE2-CD1 3.8Å; F59-I178 HydrophobicContact CE2-CG1 4.02Å; F59-I178 HydrophobicContact CZ-CD1 4.47Å; L126-I178 HydrophobicContact CD1-CD1 3.71Å; I178-A180 HydrophobicContact CG2-CB 4.11Å; I178-V186 HydrophobicContact CG2-CG1 4.35Å; I178-F188 WeakPolarHBondContact CA-O 3.43Å; I178-C189 HydrophobicContact CG1-CB 4.3Å; I178-F191 HydrophobicContact CD1-CE1 4.31Å
179	I	96.8	Very high	86.4	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	114.4	166.5	-53.8	177.6	0	0	0	107	K54 S55 V56 H187 F188 L204 L207 A208	K54-I179 HydrophobicContact CD-CG2 3.87Å; K54-I179 HydrophobicContact CG-CG2 3.94Å; S55-I179 WeakPolarHBondContact O-CA 3.3Å; V56-I179 HydrophobicContact CG2-CG1 4.3Å; I179-H187 HydrophobicContact CB-CB 4.23Å; I179-H187 HydrophobicContact CG2-CB 4.01Å; I179-H187 PolarHBondContact O-N 2.6Å; I179-F188 HydrophobicContact CB-CB 3.94Å; I179-F188 HydrophobicContact CD1-CB 3.85Å; I179-F188 HydrophobicContact CD1-CD1 4.26Å; I179-F188 HydrophobicContact CD1-CG 4.35Å; I179-F188 HydrophobicContact CG1-CB 3.92Å; I179-F188 HydrophobicContact CG1-CD1 4.29Å; I179-F188 PolarHBondContact N-O 3.13Å; I179-F188 PolarHBondContact O-N 3.22Å; I179-L204 HydrophobicContact CD1-CD2 4.28Å; I179-L204 WeakPolarHBondContact CD1-O 3.13Å; I179-L204 HydrophobicContact CG1-CD2 4.45Å; I179-L207 HydrophobicContact CD1-CB 3.57Å; I179-L207 HydrophobicContact CD1-CD1 4.3Å; I179-A208 HydrophobicContact CD1-CB 4.21Å; I179-A208 HydrophobicContact CG2-CB 4.26Å
180	A	96.8	Very high	88.2	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	160.3	-176.4	0	0	0	0	0	111.6	L28 Y50 K54 S55 I178 Q185	L28-A180 HydrophobicContact CD1-CB 3.61Å; Y50-A180 HydrophobicContact CD1-CB 4.3Å; Y50-A180 HydrophobicContact CG-CB 4.03Å; K54-A180 CarbonylContact C-O 3.52Å; K54-A180 WeakPolarHBondContact CA-O 3.43Å; S55-A180 PolarHBondContact N-O 2.86Å; S55-A180 PolarHBondContact O-N 3.4Å; I178-A180 HydrophobicContact CG2-CB 4.11Å; A180-Q185 CarbonylContact C-O 3.5Å; A180-Q185 WeakPolarHBondContact CA-O 3.31Å
181	G	95.3	Very high	89.6	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.186	C	C	.	.			trans	92.7	165	173	0	0	0	0	0	115.4	Y50 G183 Q185 H187	Y50-G181 WeakPolarHBondContact O-CA 3.13Å; G181-G183 WeakPolarHBondContact CA-O 2.92Å; G181-Q185 PolarHBondContact N-O 3.07Å; G181-H187 PolarHBondContact O-CD2 3.25Å; G181-H187 PolarHBondContact O-NE2 3.07Å
182	P	95.8	Very high	90.8	Very high	77 Å²	77	29.9 Å²	29.9	50%	0.5	17%	0.166	S	C	.	.	S	Bend	cis	-62.7	150.1	-9.2	-21.3	34.2	0	0	0	113	Y50	Y50-P182 CarbonylContact O-C 3.6Å; Y50-P182 WeakPolarHBondContact O-CA 3.45Å
183	G	93.6	Very high	91.5	Very high	29 Å²	29	28.9 Å²	28.9	30%	0.299	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.9	-168.6	-171.7	0	0	0	0	0	113.7	Y50 Q51 G181 Q185	Y50-G183 VanDerWaalsContact CD2-O 3.23Å; Y50-G183 WeakPolarHBondContact CD2-O 3.48Å; Y50-G183 PolarHBondContact O-N 3.04Å; Q51-G183 PolarHBondContact O-N 2.93Å; G181-G183 WeakPolarHBondContact CA-O 2.92Å; G183-Q185 PolarHBondContact O-N 2.99Å
184	S	92.5	Very high	91.3	Very high	54 Å²	54	29.6 Å²	29.6	38%	0.378	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	20.1	-174.7	-38.4	0	0	0	0	114.2	E32	E32-S184 WeakPolarHBondContact OE1-CB 3.26Å; E32-S184 PolarHBondContact OE1-OG 2.9Å
185	Q	93.1	Very high	90.7	Very high	112 Å²	112	34 Å²	34	52%	0.523	18%	0.182	S	C	.	.			trans	-74.9	127	177.6	-175.8	176.9	15	0	0	110.5	A180 G181 G183 H187	A180-Q185 CarbonylContact C-O 3.5Å; A180-Q185 WeakPolarHBondContact CA-O 3.31Å; G181-Q185 PolarHBondContact N-O 3.07Å; G183-Q185 PolarHBondContact O-N 2.99Å; Q185-H187 PolarHBondContact OE1-CE1 2.81Å
186	V	94.7	Very high	90.1	Very high	45 Å²	45	36.4 Å²	36.4	27%	0.273	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	122.5	172.1	-179.4	0	0	0	0	109.1	I26 L28 I178	I26-V186 WeakPolarHBondContact O-CG2 3.22Å; L28-V186 HydrophobicContact CD1-CG2 3.7Å; L28-V186 HydrophobicContact CD2-CG2 4.28Å; L28-V186 HydrophobicContact CG-CG2 3.63Å; I178-V186 HydrophobicContact CG2-CG1 4.35Å
187	H	93.3	Very high	89.4	Confident	78 Å²	78	37.5 Å²	37.5	36%	0.361	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	-29	176.2	-61.1	-86.6	0	0	0	112.1	I179 G181 Q185	I179-H187 HydrophobicContact CB-CB 4.23Å; I179-H187 HydrophobicContact CG2-CB 4.01Å; I179-H187 PolarHBondContact O-N 2.6Å; G181-H187 PolarHBondContact O-CD2 3.25Å; G181-H187 PolarHBondContact O-NE2 3.07Å; Q185-H187 PolarHBondContact OE1-CE1 2.81Å
188	F	94.3	Very high	88.9	Confident	31 Å²	31	38 Å²	38	14%	0.136	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159	147.4	-179	-179.4	-104.1	0	0	0	111.1	I178 I179 H190 M199 W203 L204 L207	I178-F188 WeakPolarHBondContact CA-O 3.43Å; I179-F188 HydrophobicContact CB-CB 3.94Å; I179-F188 HydrophobicContact CD1-CB 3.85Å; I179-F188 HydrophobicContact CD1-CD1 4.26Å; I179-F188 HydrophobicContact CD1-CG 4.35Å; I179-F188 HydrophobicContact CG1-CB 3.92Å; I179-F188 HydrophobicContact CG1-CD1 4.29Å; I179-F188 PolarHBondContact N-O 3.13Å; I179-F188 PolarHBondContact O-N 3.22Å; F188-H190 HydrophobicContact CE1-CB 3.67Å; F188-H190 HydrophobicContact CZ-CB 3.74Å; F188-M199 HydrophobicContact CE1-CE 4.13Å; F188-M199 HydrophobicContact CE1-CG 4.19Å; F188-M199 HydrophobicContact CZ-CE 3.63Å; F188-M199 HydrophobicContact CZ-CG 4.48Å; F188-M199 HydrophobicContact CZ-SD 4.24Å; F188-W203 HydrophobicContact CD2-CZ3 4.16Å; F188-W203 HydrophobicContact CE1-CZ3 4.42Å; F188-W203 HydrophobicContact CE2-CH2 4.12Å; F188-W203 AromaticContact CE2-CZ3 3.49Å; F188-W203 HydrophobicContact CE2-CZ3 3.49Å; F188-W203 VanDerWaalsContact CE2-CZ3 3.49Å; F188-W203 HydrophobicContact CZ-CE3 4.36Å; F188-W203 AromaticContact CZ-CZ3 3.64Å; F188-W203 HydrophobicContact CZ-CZ3 3.64Å; F188-L204 HydrophobicContact CD1-CD2 3.93Å; F188-L204 HydrophobicContact CE1-CD2 3.88Å; F188-L207 HydrophobicContact CB-CD1 4.12Å; F188-L207 HydrophobicContact CD1-CD1 4.14Å; F188-L207 HydrophobicContact CD2-CD1 3.6Å; F188-L207 HydrophobicContact CE2-CD1 4.06Å; F188-L207 HydrophobicContact CG-CD1 3.65Å; F188-L207 HydrophobicContact CZ-CD1 4.49Å
189	C	93.1	Very high	88.5	Confident	27 Å²	27	38.3 Å²	38.3	18%	0.182	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	143.9	164.1	-177.9	0	0	0	0	111.8	I26 A177 I178 F191	I26-C189 HydrophobicContact CD1-CB 3.51Å; I26-C189 WeakPolarHBondContact CD1-SG 3.43Å; A177-C189 CarbonylContact O-C 3.47Å; A177-C189 WeakPolarHBondContact O-CA 3.02Å; I178-C189 HydrophobicContact CG1-CB 4.3Å; C189-F191 WeakPolarHBondContact SG-CE1 3.4Å
190	H	91.4	Very high	88.1	Confident	16 Å²	16	39.4 Å²	39.4	7%	0.074	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	131.8	167.1	178.3	77.7	0	0	0	109.9	G176 A177 F188 D192 D197 M199	G176-H190 CarbonylContact C-O 3.36Å; G176-H190 WeakPolarHBondContact CA-O 3.23Å; A177-H190 PolarHBondContact N-O 2.7Å; A177-H190 PolarHBondContact O-N 2.9Å; F188-H190 HydrophobicContact CE1-CB 3.67Å; F188-H190 HydrophobicContact CZ-CB 3.74Å; H190-D192 IonicContact CD2-OD1 2.82Å; H190-D192 PolarHBondContact CD2-OD1 3.06Å; H190-D192 VanDerWaalsContact CD2-OD1 3.29Å; H190-D192 IonicContact NE2-OD1 2.78Å; H190-D197 IonicContact CE1-OD1 3.85Å; H190-D197 IonicContact CE1-OD2 2.74Å; H190-D197 PolarHBondContact CE1-OD2 3.37Å; H190-D197 PolarHBondContact NE2-O 2.9Å; H190-D197 IonicContact NE2-OD1 3.39Å; H190-D197 IonicContact NE2-OD2 3.5Å; H190-D197 PolarHBondContact NE2-OD2 3.17Å; H190-M199 HydrophobicContact CB-CE 3.62Å; H190-M199 WeakPolarHBondContact ND1-CE 3.49Å
191	F	90.3	Very high	87.8	Confident	33 Å²	33	39.5 Å²	39.5	15%	0.145	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	126.5	169.3	-62.7	-32.4	0	0	0	108.6	I26 L126 M128 I178 C189 M193	I26-F191 HydrophobicContact CD1-CE1 3.95Å; I26-F191 HydrophobicContact CD1-CE2 3.76Å; I26-F191 HydrophobicContact CD1-CZ 3.25Å; I26-F191 HydrophobicContact CG1-CE2 4.49Å; I26-F191 HydrophobicContact CG1-CZ 4.25Å; L126-F191 HydrophobicContact CB-CZ 4.01Å; L126-F191 VanDerWaalsContact O-CE2 3.23Å; L126-F191 WeakPolarHBondContact O-CE2 3.3Å; L126-F191 WeakPolarHBondContact O-CZ 3.14Å; M128-F191 HydrophobicContact CE-CD1 3.64Å; M128-F191 HydrophobicContact CE-CE1 3.25Å; M128-F191 HydrophobicContact CE-CZ 4.14Å; M128-F191 HydrophobicContact CG-CD1 3.91Å; M128-F191 HydrophobicContact CG-CE1 3.87Å; M128-F191 HydrophobicContact CG-CE2 4.49Å; M128-F191 HydrophobicContact CG-CG 4.26Å; M128-F191 HydrophobicContact CG-CZ 4.14Å; M128-F191 HydrophobicContact SD-CD1 4.49Å; M128-F191 HydrophobicContact SD-CE1 4.41Å; I178-F191 HydrophobicContact CD1-CE1 4.31Å; C189-F191 WeakPolarHBondContact SG-CE1 3.4Å; F191-M193 PolarHBondContact O-N 3.08Å
192	D	84.6	Confident	87.5	Confident	3 Å²	3	42.3 Å²	42.3	2%	0.016	23%	0.228	C	C	.	.			trans	-66.2	124.3	-172.7	-59.5	-18.3	0	0	0	109.7	Q174 G175 G176 H190 N194 D197 H198	Q174-D192 VanDerWaalsContact CG-O 3.32Å; Q174-D192 WeakPolarHBondContact CG-O 3.34Å; G175-D192 WeakPolarHBondContact CA-OD2 3.13Å; G175-D192 PolarHBondContact O-N 3.06Å; G176-D192 PolarHBondContact N-OD2 2.71Å; H190-D192 IonicContact CD2-OD1 2.82Å; H190-D192 PolarHBondContact CD2-OD1 3.06Å; H190-D192 VanDerWaalsContact CD2-OD1 3.29Å; H190-D192 IonicContact NE2-OD1 2.78Å; D192-N194 VanDerWaalsContact C-N 3.28Å; D192-N194 PolarHBondContact O-N 2.75Å; D192-D197 HydrophobicContact CB-CB 4.38Å; D192-D197 VanDerWaalsContact OD1-O 3.12Å; D192-H198 IonicContact OD1-ND1 3.51Å; D192-H198 IonicContact OD2-CE1 3.44Å; D192-H198 PolarHBondContact OD2-CE1 2.56Å; D192-H198 VanDerWaalsContact OD2-CE1 3.25Å; D192-H198 IonicContact OD2-CG 3.29Å; D192-H198 IonicContact OD2-ND1 3.05Å; D192-H198 PolarHBondContact OD2-ND1 3.35Å
193	M	79.3	Confident	87.1	Confident	86 Å²	86	43.2 Å²	43.2	42%	0.424	22%	0.222	S	C	.	.	S	Bend	trans	-71.6	-26.3	177.6	-67.2	-61	-74.4	0	0	112.8	T133 F191 D197	T133-M193 HydrophobicContact CG2-CE 4.27Å; T133-M193 PolarHBondContact N-O 2.85Å; T133-M193 WeakPolarHBondContact OG1-CE 3.28Å; T133-M193 PolarHBondContact OG1-O 2.8Å; F191-M193 PolarHBondContact O-N 3.08Å; M193-D197 HydrophobicContact CB-CB 4.43Å; M193-D197 WeakPolarHBondContact CB-OD2 3.49Å; M193-D197 WeakPolarHBondContact CG-OD2 3.48Å; M193-D197 PolarHBondContact N-OD2 2.8Å
194	N	75.1	Confident	87.1	Confident	14 Å²	14	41.9 Å²	41.9	8%	0.075	21%	0.208	C	C	.	.	S	Bend	trans	-158.1	176.5	174.4	64.8	67.4	0	0	0	110.3	D192 L196 D197	D192-N194 VanDerWaalsContact C-N 3.28Å; D192-N194 PolarHBondContact O-N 2.75Å; N194-L196 PolarHBondContact O-N 3.4Å; N194-L196 WeakPolarHBondContact OD1-CA 2.84Å; N194-L196 WeakPolarHBondContact OD1-CB 2.93Å; N194-L196 PolarHBondContact OD1-N 3.1Å; N194-D197 WeakPolarHBondContact O-CB 3.24Å; N194-D197 PolarHBondContact O-N 3.23Å; N194-D197 PolarHBondContact OD1-N 3.1Å
195	R	71.8	Confident	87	Confident	103 Å²	103	39.6 Å²	39.6	39%	0.389	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-14.9	-176.9	73.1	-175.4	171.8	-95.3	-1.3	116	S67 E132 H198	S67-R195 WeakPolarHBondContact CB-O 3.34Å; S67-R195 PolarHBondContact OG-O 2.89Å; E132-R195 IonicContact OE1-NH1 3.79Å; E132-R195 IonicContact OE2-NH1 3.22Å; E132-R195 PolarHBondContact OE2-NH1 3.39Å; R195-H198 PolarHBondContact O-NE2 3.26Å
196	L	75.9	Confident	86.9	Confident	52 Å²	52	40.9 Å²	40.9	27%	0.272	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.5	6.4	-179.5	-53.7	-179.7	0	0	0	112.2	S141 V144 N194	S141-L196 WeakPolarHBondContact CA-O 3.5Å; S141-L196 WeakPolarHBondContact CB-O 3.16Å; S141-L196 PolarHBondContact N-O 3.27Å; S141-L196 VanDerWaalsContact N-O 3.07Å; V144-L196 HydrophobicContact CB-CD2 4.3Å; V144-L196 HydrophobicContact CG1-CD2 4.03Å; V144-L196 HydrophobicContact CG2-CD2 3.8Å; N194-L196 PolarHBondContact O-N 3.4Å; N194-L196 WeakPolarHBondContact OD1-CA 2.84Å; N194-L196 WeakPolarHBondContact OD1-CB 2.93Å; N194-L196 PolarHBondContact OD1-N 3.1Å
197	D	79.4	Confident	86.7	Confident	26 Å²	26	42 Å²	42	14%	0.139	20%	0.202	C	C	.	.			trans	-99.8	27.9	-177.4	-169.3	37.2	0	0	0	112.3	H190 D192 M193 N194 M199	H190-D197 IonicContact CE1-OD1 3.85Å; H190-D197 IonicContact CE1-OD2 2.74Å; H190-D197 PolarHBondContact CE1-OD2 3.37Å; H190-D197 PolarHBondContact NE2-O 2.9Å; H190-D197 IonicContact NE2-OD1 3.39Å; H190-D197 IonicContact NE2-OD2 3.5Å; H190-D197 PolarHBondContact NE2-OD2 3.17Å; D192-D197 HydrophobicContact CB-CB 4.38Å; D192-D197 VanDerWaalsContact OD1-O 3.12Å; M193-D197 HydrophobicContact CB-CB 4.43Å; M193-D197 WeakPolarHBondContact CB-OD2 3.49Å; M193-D197 WeakPolarHBondContact CG-OD2 3.48Å; M193-D197 PolarHBondContact N-OD2 2.8Å; N194-D197 WeakPolarHBondContact O-CB 3.24Å; N194-D197 PolarHBondContact O-N 3.23Å; N194-D197 PolarHBondContact OD1-N 3.1Å; D197-M199 PolarHBondContact O-N 2.98Å
198	H	84	Confident	86.6	Confident	11 Å²	11	38.4 Å²	38.4	5%	0.051	19%	0.185	C	C	.	.	P	Polyproline II helix	trans	-64.3	128.7	174.7	-64.3	-46	0	0	0	110.6	C68 Y71 D192 R195	C68-H198 VanDerWaalsContact SG-CE1 3.57Å; Y71-H198 HydrophobicContact CD2-CB 3.65Å; Y71-H198 HydrophobicContact CE2-CB 3.66Å; Y71-H198 HydrophobicContact CG-CB 4.1Å; Y71-H198 AromaticContact CG-CD2 3.98Å; D192-H198 IonicContact OD1-ND1 3.51Å; D192-H198 IonicContact OD2-CE1 3.44Å; D192-H198 PolarHBondContact OD2-CE1 2.56Å; D192-H198 VanDerWaalsContact OD2-CE1 3.25Å; D192-H198 IonicContact OD2-CG 3.29Å; D192-H198 IonicContact OD2-ND1 3.05Å; D192-H198 PolarHBondContact OD2-ND1 3.35Å; R195-H198 PolarHBondContact O-NE2 3.26Å
199	M	87.3	Confident	86.3	Confident	7 Å²	7	38.8 Å²	38.8	3%	0.034	20%	0.198	C	C	.	.	P	Polyproline II helix	trans	-57.3	135.2	176.1	-174.2	59.2	52.5	0	0	111.2	Y71 A177 F188 H190 D197 I201 W203 L204	Y71-M199 VanDerWaalsContact CE2-O 3.26Å; Y71-M199 WeakPolarHBondContact CE2-O 3.4Å; Y71-M199 PolarHBondContact OH-O 3.16Å; A177-M199 HydrophobicContact CB-CB 4.48Å; F188-M199 HydrophobicContact CE1-CE 4.13Å; F188-M199 HydrophobicContact CE1-CG 4.19Å; F188-M199 HydrophobicContact CZ-CE 3.63Å; F188-M199 HydrophobicContact CZ-CG 4.48Å; F188-M199 HydrophobicContact CZ-SD 4.24Å; H190-M199 HydrophobicContact CB-CE 3.62Å; H190-M199 WeakPolarHBondContact ND1-CE 3.49Å; D197-M199 PolarHBondContact O-N 2.98Å; M199-I201 PolarHBondContact O-N 3.08Å; M199-W203 HydrophobicContact CG-CE3 4.28Å; M199-W203 HydrophobicContact SD-CD2 4.33Å; M199-W203 HydrophobicContact SD-CE3 3.48Å; M199-W203 HydrophobicContact SD-CZ3 3.95Å; M199-L204 HydrophobicContact CB-CD1 4.2Å; M199-L204 HydrophobicContact CB-CD2 4.19Å; M199-L204 HydrophobicContact CB-CG 4.15Å; M199-L204 HydrophobicContact CG-CD1 4.26Å; M199-L204 HydrophobicContact CG-CD2 3.61Å; M199-L204 HydrophobicContact CG-CG 3.66Å
200	P	88.8	Confident	86	Confident	24 Å²	24	38 Å²	38	16%	0.156	19%	0.193	C	C	.	.	P	Polyproline II helix	trans	-59.8	132.7	179.3	-27.4	36.5	0	0	0	113.7	H143 T202 W203 L204	H143-P200 VanDerWaalsContact CE1-CA 3.47Å; H143-P200 WeakPolarHBondContact CE1-CA 3.42Å; P200-T202 VanDerWaalsContact C-N 3.32Å; P200-T202 PolarHBondContact O-N 2.9Å; P200-W203 HydrophobicContact CB-CB 4.2Å; P200-W203 WeakPolarHBondContact O-CB 3.22Å; P200-W203 PolarHBondContact O-N 2.82Å; P200-L204 PolarHBondContact O-N 3.28Å; P200-L204 VanDerWaalsContact O-N 3.08Å
201	I	91.1	Very high	85.1	Confident	1 Å²	1	46.5 Å²	46.5	1%	0.005	23%	0.232	C	C	.	.	H	α-helix	trans	-60.6	-42.7	-175.2	-61.5	171.1	0	0	0	110.9	Y71 D74 L75 V78 M199 W203 L204 L205 F216	Y71-I201 HydrophobicContact CD2-CD1 4.35Å; Y71-I201 HydrophobicContact CD2-CG1 4.32Å; Y71-I201 HydrophobicContact CE2-CD1 4.09Å; Y71-I201 HydrophobicContact CE2-CG1 3.57Å; D74-I201 HydrophobicContact CB-CD1 3.6Å; L75-I201 HydrophobicContact CB-CD1 4.42Å; L75-I201 HydrophobicContact CD2-CB 4.39Å; L75-I201 HydrophobicContact CD2-CD1 3.73Å; L75-I201 HydrophobicContact CD2-CG1 3.7Å; L75-I201 HydrophobicContact CD2-CG2 3.86Å; L75-I201 HydrophobicContact CG-CD1 3.74Å; L75-I201 HydrophobicContact CG-CG1 4.18Å; V78-I201 HydrophobicContact CG2-CG2 3.93Å; M199-I201 PolarHBondContact O-N 3.08Å; I201-W203 PolarHBondContact O-N 3.44Å; I201-L204 PolarHBondContact O-N 3.17Å; I201-L205 HydrophobicContact CG2-CD1 3.75Å; I201-L205 HydrophobicContact CG2-CG 4.21Å; I201-L205 VanDerWaalsContact O-CG 3.28Å; I201-L205 WeakPolarHBondContact O-CG 3.44Å; I201-L205 PolarHBondContact O-N 3.33Å; I201-F216 HydrophobicContact CB-CE2 4.16Å; I201-F216 HydrophobicContact CB-CZ 4.02Å; I201-F216 HydrophobicContact CD1-CE1 4.37Å; I201-F216 HydrophobicContact CG2-CE1 4.18Å; I201-F216 HydrophobicContact CG2-CE2 3.96Å; I201-F216 HydrophobicContact CG2-CZ 3.49Å; I201-F216 VanDerWaalsContact CG2-CZ 3.49Å
202	T	87.4	Confident	83.9	Confident	59 Å²	59	48.9 Å²	48.9	36%	0.362	24%	0.244	S	C	.	.	H	α-helix	trans	-53.8	-41.5	175.4	48.6	0	0	0	0	112.3	P200 Q206 L214 F216	P200-T202 VanDerWaalsContact C-N 3.32Å; P200-T202 PolarHBondContact O-N 2.9Å; T202-Q206 WeakPolarHBondContact O-CB 3.47Å; T202-Q206 PolarHBondContact O-N 3.14Å; T202-L214 VanDerWaalsContact CG2-O 3.23Å; T202-L214 WeakPolarHBondContact CG2-O 3.16Å; T202-F216 HydrophobicContact CG2-CD2 3.33Å; T202-F216 HydrophobicContact CG2-CE2 3.48Å; T202-F216 VanDerWaalsContact CG2-CE2 3.48Å
203	W	89.3	Confident	82.6	Confident	96 Å²	96	54.6 Å²	54.6	36%	0.364	28%	0.284	S	S	.	.	H	α-helix	trans	-73.1	-41.9	-176.3	-151.5	74.4	0	0	0	111.3	F188 M199 P200 I201 L205 Q206 L207	F188-W203 HydrophobicContact CD2-CZ3 4.16Å; F188-W203 HydrophobicContact CE1-CZ3 4.42Å; F188-W203 HydrophobicContact CE2-CH2 4.12Å; F188-W203 AromaticContact CE2-CZ3 3.49Å; F188-W203 HydrophobicContact CE2-CZ3 3.49Å; F188-W203 VanDerWaalsContact CE2-CZ3 3.49Å; F188-W203 HydrophobicContact CZ-CE3 4.36Å; F188-W203 AromaticContact CZ-CZ3 3.64Å; F188-W203 HydrophobicContact CZ-CZ3 3.64Å; M199-W203 HydrophobicContact CG-CE3 4.28Å; M199-W203 HydrophobicContact SD-CD2 4.33Å; M199-W203 HydrophobicContact SD-CE3 3.48Å; M199-W203 HydrophobicContact SD-CZ3 3.95Å; P200-W203 HydrophobicContact CB-CB 4.2Å; P200-W203 WeakPolarHBondContact O-CB 3.22Å; P200-W203 PolarHBondContact O-N 2.82Å; I201-W203 PolarHBondContact O-N 3.44Å; W203-L205 VanDerWaalsContact C-N 3.35Å; W203-L205 PolarHBondContact O-N 3.12Å; W203-Q206 PolarHBondContact O-N 3.42Å; W203-L207 HydrophobicContact CD2-CD1 4.11Å; W203-L207 HydrophobicContact CD2-CG 4.28Å; W203-L207 HydrophobicContact CE3-CD1 3.39Å; W203-L207 HydrophobicContact CE3-CG 4.04Å; W203-L207 HydrophobicContact CH2-CD1 3.7Å; W203-L207 HydrophobicContact CH2-CD2 4.4Å; W203-L207 HydrophobicContact CH2-CG 4.36Å; W203-L207 HydrophobicContact CZ2-CD1 4.34Å; W203-L207 HydrophobicContact CZ2-CD2 4.46Å; W203-L207 HydrophobicContact CZ3-CD1 3.19Å; W203-L207 HydrophobicContact CZ3-CG 4.13Å; W203-L207 WeakPolarHBondContact O-CB 3.12Å; W203-L207 WeakPolarHBondContact O-CG 3.45Å; W203-L207 PolarHBondContact O-N 2.88Å
204	L	92	Very high	81.8	Confident	1 Å²	1	52.2 Å²	52.2	1%	0.005	27%	0.273	C	S	.	.	H	α-helix	trans	-58.8	-45.7	172.8	-70.2	175.8	0	0	0	112.1	V56 I58 Y71 A177 I179 F188 M199 P200 I201 L207 A208	V56-L204 HydrophobicContact CG1-CB 4.18Å; V56-L204 HydrophobicContact CG1-CD1 4.23Å; I58-L204 HydrophobicContact CD1-CD1 3.56Å; Y71-L204 VanDerWaalsContact OH-CD1 3.32Å; Y71-L204 WeakPolarHBondContact OH-CD1 3.21Å; A177-L204 HydrophobicContact CB-CD1 3.84Å; A177-L204 HydrophobicContact CB-CD2 3.76Å; A177-L204 HydrophobicContact CB-CG 4.46Å; I179-L204 HydrophobicContact CD1-CD2 4.28Å; I179-L204 WeakPolarHBondContact CD1-O 3.13Å; I179-L204 HydrophobicContact CG1-CD2 4.45Å; F188-L204 HydrophobicContact CD1-CD2 3.93Å; F188-L204 HydrophobicContact CE1-CD2 3.88Å; M199-L204 HydrophobicContact CB-CD1 4.2Å; M199-L204 HydrophobicContact CB-CD2 4.19Å; M199-L204 HydrophobicContact CB-CG 4.15Å; M199-L204 HydrophobicContact CG-CD1 4.26Å; M199-L204 HydrophobicContact CG-CD2 3.61Å; M199-L204 HydrophobicContact CG-CG 3.66Å; P200-L204 PolarHBondContact O-N 3.28Å; P200-L204 VanDerWaalsContact O-N 3.08Å; I201-L204 PolarHBondContact O-N 3.17Å; L204-L207 PolarHBondContact O-N 3.06Å; L204-A208 VanDerWaalsContact O-CB 3.26Å; L204-A208 WeakPolarHBondContact O-CB 3.49Å; L204-A208 PolarHBondContact O-N 2.88Å
205	L	91.8	Very high	81.1	Confident	6 Å²	6	56.2 Å²	56.2	3%	0.031	29%	0.294	C	S	.	.	H	α-helix	trans	-67.4	-40.8	-179.5	-65.3	175.5	0	0	0	111.4	V78 L83 I201 W203 A208 G209 V210 L214	V78-L205 HydrophobicContact CG1-CD1 3.92Å; V78-L205 HydrophobicContact CG1-CD2 4.29Å; V78-L205 HydrophobicContact CG2-CD1 3.8Å; L83-L205 HydrophobicContact CD2-CD2 3.91Å; I201-L205 HydrophobicContact CG2-CD1 3.75Å; I201-L205 HydrophobicContact CG2-CG 4.21Å; I201-L205 VanDerWaalsContact O-CG 3.28Å; I201-L205 WeakPolarHBondContact O-CG 3.44Å; I201-L205 PolarHBondContact O-N 3.33Å; W203-L205 VanDerWaalsContact C-N 3.35Å; W203-L205 PolarHBondContact O-N 3.12Å; L205-A208 PolarHBondContact O-N 3.01Å; L205-G209 PolarHBondContact O-N 3.4Å; L205-V210 HydrophobicContact CB-CB 4.02Å; L205-V210 HydrophobicContact CB-CG2 4.08Å; L205-V210 HydrophobicContact CD2-CG2 4.1Å; L205-V210 WeakPolarHBondContact O-CB 3.24Å; L205-V210 PolarHBondContact O-N 3.49Å; L205-L214 HydrophobicContact CD1-CD1 3.34Å
206	Q	89.6	Confident	80.4	Confident	139 Å²	139	53.1 Å²	53.1	65%	0.65	28%	0.284	S	S	*	.	H	α-helix	trans	-62.8	-46.8	174.9	-175	179.2	-2.5	0	0	111.9	T202 W203 A208 G209	T202-Q206 WeakPolarHBondContact O-CB 3.47Å; T202-Q206 PolarHBondContact O-N 3.14Å; W203-Q206 PolarHBondContact O-N 3.42Å; Q206-A208 VanDerWaalsContact C-N 3.28Å; Q206-A208 PolarHBondContact O-N 3.42Å; Q206-G209 PolarHBondContact O-N 2.8Å; Q206-G209 VanDerWaalsContact O-N 3.12Å
207	L	90.4	Very high	79.3	Confident	70 Å²	70	53.8 Å²	53.8	37%	0.366	29%	0.293	S	S	.	.	H	α-helix	trans	-62.3	-36	175.9	-77.2	-175.8	0	0	0	112.5	I179 F188 W203 L204 G209	I179-L207 HydrophobicContact CD1-CB 3.57Å; I179-L207 HydrophobicContact CD1-CD1 4.3Å; F188-L207 HydrophobicContact CB-CD1 4.12Å; F188-L207 HydrophobicContact CD1-CD1 4.14Å; F188-L207 HydrophobicContact CD2-CD1 3.6Å; F188-L207 HydrophobicContact CE2-CD1 4.06Å; F188-L207 HydrophobicContact CG-CD1 3.65Å; F188-L207 HydrophobicContact CZ-CD1 4.49Å; W203-L207 HydrophobicContact CD2-CD1 4.11Å; W203-L207 HydrophobicContact CD2-CG 4.28Å; W203-L207 HydrophobicContact CE3-CD1 3.39Å; W203-L207 HydrophobicContact CE3-CG 4.04Å; W203-L207 HydrophobicContact CH2-CD1 3.7Å; W203-L207 HydrophobicContact CH2-CD2 4.4Å; W203-L207 HydrophobicContact CH2-CG 4.36Å; W203-L207 HydrophobicContact CZ2-CD1 4.34Å; W203-L207 HydrophobicContact CZ2-CD2 4.46Å; W203-L207 HydrophobicContact CZ3-CD1 3.19Å; W203-L207 HydrophobicContact CZ3-CG 4.13Å; W203-L207 WeakPolarHBondContact O-CB 3.12Å; W203-L207 WeakPolarHBondContact O-CG 3.45Å; W203-L207 PolarHBondContact O-N 2.88Å; L204-L207 PolarHBondContact O-N 3.06Å; L207-G209 PolarHBondContact O-N 3.34Å
208	A	91.5	Very high	77.6	Confident	1 Å²	1	58.2 Å²	58.2	1%	0.008	32%	0.322	C	S	.	.	H	α-helix	trans	-69.3	-25.8	177.2	0	0	0	0	0	111.8	K54 V56 I88 I179 L204 L205 Q206	K54-A208 HydrophobicContact CD-CB 4.35Å; K54-A208 WeakPolarHBondContact CD-O 3.11Å; K54-A208 PolarHBondContact NZ-O 3.5Å; V56-A208 HydrophobicContact CG2-CB 3.53Å; I88-A208 VanDerWaalsContact CD1-C 3.47Å; I88-A208 HydrophobicContact CD1-CB 3.71Å; I88-A208 VanDerWaalsContact CD1-O 3.24Å; I88-A208 WeakPolarHBondContact CD1-O 3.47Å; I88-A208 HydrophobicContact CG1-CB 4.41Å; I88-A208 HydrophobicContact CG2-CB 4.19Å; I179-A208 HydrophobicContact CD1-CB 4.21Å; I179-A208 HydrophobicContact CG2-CB 4.26Å; L204-A208 VanDerWaalsContact O-CB 3.26Å; L204-A208 WeakPolarHBondContact O-CB 3.49Å; L204-A208 PolarHBondContact O-N 2.88Å; L205-A208 PolarHBondContact O-N 3.01Å; Q206-A208 VanDerWaalsContact C-N 3.28Å; Q206-A208 PolarHBondContact O-N 3.42Å
209	G	89.1	Confident	75.6	Confident	40 Å²	40	64.6 Å²	64.6	41%	0.412	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	112.3	15.7	177.3	0	0	0	0	0	114.4	L205 Q206 L207 Q211	L205-G209 PolarHBondContact O-N 3.4Å; Q206-G209 PolarHBondContact O-N 2.8Å; Q206-G209 VanDerWaalsContact O-N 3.12Å; L207-G209 PolarHBondContact O-N 3.34Å; G209-Q211 PolarHBondContact O-N 3.12Å
210	V	87.1	Confident	73.2	Confident	11 Å²	11	69.5 Å²	69.5	7%	0.067	38%	0.383	C	S	.	.			trans	-73.5	117.7	173.2	-177.4	0	0	0	0	108.9	A82 L83 A86 I88 L205 Q212	A82-V210 HydrophobicContact CB-CG1 4.23Å; L83-V210 HydrophobicContact CD2-CG2 4.37Å; A86-V210 HydrophobicContact CB-CG2 4.16Å; I88-V210 HydrophobicContact CD1-CG2 3.64Å; L205-V210 HydrophobicContact CB-CB 4.02Å; L205-V210 HydrophobicContact CB-CG2 4.08Å; L205-V210 HydrophobicContact CD2-CG2 4.1Å; L205-V210 WeakPolarHBondContact O-CB 3.24Å; L205-V210 PolarHBondContact O-N 3.49Å; V210-Q212 HydrophobicContact CG1-CB 4.43Å
211	Q	71.7	Confident	70.7	Confident	193 Å²	193	77.8 Å²	77.8	90%	0.902	42%	0.416	S	S	*	.			trans	-84.6	-11.6	-175.3	-60.5	-141.1	-10.9	0	0	114.4	G209	G209-Q211 PolarHBondContact O-N 3.12Å
212	Q	64.9	Low	68.2	Low	84 Å²	84	84.2 Å²	84.2	39%	0.393	45%	0.449	S	S	.	.	S	Bend	trans	-79.5	125.7	-179.7	-66.4	177.8	14.4	0	0	110.8	A82 E85 V210 L214	A82-Q212 VanDerWaalsContact CB-OE1 3.22Å; E85-Q212 PolarHBondContact OE2-NE2 3.19Å; V210-Q212 HydrophobicContact CG1-CB 4.43Å; Q212-L214 PolarHBondContact O-N 3.17Å; Q212-L214 VanDerWaalsContact O-N 3.15Å
213	S	57.2	Low	65.9	Low	122 Å²	122	87.7 Å²	87.7	85%	0.853	46%	0.464	S	S	*	.			trans	-70	107.2	172	61.7	0	0	0	0	109.9
214	L	62.1	Low	63.3	Low	37 Å²	37	91.4 Å²	91.4	19%	0.194	49%	0.485	C	S	.	.			trans	-90.9	118.4	171.8	-66.6	168.3	0	0	0	109.1	V78 P79 T202 L205 Q212 F216	V78-L214 HydrophobicContact CG1-CD1 4.2Å; V78-L214 HydrophobicContact CG2-CD1 4.42Å; P79-L214 VanDerWaalsContact CD-CD2 3.45Å; P79-L214 HydrophobicContact CG-CD2 3.87Å; T202-L214 VanDerWaalsContact CG2-O 3.23Å; T202-L214 WeakPolarHBondContact CG2-O 3.16Å; L205-L214 HydrophobicContact CD1-CD1 3.34Å; Q212-L214 PolarHBondContact O-N 3.17Å; Q212-L214 VanDerWaalsContact O-N 3.15Å; L214-F216 HydrophobicContact CB-CD2 4.2Å; L214-F216 HydrophobicContact CB-CE2 3.48Å; L214-F216 VanDerWaalsContact CB-CE2 3.48Å; L214-F216 HydrophobicContact CB-CZ 3.89Å; L214-F216 HydrophobicContact CD1-CE2 4.4Å; L214-F216 HydrophobicContact CD1-CZ 4.15Å
215	D	60.6	Low	60.9	Low	97 Å²	97	101 Å²	101	52%	0.519	54%	0.543	S	S	.	.			trans	-92.6	108.7	175	-172.9	4.4	0	0	0	109.2	S217 K219	D215-S217 VanDerWaalsContact C-N 3.34Å; D215-S217 WeakPolarHBondContact OD1-CB 3.47Å; D215-S217 PolarHBondContact OD1-N 3.15Å; D215-S217 PolarHBondContact OD1-OG 3.31Å; D215-K219 IonicContact OD2-NZ 2.71Å; D215-K219 PolarHBondContact OD2-NZ 3.26Å
216	F	58.1	Low	59.3	Low	39 Å²	39	105.8 Å²	105.8	17%	0.171	57%	0.569	C	S	.	*			trans	-93.5	8.4	175.5	-61.9	-91.6	0	0	0	112.6	D74 K77 V78 I201 T202 L214	D74-F216 HydrophobicContact CB-CD1 4.4Å; D74-F216 WeakPolarHBondContact O-CE1 3.15Å; K77-F216 HydrophobicContact CB-CE1 4.48Å; V78-F216 HydrophobicContact CG2-CZ 4.14Å; I201-F216 HydrophobicContact CB-CE2 4.16Å; I201-F216 HydrophobicContact CB-CZ 4.02Å; I201-F216 HydrophobicContact CD1-CE1 4.37Å; I201-F216 HydrophobicContact CG2-CE1 4.18Å; I201-F216 HydrophobicContact CG2-CE2 3.96Å; I201-F216 HydrophobicContact CG2-CZ 3.49Å; I201-F216 VanDerWaalsContact CG2-CZ 3.49Å; T202-F216 HydrophobicContact CG2-CD2 3.33Å; T202-F216 HydrophobicContact CG2-CE2 3.48Å; T202-F216 VanDerWaalsContact CG2-CE2 3.48Å; L214-F216 HydrophobicContact CB-CD2 4.2Å; L214-F216 HydrophobicContact CB-CE2 3.48Å; L214-F216 VanDerWaalsContact CB-CE2 3.48Å; L214-F216 HydrophobicContact CB-CZ 3.89Å; L214-F216 HydrophobicContact CD1-CE2 4.4Å; L214-F216 HydrophobicContact CD1-CZ 4.15Å
217	S	52.5	Low	57.7	Low	66 Å²	66	104 Å²	104	46%	0.462	57%	0.565	S	S	.	*			trans	-61.9	137.5	177.9	-54	0	0	0	0	110.6	D215 K219	D215-S217 VanDerWaalsContact C-N 3.34Å; D215-S217 WeakPolarHBondContact OD1-CB 3.47Å; D215-S217 PolarHBondContact OD1-N 3.15Å; D215-S217 PolarHBondContact OD1-OG 3.31Å; S217-K219 PolarHBondContact O-N 3.19Å
218	P	43.2	Very low	55.9	Low	118 Å²	118	105.9 Å²	105.9	77%	0.766	58%	0.576	S	S	*	*			trans	-73.5	74.5	172.3	31.4	-33.8	0	0	0	109.6
219	K	42.6	Very low	53.8	Low	145 Å²	145	112.1 Å²	112.1	63%	0.63	61%	0.609	S	S	*	*			trans	-84	125.7	170.5	-73	176	-177.5	152.9	0	108.9	D215 S217 K221	D215-K219 IonicContact OD2-NZ 2.71Å; D215-K219 PolarHBondContact OD2-NZ 3.26Å; S217-K219 PolarHBondContact O-N 3.19Å; K219-K221 PolarHBondContact O-N 3.33Å
220	P	36.9	Very low	51.6	Low	111 Å²	111	116.6 Å²	116.6	72%	0.721	62%	0.621	S	S	*	*			trans	-60.1	126.6	166.2	24.2	-29.8	0	0	0	108.1	I222	P220-I222 PolarHBondContact O-N 3.1Å
221	K	35.5	Very low	49.2	Very low	198 Å²	198	123.6 Å²	123.6	86%	0.861	66%	0.658	S	S	*	*			trans	-66.9	100.6	170.3	-74.7	-176.6	178.6	179.8	0	107.5	K219 I223	K219-K221 PolarHBondContact O-N 3.33Å; K221-I223 PolarHBondContact O-N 3.01Å; K221-I223 VanDerWaalsContact O-N 3.08Å
222	I	39.4	Very low	47.6	Very low	135 Å²	135	118.6 Å²	118.6	69%	0.692	64%	0.641	S	S	*	*			trans	-71.2	101	165.5	-59	174.8	0	0	0	105.8	P220 H224	P220-I222 PolarHBondContact O-N 3.1Å; I222-H224 PolarHBondContact O-N 3.4Å
223	I	38.9	Very low	46.3	Very low	133 Å²	133	121.3 Å²	121.3	68%	0.682	66%	0.66	S	S	*	*			trans	-80.5	109.6	166.2	-60.1	168.2	0	0	0	105	K221 V225	K221-I223 PolarHBondContact O-N 3.01Å; K221-I223 VanDerWaalsContact O-N 3.08Å; I223-V225 HydrophobicContact CG2-CG2 4.21Å; I223-V225 PolarHBondContact O-N 3.11Å
224	H	33.4	Very low	45.4	Very low	174 Å²	174	121.3 Å²	121.3	81%	0.806	64%	0.644	S	S	*	*			trans	-67.9	110.6	162	-76.8	-79	0	0	0	107	I222	I222-H224 PolarHBondContact O-N 3.4Å
225	V	41.5	Very low	43.9	Very low	202 Å²	202	128.9 Å²	128.9	100%	1.224	69%	0.685	S	S	*	*			trans	-85.2	0	164.7	-179.4	0	0	0	0	108.1	I223	I223-V225 HydrophobicContact CG2-CG2 4.21Å; I223-V225 PolarHBondContact O-N 3.11Å

Retrieved 225 of 225 residues in 66 ms (Link to these results)

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