A0A077ZK25_TRITR Loading...

Small ribosomal subunit protein eS1

AlphaFold DB , UniProt , Accession A0A077ZK25, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 262 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	38.5	Very low	43.9	Very low	249 Å²	249	166.6 Å²	166.6	100%	1.227	88%	0.88	S	S	*	*				0	115.7	0	-64.4	-168.8	-90.4	0	0	106.2
2	A	43.5	Very low	44.3	Very low	103 Å²	103	161.1 Å²	161.1	85%	0.851	88%	0.876	S	S	*	*			cis	-127.1	138.5	31.6	0	0	0	0	0	112.7
3	V	38.7	Very low	44.4	Very low	134 Å²	134	153.5 Å²	153.5	81%	0.812	86%	0.858	S	S	*	*			trans	-105.9	93	176.2	178.2	0	0	0	0	107.3
4	G	48.1	Very low	44.4	Very low	80 Å²	80	157.8 Å²	157.8	83%	0.825	86%	0.863	S	S	*	*			trans	-92.8	95.1	174.7	0	0	0	0	0	110.7
5	K	46.4	Very low	44.4	Very low	189 Å²	189	160.3 Å²	160.3	82%	0.822	86%	0.862	S	S	*	*			trans	-52.8	129.8	-176	-77.5	167.7	172.6	171.1	0	113.8	K7	K5-K7 PolarHBondContact O-N 3.17Å
6	N	40.5	Very low	44.8	Very low	167 Å²	167	154.4 Å²	154.4	89%	0.893	85%	0.85	S	S	*	*			trans	-47.5	92.1	166.5	-134.4	12.8	0	0	0	111.7	R8	N6-R8 VanDerWaalsContact C-N 3.33Å; N6-R8 PolarHBondContact O-N 3.04Å; N6-R8 VanDerWaalsContact O-N 3.08Å
7	K	46.4	Very low	45.2	Very low	198 Å²	198	149.4 Å²	149.4	86%	0.861	84%	0.842	S	S	*	*			trans	-84.7	84.7	174.1	-156	174.4	-173.2	177.9	0	108.9	K5	K5-K7 PolarHBondContact O-N 3.17Å
8	R	43.3	Very low	45.8	Very low	214 Å²	214	152.3 Å²	152.3	81%	0.808	84%	0.844	S	S	*	*			trans	44.5	111.5	144.4	-71.4	176.3	147.8	-168.9	-7	116.4	N6 S10	N6-R8 VanDerWaalsContact C-N 3.33Å; N6-R8 PolarHBondContact O-N 3.04Å; N6-R8 VanDerWaalsContact O-N 3.08Å; R8-S10 PolarHBondContact O-N 3.26Å
9	L	46.1	Very low	46.8	Very low	190 Å²	190	154.6 Å²	154.6	100%	0.995	84%	0.844	S	S	*	*			trans	-33.8	85.2	144.1	-69.4	124.2	0	0	0	112.1
10	S	45.2	Very low	48	Very low	94 Å²	94	156.4 Å²	156.4	66%	0.657	84%	0.844	S	S	*	*			trans	-119.2	96.8	171.3	63.5	0	0	0	0	108.4	R8 A12	R8-S10 PolarHBondContact O-N 3.26Å; S10-A12 VanDerWaalsContact C-N 3.3Å; S10-A12 PolarHBondContact O-N 3.32Å
11	K	46.1	Very low	49.6	Very low	215 Å²	215	157.3 Å²	157.3	94%	0.935	85%	0.847	S	S	*	*			trans	54.6	30.8	135.4	-107.6	174.8	-178.5	173.6	0	117.9	G13	K11-G13 PolarHBondContact O-N 3.19Å
12	A	49.1	Very low	51.7	Low	100 Å²	100	149.7 Å²	149.7	83%	0.826	81%	0.814	S	S	*	*			trans	-89	49.9	155.2	0	0	0	0	0	109.6	S10 K14	S10-A12 VanDerWaalsContact C-N 3.3Å; S10-A12 PolarHBondContact O-N 3.32Å; A12-K14 PolarHBondContact O-N 3Å
13	G	45.6	Very low	54	Low	62 Å²	62	149 Å²	149	64%	0.639	80%	0.796	S	S	*	*			trans	-62.4	105.1	166.7	0	0	0	0	0	106.7	K11 K15	K11-G13 PolarHBondContact O-N 3.19Å; G13-K15 PolarHBondContact O-N 3.1Å
14	K	44	Very low	56.4	Low	214 Å²	214	146.9 Å²	146.9	93%	0.93	79%	0.785	S	S	*	*			trans	-56.3	65.7	164.7	-155.1	174.5	-171.4	176.9	0	108.2	A12 G16	A12-K14 PolarHBondContact O-N 3Å; K14-G16 PolarHBondContact O-N 2.84Å
15	K	43.9	Very low	58.6	Low	196 Å²	196	149.6 Å²	149.6	85%	0.852	77%	0.774	S	S	*	*			trans	-65	97.1	166.3	-91.8	-177.9	174.6	176.5	0	103.2	G13 G17	G13-K15 PolarHBondContact O-N 3.1Å; K15-G17 PolarHBondContact O-N 3.46Å
16	G	50.8	Low	60.7	Low	65 Å²	65	143.5 Å²	143.5	67%	0.67	76%	0.755	S	S	*	*			trans	-38.4	117.1	175.2	0	0	0	0	0	107.5	K14 K18	K14-G16 PolarHBondContact O-N 2.84Å; G16-K18 PolarHBondContact O-N 2.88Å
17	G	52.2	Low	63.1	Low	69 Å²	69	141.2 Å²	141.2	71%	0.711	73%	0.734	S	S	*	*			trans	-45.9	117.2	-171.1	0	0	0	0	0	107.2	K15 K19	K15-G17 PolarHBondContact O-N 3.46Å; G17-K19 VanDerWaalsContact C-N 3.32Å; G17-K19 PolarHBondContact O-N 3.17Å
18	K	56.9	Low	65.3	Low	203 Å²	203	134.5 Å²	134.5	88%	0.883	71%	0.705	S	S	*	*			trans	-47.6	107.5	174.7	-77.7	-179.4	175.4	-177.1	0	104.3	G16 K20	G16-K18 PolarHBondContact O-N 2.88Å; K18-K20 PolarHBondContact O-N 3.44Å
19	K	64.5	Low	67.7	Low	195 Å²	195	127.5 Å²	127.5	85%	0.848	68%	0.682	S	S	*	*			trans	-44.5	119.1	174.9	-78.4	-179.2	176.5	176.3	0	104.2	G17 I21	G17-K19 VanDerWaalsContact C-N 3.32Å; G17-K19 PolarHBondContact O-N 3.17Å; K19-I21 PolarHBondContact O-N 3.02Å
20	K	70.8	Confident	70	Confident	191 Å²	191	125.9 Å²	125.9	83%	0.83	66%	0.662	S	S	*	*			trans	-44	123.7	177.7	-84.8	-174	175.1	-178.6	0	105.3	K18 V22	K18-K20 PolarHBondContact O-N 3.44Å; K20-V22 HydrophobicContact CB-CG2 4.42Å; K20-V22 WeakPolarHBondContact O-CG2 3.39Å; K20-V22 PolarHBondContact O-N 3.41Å
21	I	81.4	Confident	72.4	Confident	176 Å²	176	122.8 Å²	122.8	90%	0.903	64%	0.636	S	S	*	*			trans	-66	96	177.8	-66.8	166.5	0	0	0	104.2	K19	K19-I21 PolarHBondContact O-N 3.02Å
22	V	83.1	Confident	74.7	Confident	88 Å²	88	114 Å²	114	53%	0.533	60%	0.602	S	S	.	*			trans	-84.3	126.5	-179.4	175.1	0	0	0	0	107	K20 P24 S26	K20-V22 HydrophobicContact CB-CG2 4.42Å; K20-V22 WeakPolarHBondContact O-CG2 3.39Å; K20-V22 PolarHBondContact O-N 3.41Å; V22-P24 WeakPolarHBondContact O-CD 3.45Å; V22-S26 VanDerWaalsContact CG1-OG 3.29Å; V22-S26 WeakPolarHBondContact CG1-OG 3.39Å
23	D	90.8	Very high	76.9	Confident	90 Å²	90	109.6 Å²	109.6	48%	0.481	56%	0.564	S	S	.	*			trans	-53.8	123.9	177	-179.6	-8.4	0	0	0	110.2	F25 S26	D23-F25 PolarHBondContact O-N 3.42Å; D23-F25 VanDerWaalsContact O-N 3.14Å; D23-F25 PolarHBondContact OD1-N 3.35Å; D23-S26 WeakPolarHBondContact O-CB 3.41Å; D23-S26 PolarHBondContact O-N 3.07Å; D23-S26 VanDerWaalsContact O-N 3.11Å; D23-S26 PolarHBondContact O-OG 3.41Å
24	P	90.3	Very high	79.3	Confident	89 Å²	89	109.9 Å²	109.9	58%	0.578	55%	0.548	S	S	*	.	G	3₁₀ helix	trans	-52.6	-29.5	174.6	-27.1	35.4	0	0	0	115.2	V22	V22-P24 WeakPolarHBondContact O-CD 3.45Å
25	F	92.8	Very high	81.7	Confident	136 Å²	136	99.7 Å²	99.7	60%	0.596	50%	0.504	S	S	*	.	G	3₁₀ helix	trans	-75.4	-27	179.1	-75.3	-83.4	0	0	0	113.5	D23 R27 K28 L48	D23-F25 PolarHBondContact O-N 3.42Å; D23-F25 VanDerWaalsContact O-N 3.14Å; D23-F25 PolarHBondContact OD1-N 3.35Å; F25-R27 PolarHBondContact O-N 3.41Å; F25-R27 VanDerWaalsContact O-N 3.07Å; F25-K28 HydrophobicContact CD1-CD 3.79Å; F25-K28 HydrophobicContact CE1-CD 4.25Å; F25-K28 HydrophobicContact CG-CD 4.49Å; F25-K28 WeakPolarHBondContact O-CB 3.45Å; F25-K28 PolarHBondContact O-N 2.95Å; F25-L48 HydrophobicContact CE1-CD1 4.28Å
26	S	90.2	Very high	84	Confident	62 Å²	62	90.4 Å²	90.4	43%	0.434	46%	0.463	S	S	.	.	G	3₁₀ helix	trans	-61.5	-19.3	175.8	69.5	0	0	0	0	113.4	V22 D23	V22-S26 VanDerWaalsContact CG1-OG 3.29Å; V22-S26 WeakPolarHBondContact CG1-OG 3.39Å; D23-S26 WeakPolarHBondContact O-CB 3.41Å; D23-S26 PolarHBondContact O-N 3.07Å; D23-S26 VanDerWaalsContact O-N 3.11Å; D23-S26 PolarHBondContact O-OG 3.41Å
27	R	90.5	Very high	85.9	Confident	119 Å²	119	89.4 Å²	89.4	45%	0.449	45%	0.446	S	S	.	.	G	3₁₀ helix	trans	-94.5	5.2	179.5	-58.7	175.2	78.7	-178	8.2	112.8	F25 R51	F25-R27 PolarHBondContact O-N 3.41Å; F25-R27 VanDerWaalsContact O-N 3.07Å; R27-R51 WeakPolarHBondContact O-CB 3.18Å; R27-R51 WeakPolarHBondContact O-CG 3.36Å; R27-R51 PolarHBondContact O-N 2.86Å
28	K	94.3	Very high	87.7	Confident	56 Å²	56	86.9 Å²	86.9	24%	0.243	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	150	-176.7	-61	-178.1	-179.5	-71.1	0	111.3	F25 L48 V49 N50	F25-K28 HydrophobicContact CD1-CD 3.79Å; F25-K28 HydrophobicContact CE1-CD 4.25Å; F25-K28 HydrophobicContact CG-CD 4.49Å; F25-K28 WeakPolarHBondContact O-CB 3.45Å; F25-K28 PolarHBondContact O-N 2.95Å; K28-L48 HydrophobicContact CD-CD1 3.42Å; K28-L48 VanDerWaalsContact CD-CD1 3.42Å; K28-V49 CarbonylContact C-O 3.6Å; K28-V49 WeakPolarHBondContact CA-O 3.11Å; K28-V49 WeakPolarHBondContact CB-O 3.41Å; K28-N50 PolarHBondContact NZ-OD1 3.37Å
29	E	92.9	Very high	89.3	Confident	68 Å²	68	77.5 Å²	77.5	32%	0.318	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	149.6	173.6	-76.9	174.2	177.6	0	0	110.1	Y31 L48 V49 R51	E29-Y31 HydrophobicContact CB-CE2 4.06Å; E29-L48 WeakPolarHBondContact O-CA 3.38Å; E29-V49 PolarHBondContact N-O 3.45Å; E29-V49 PolarHBondContact O-N 3.02Å; E29-R51 VanDerWaalsContact CD-CG 3.43Å; E29-R51 HydrophobicContact CG-CG 3.62Å; E29-R51 WeakPolarHBondContact OE1-CD 3.36Å; E29-R51 VanDerWaalsContact OE1-CG 3.32Å; E29-R51 WeakPolarHBondContact OE1-CG 3.2Å; E29-R51 IonicContact OE1-CZ 3.53Å; E29-R51 IonicContact OE1-NE 2.69Å; E29-R51 PolarHBondContact OE1-NE 3.36Å; E29-R51 IonicContact OE1-NH2 3.69Å
30	W	94.2	Very high	90.5	Very high	155 Å²	155	77 Å²	77	59%	0.587	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.2	136	-179.6	-66.1	95.2	0	0	0	110.7	Q46 L48	W30-Q46 HydrophobicContact CE3-CB 3.89Å; W30-Q46 HydrophobicContact CZ3-CB 4.31Å; W30-L48 HydrophobicContact CD2-CB 4.34Å; W30-L48 HydrophobicContact CE3-CB 4.16Å; W30-L48 HydrophobicContact CE3-CD2 4.23Å; W30-L48 HydrophobicContact CH2-CD2 3.58Å; W30-L48 HydrophobicContact CZ2-CD2 4.3Å; W30-L48 HydrophobicContact CZ3-CB 4.3Å; W30-L48 HydrophobicContact CZ3-CD2 3.53Å
31	Y	95.2	Very high	91.4	Very high	30 Å²	30	70.1 Å²	70.1	12%	0.118	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	139.1	176.1	-74.8	-110.8	0	0	0	109.1	E29 Q46 T47 V49 L62 I91 G93 S94	E29-Y31 HydrophobicContact CB-CE2 4.06Å; Y31-Q46 CarbonylContact O-C 3.6Å; Y31-Q46 VanDerWaalsContact O-CA 3.25Å; Y31-Q46 WeakPolarHBondContact O-CA 3.24Å; Y31-T47 PolarHBondContact N-O 3.29Å; Y31-T47 PolarHBondContact O-N 3.5Å; Y31-V49 HydrophobicContact CD2-CG1 3.87Å; Y31-V49 HydrophobicContact CE2-CG1 3.58Å; Y31-L62 HydrophobicContact CD1-CD1 3.62Å; Y31-L62 HydrophobicContact CD2-CD1 3.66Å; Y31-L62 HydrophobicContact CE1-CD1 3.86Å; Y31-L62 HydrophobicContact CE2-CD1 3.93Å; Y31-L62 HydrophobicContact CG-CD1 3.53Å; Y31-I91 HydrophobicContact CD1-CG2 3.91Å; Y31-I91 HydrophobicContact CE1-CG2 3.68Å; Y31-G93 VanDerWaalsContact CE1-O 3.28Å; Y31-G93 WeakPolarHBondContact CE1-O 3.49Å; Y31-S94 CarbonylContact C-O 3.58Å; Y31-S94 WeakPolarHBondContact CA-O 3.37Å; Y31-S94 WeakPolarHBondContact CB-O 3.45Å
32	S	95.6	Very high	91.9	Very high	29 Å²	29	65.9 Å²	65.9	20%	0.203	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	135	174.7	175.8	0	0	0	0	110.4	S94 V95 C96	S32-S94 PolarHBondContact N-O 3.28Å; S32-V95 CarbonylContact O-C 3.52Å; S32-V95 WeakPolarHBondContact O-CA 3.32Å; S32-C96 PolarHBondContact O-N 3.42Å
33	I	95.5	Very high	92.3	Very high	8 Å²	8	68.8 Å²	68.8	4%	0.041	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	119.7	177.1	-55.6	164.1	0	0	0	108.6	V44 G45 T47 F67 T98	I33-V44 HydrophobicContact CB-CB 4.16Å; I33-V44 HydrophobicContact CG2-CB 3.96Å; I33-V44 HydrophobicContact CG2-CG1 4.37Å; I33-V44 HydrophobicContact CG2-CG2 4.33Å; I33-V44 PolarHBondContact O-N 3.47Å; I33-G45 PolarHBondContact N-O 3.01Å; I33-T47 HydrophobicContact CD1-CG2 4.33Å; I33-T47 HydrophobicContact CG1-CG2 3.99Å; I33-F67 HydrophobicContact CD1-CD1 3.69Å; I33-F67 HydrophobicContact CD1-CD2 4.08Å; I33-F67 HydrophobicContact CD1-CE1 3.5Å; I33-F67 HydrophobicContact CD1-CE2 3.89Å; I33-F67 HydrophobicContact CD1-CG 3.98Å; I33-F67 HydrophobicContact CD1-CZ 3.61Å; I33-F67 HydrophobicContact CG1-CD2 4.49Å; I33-F67 HydrophobicContact CG1-CE1 4.37Å; I33-F67 HydrophobicContact CG1-CE2 4.03Å; I33-F67 HydrophobicContact CG1-CZ 3.97Å; I33-F67 HydrophobicContact CG2-CD2 3.91Å; I33-F67 HydrophobicContact CG2-CE2 4.03Å; I33-T98 HydrophobicContact CG2-CG2 3.56Å
34	K	94.7	Very high	92.3	Very high	69 Å²	69	66.4 Å²	66.4	30%	0.3	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	128.6	174.7	-73.1	-168.2	-169	-178.3	0	112.5	R42 V95 C96 L97 T98 H232	K34-R42 CarbonylContact C-O 3.5Å; K34-R42 WeakPolarHBondContact CA-O 3.2Å; K34-V95 HydrophobicContact CB-CG1 4.03Å; K34-V95 HydrophobicContact CD-CG1 3.53Å; K34-V95 HydrophobicContact CG-CG1 3.6Å; K34-C96 PolarHBondContact N-O 3.38Å; K34-L97 HydrophobicContact CB-CD2 4.4Å; K34-T98 PolarHBondContact O-N 3.26Å; K34-T98 PolarHBondContact O-OG1 2.79Å; K34-H232 PolarHBondContact O-CE1 3.14Å
35	A	94.1	Very high	92.4	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	30%	0.298	C	S	.	.			trans	-75.1	154.8	169.8	0	0	0	0	0	111.5	F39 R42 V44 L74 L86 H232	A35-F39 HydrophobicContact CB-CD2 4.07Å; A35-R42 PolarHBondContact N-O 3.34Å; A35-V44 HydrophobicContact CB-CG2 3.73Å; A35-L74 HydrophobicContact CB-CD2 4.05Å; A35-L86 HydrophobicContact CB-CD1 4.15Å; A35-H232 VanDerWaalsContact C-CE1 3.48Å; A35-H232 PolarHBondContact O-CE1 3.05Å; A35-H232 PolarHBondContact O-ND1 3.11Å; A35-H232 VanDerWaalsContact O-ND1 3.08Å
36	P	93.6	Very high	92.5	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	30%	0.299	C	S	.	.			trans	-62	160.2	170.3	0.3	5	0	0	0	112.1	M38 F39 T98	P36-M38 HydrophobicContact CB-CE 3.84Å; P36-M38 HydrophobicContact CB-CG 3.99Å; P36-M38 HydrophobicContact CB-SD 4.12Å; P36-M38 HydrophobicContact CG-CE 4.14Å; P36-M38 HydrophobicContact CG-CG 4.24Å; P36-M38 HydrophobicContact CG-SD 3.99Å; P36-M38 PolarHBondContact O-N 2.91Å; P36-F39 HydrophobicContact CG-CD2 4.44Å; P36-F39 HydrophobicContact CG-CE2 4.32Å; P36-F39 PolarHBondContact O-N 3.42Å; P36-T98 WeakPolarHBondContact CD-O 3.39Å; P36-T98 WeakPolarHBondContact CG-O 3.36Å
37	S	91.1	Very high	92.8	Very high	45 Å²	45	61.4 Å²	61.4	32%	0.315	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-4.3	-175.9	72.4	0	0	0	0	114.5	F39 M231	S37-F39 PolarHBondContact O-N 2.97Å; S37-M231 WeakPolarHBondContact CB-O 3.48Å; S37-M231 PolarHBondContact N-O 2.82Å; S37-M231 PolarHBondContact OG-O 2.87Å; S37-M231 VanDerWaalsContact OG-O 3.05Å
38	M	88.8	Confident	93	Very high	15 Å²	15	58.4 Å²	58.4	7%	0.074	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-16.4	172.7	62.7	-167.3	57.2	0	0	112.8	P36 K182 V185 E186 I189 M231	P36-M38 HydrophobicContact CB-CE 3.84Å; P36-M38 HydrophobicContact CB-CG 3.99Å; P36-M38 HydrophobicContact CB-SD 4.12Å; P36-M38 HydrophobicContact CG-CE 4.14Å; P36-M38 HydrophobicContact CG-CG 4.24Å; P36-M38 HydrophobicContact CG-SD 3.99Å; P36-M38 PolarHBondContact O-N 2.91Å; M38-K182 HydrophobicContact CE-CB 4.38Å; M38-K182 HydrophobicContact CE-CG 4.34Å; M38-V185 HydrophobicContact CE-CB 4.39Å; M38-V185 HydrophobicContact CG-CG1 4.1Å; M38-V185 HydrophobicContact SD-CB 3.56Å; M38-V185 VanDerWaalsContact SD-CB 3.56Å; M38-V185 HydrophobicContact SD-CG1 3.35Å; M38-V185 WeakPolarHBondContact SD-CG1 3.43Å; M38-V185 HydrophobicContact SD-CG2 3.87Å; M38-E186 HydrophobicContact CB-CG 4.47Å; M38-I189 WeakPolarHBondContact O-CD1 3.34Å; M38-M231 HydrophobicContact CE-SD 4.34Å
39	F	90.1	Very high	93	Very high	6 Å²	6	56 Å²	56	3%	0.026	27%	0.265	C	S	.	.	S	Bend	trans	-107.5	144.5	175.8	-57.4	-71.7	0	0	0	110.5	A35 P36 S37 L71 L74 F84 L86 V185 I189	A35-F39 HydrophobicContact CB-CD2 4.07Å; P36-F39 HydrophobicContact CG-CD2 4.44Å; P36-F39 HydrophobicContact CG-CE2 4.32Å; P36-F39 PolarHBondContact O-N 3.42Å; S37-F39 PolarHBondContact O-N 2.97Å; F39-L71 HydrophobicContact CD1-CD1 4.38Å; F39-L71 HydrophobicContact CE1-CD1 4.27Å; F39-L74 HydrophobicContact CB-CB 4.18Å; F39-L74 HydrophobicContact CB-CD2 4.3Å; F39-L74 HydrophobicContact CD1-CB 3.79Å; F39-L74 HydrophobicContact CD1-CD1 3.89Å; F39-L74 HydrophobicContact CD1-CG 4.31Å; F39-L74 HydrophobicContact CD2-CD1 4.45Å; F39-L74 HydrophobicContact CD2-CD2 4.47Å; F39-L74 HydrophobicContact CE1-CB 4.48Å; F39-L74 HydrophobicContact CE1-CD1 3.84Å; F39-L74 HydrophobicContact CE2-CD1 4.41Å; F39-L74 HydrophobicContact CG-CB 4.1Å; F39-L74 HydrophobicContact CG-CD1 4.2Å; F39-L74 HydrophobicContact CG-CD2 4.21Å; F39-L74 HydrophobicContact CG-CG 4.41Å; F39-L74 HydrophobicContact CZ-CD1 4.11Å; F39-F84 HydrophobicContact CE1-CD1 4.28Å; F39-F84 HydrophobicContact CE1-CD2 4.23Å; F39-F84 HydrophobicContact CE1-CE1 4.35Å; F39-F84 HydrophobicContact CE1-CE2 4.31Å; F39-F84 HydrophobicContact CE1-CG 4.23Å; F39-F84 HydrophobicContact CE1-CZ 4.36Å; F39-F84 HydrophobicContact CZ-CB 4.49Å; F39-F84 AromaticContact CZ-CD1 3.81Å; F39-F84 HydrophobicContact CZ-CD1 3.81Å; F39-F84 HydrophobicContact CZ-CD2 4.46Å; F39-F84 HydrophobicContact CZ-CE1 4.14Å; F39-F84 AromaticContact CZ-CG 3.99Å; F39-F84 HydrophobicContact CZ-CG 3.99Å; F39-L86 HydrophobicContact CE2-CD2 4.01Å; F39-V185 HydrophobicContact CE1-CG1 4.36Å; F39-V185 HydrophobicContact CZ-CG1 3.91Å; F39-I189 HydrophobicContact CD1-CD1 4.04Å; F39-I189 HydrophobicContact CE1-CD1 3.97Å; F39-I189 HydrophobicContact CE1-CG1 4.18Å
40	R	89.3	Confident	93	Very high	186 Å²	186	57 Å²	57	70%	0.702	27%	0.273	S	S	*	.	S	Bend	trans	-67	-48.6	-179.8	-175.9	177.8	-177.3	-177.1	1	111.9	R42 L74 N75	R40-R42 PolarHBondContact O-N 2.92Å; R40-L74 PolarHBondContact N-O 3.41Å; R40-N75 VanDerWaalsContact CB-OD1 3.23Å; R40-N75 WeakPolarHBondContact CB-OD1 3.45Å
41	N	91.2	Very high	92.9	Very high	46 Å²	46	55.5 Å²	55.5	25%	0.246	27%	0.267	C	S	.	.			trans	-87.6	112.1	176.5	-63.5	-16.5	0	0	0	109	E73 L74 N76	N41-E73 WeakPolarHBondContact CB-O 3.47Å; N41-E73 PolarHBondContact ND2-O 3.31Å; N41-L74 WeakPolarHBondContact CB-O 3.28Å; N41-L74 PolarHBondContact N-O 2.93Å; N41-N76 VanDerWaalsContact ND2-CG 3.32Å; N41-N76 PolarHBondContact ND2-ND2 3.25Å; N41-N76 PolarHBondContact ND2-OD1 3.5Å; N41-N76 PolarHBondContact OD1-ND2 3.35Å
42	R	90.7	Very high	92.8	Very high	87 Å²	87	57.8 Å²	57.8	33%	0.328	28%	0.284	S	S	.	.			trans	-87.9	-22.2	-176.8	-63.1	-169.2	65.5	176.9	-1.6	113.4	K34 A35 R40 H232	K34-R42 CarbonylContact C-O 3.5Å; K34-R42 WeakPolarHBondContact CA-O 3.2Å; A35-R42 PolarHBondContact N-O 3.34Å; R40-R42 PolarHBondContact O-N 2.92Å; R42-H232 PolarHBondContact NH1-O 3.01Å; R42-H232 PolarHBondContact NH2-ND1 2.84Å; R42-H232 PolarHBondContact NH2-O 3.07Å
43	E	91.7	Very high	92.5	Very high	148 Å²	148	61.3 Å²	61.3	69%	0.692	30%	0.298	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.2	111.1	178	-64.1	-169.7	162	0	0	109.3
44	V	91	Very high	92.3	Very high	40 Å²	40	64.6 Å²	64.6	24%	0.242	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	-35.9	-179.5	176.8	0	0	0	0	110.7	I33 A35 V69 L74 L86	I33-V44 HydrophobicContact CB-CB 4.16Å; I33-V44 HydrophobicContact CG2-CB 3.96Å; I33-V44 HydrophobicContact CG2-CG1 4.37Å; I33-V44 HydrophobicContact CG2-CG2 4.33Å; I33-V44 PolarHBondContact O-N 3.47Å; A35-V44 HydrophobicContact CB-CG2 3.73Å; V44-V69 HydrophobicContact CG1-CB 4.39Å; V44-V69 HydrophobicContact CG1-CG1 4.06Å; V44-V69 HydrophobicContact CG1-CG2 3.38Å; V44-L74 HydrophobicContact CG2-CD2 4.05Å; V44-L86 HydrophobicContact CG2-CD1 4.25Å
45	G	93.3	Very high	92.1	Very high	33 Å²	33	67.8 Å²	67.8	34%	0.34	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	154.3	-157.8	-176.8	0	0	0	0	0	112.1	I33	I33-G45 PolarHBondContact N-O 3.01Å
46	Q	94.5	Very high	92	Very high	135 Å²	135	75.7 Å²	75.7	63%	0.631	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.2	148.9	-178	-61	-178.1	-19.1	0	0	111.3	W30 Y31	W30-Q46 HydrophobicContact CE3-CB 3.89Å; W30-Q46 HydrophobicContact CZ3-CB 4.31Å; Y31-Q46 CarbonylContact O-C 3.6Å; Y31-Q46 VanDerWaalsContact O-CA 3.25Å; Y31-Q46 WeakPolarHBondContact O-CA 3.24Å
47	T	95.6	Very high	91.9	Very high	14 Å²	14	79.6 Å²	79.6	9%	0.086	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	139.6	173.4	-167.6	0	0	0	0	110.3	Y31 I33 L62 R65 F67	Y31-T47 PolarHBondContact N-O 3.29Å; Y31-T47 PolarHBondContact O-N 3.5Å; I33-T47 HydrophobicContact CD1-CG2 4.33Å; I33-T47 HydrophobicContact CG1-CG2 3.99Å; T47-L62 HydrophobicContact CG2-CD2 3.54Å; T47-R65 PolarHBondContact OG1-NH1 2.96Å; T47-F67 HydrophobicContact CG2-CZ 4.07Å
48	L	94.4	Very high	91.9	Very high	56 Å²	56	77.7 Å²	77.7	29%	0.293	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	142.1	176.7	52.4	137.2	0	0	0	111.4	F25 K28 E29 W30 R65	F25-L48 HydrophobicContact CE1-CD1 4.28Å; K28-L48 HydrophobicContact CD-CD1 3.42Å; K28-L48 VanDerWaalsContact CD-CD1 3.42Å; E29-L48 WeakPolarHBondContact O-CA 3.38Å; W30-L48 HydrophobicContact CD2-CB 4.34Å; W30-L48 HydrophobicContact CE3-CB 4.16Å; W30-L48 HydrophobicContact CE3-CD2 4.23Å; W30-L48 HydrophobicContact CH2-CD2 3.58Å; W30-L48 HydrophobicContact CZ2-CD2 4.3Å; W30-L48 HydrophobicContact CZ3-CB 4.3Å; W30-L48 HydrophobicContact CZ3-CD2 3.53Å; L48-R65 PolarHBondContact O-NH1 3.09Å; L48-R65 PolarHBondContact O-NH2 3.48Å
49	V	94.5	Very high	92	Very high	5 Å²	5	78.9 Å²	78.9	3%	0.03	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	157.6	168.9	69.1	0	0	0	0	109.8	K28 E29 Y31 A58 A61 L62	K28-V49 CarbonylContact C-O 3.6Å; K28-V49 WeakPolarHBondContact CA-O 3.11Å; K28-V49 WeakPolarHBondContact CB-O 3.41Å; E29-V49 PolarHBondContact N-O 3.45Å; E29-V49 PolarHBondContact O-N 3.02Å; Y31-V49 HydrophobicContact CD2-CG1 3.87Å; Y31-V49 HydrophobicContact CE2-CG1 3.58Å; V49-A58 HydrophobicContact CG1-CB 3.9Å; V49-A61 HydrophobicContact CG2-CB 3.93Å; V49-L62 HydrophobicContact CB-CD1 4.07Å; V49-L62 HydrophobicContact CB-CD2 3.87Å; V49-L62 HydrophobicContact CB-CG 3.71Å; V49-L62 HydrophobicContact CG1-CD1 3.55Å; V49-L62 HydrophobicContact CG1-CD2 4.26Å; V49-L62 HydrophobicContact CG1-CG 3.77Å; V49-L62 HydrophobicContact CG2-CD2 4.46Å; V49-L62 HydrophobicContact CG2-CG 4Å
50	N	93.5	Very high	92.1	Very high	89 Å²	89	85 Å²	85	48%	0.476	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	142.1	170.4	-65.3	-9.2	0	0	0	109.5	K28 A58	K28-N50 PolarHBondContact NZ-OD1 3.37Å; N50-A58 WeakPolarHBondContact O-CB 3.4Å
51	R	91.8	Very high	92.2	Very high	124 Å²	124	78.9 Å²	78.9	47%	0.468	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-52.6	146.5	168.1	-74.4	-176.2	175.2	160.5	6.1	110.5	R27 E29 Q53	R27-R51 WeakPolarHBondContact O-CB 3.18Å; R27-R51 WeakPolarHBondContact O-CG 3.36Å; R27-R51 PolarHBondContact O-N 2.86Å; E29-R51 VanDerWaalsContact CD-CG 3.43Å; E29-R51 HydrophobicContact CG-CG 3.62Å; E29-R51 WeakPolarHBondContact OE1-CD 3.36Å; E29-R51 VanDerWaalsContact OE1-CG 3.32Å; E29-R51 WeakPolarHBondContact OE1-CG 3.2Å; E29-R51 IonicContact OE1-CZ 3.53Å; E29-R51 IonicContact OE1-NE 2.69Å; E29-R51 PolarHBondContact OE1-NE 3.36Å; E29-R51 IonicContact OE1-NH2 3.69Å; R51-Q53 VanDerWaalsContact O-CG 3.28Å; R51-Q53 WeakPolarHBondContact O-CG 3.28Å; R51-Q53 PolarHBondContact O-N 2.89Å
52	T	92.9	Very high	92.2	Very high	78 Å²	78	76.7 Å²	76.7	48%	0.479	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-54.8	126.1	174.8	-63.6	0	0	0	0	109.8	K56 A58	T52-K56 WeakPolarHBondContact CA-O 3.45Å; T52-A58 WeakPolarHBondContact OG1-CB 3.38Å; T52-A58 PolarHBondContact OG1-N 3.23Å
53	Q	89.3	Confident	92.3	Very high	103 Å²	103	76.8 Å²	76.8	48%	0.481	42%	0.419	S	S	.	.	B	Isolated β-bridge	trans	-138.9	111.3	-174.3	-75.4	-104.4	-26	0	0	108.9	R51 T55 K56	R51-Q53 VanDerWaalsContact O-CG 3.28Å; R51-Q53 WeakPolarHBondContact O-CG 3.28Å; R51-Q53 PolarHBondContact O-N 2.89Å; Q53-T55 PolarHBondContact O-N 3.24Å; Q53-K56 PolarHBondContact N-O 3.39Å; Q53-K56 VanDerWaalsContact N-O 3.12Å; Q53-K56 PolarHBondContact O-N 2.65Å; Q53-K56 VanDerWaalsContact O-N 3.16Å
54	G	91.2	Very high	92.4	Very high	78 Å²	78	72 Å²	72	80%	0.804	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.6	-123.1	-176.1	0	0	0	0	0	111
55	T	92.3	Very high	92.6	Very high	136 Å²	136	74 Å²	74	83%	0.834	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-9.9	-179.4	54.1	0	0	0	0	114.2	Q53 I57	Q53-T55 PolarHBondContact O-N 3.24Å; T55-I57 PolarHBondContact O-N 3.16Å
56	K	90.3	Very high	92.7	Very high	165 Å²	165	74.7 Å²	74.7	72%	0.717	41%	0.411	S	S	*	.	B	Isolated β-bridge	trans	-89	103.9	-179.5	-66.9	-175.5	179.9	-177.4	0	110	T52 Q53	T52-K56 WeakPolarHBondContact CA-O 3.45Å; Q53-K56 PolarHBondContact N-O 3.39Å; Q53-K56 VanDerWaalsContact N-O 3.12Å; Q53-K56 PolarHBondContact O-N 2.65Å; Q53-K56 VanDerWaalsContact O-N 3.16Å
57	I	92.6	Very high	92.7	Very high	83 Å²	83	70 Å²	70	43%	0.426	39%	0.388	S	S	.	.			trans	-83.1	129.2	179.2	-50.8	174.9	0	0	0	109.7	T55 S59 E60 A61	T55-I57 PolarHBondContact O-N 3.16Å; I57-S59 WeakPolarHBondContact CG2-OG 3.37Å; I57-S59 PolarHBondContact O-N 2.97Å; I57-E60 HydrophobicContact CB-CB 4.41Å; I57-E60 PolarHBondContact O-N 3.46Å; I57-E60 VanDerWaalsContact O-N 3.17Å; I57-A61 PolarHBondContact O-N 2.92Å
58	A	90.9	Very high	92.8	Very high	4 Å²	4	73.8 Å²	73.8	3%	0.033	41%	0.405	C	S	.	.	H	α-helix	trans	-55.9	-39.4	178.7	0	0	0	0	0	112.5	V49 N50 T52 E60 A61 L62	V49-A58 HydrophobicContact CG1-CB 3.9Å; N50-A58 WeakPolarHBondContact O-CB 3.4Å; T52-A58 WeakPolarHBondContact OG1-CB 3.38Å; T52-A58 PolarHBondContact OG1-N 3.23Å; A58-E60 VanDerWaalsContact C-N 3.34Å; A58-E60 PolarHBondContact O-N 3.05Å; A58-A61 PolarHBondContact O-N 3.5Å; A58-L62 PolarHBondContact O-N 3.39Å; A58-L62 VanDerWaalsContact O-N 3.17Å
59	S	91.4	Very high	92.7	Very high	40 Å²	40	71.5 Å²	71.5	28%	0.28	39%	0.393	S	S	.	.	H	α-helix	trans	-64.7	-36.2	-179.8	61.8	0	0	0	0	113.1	I57 L62 K63 I91	I57-S59 WeakPolarHBondContact CG2-OG 3.37Å; I57-S59 PolarHBondContact O-N 2.97Å; S59-L62 PolarHBondContact O-N 3.33Å; S59-K63 VanDerWaalsContact O-CG 3.31Å; S59-K63 WeakPolarHBondContact O-CG 3.46Å; S59-K63 PolarHBondContact O-N 3.45Å; S59-K63 VanDerWaalsContact O-N 3.08Å; S59-I91 VanDerWaalsContact CA-CD1 3.4Å; S59-I91 WeakPolarHBondContact O-CD1 3.2Å
60	E	91.5	Very high	92.7	Very high	134 Å²	134	72 Å²	72	63%	0.626	40%	0.397	S	S	*	.	H	α-helix	trans	-70.4	-37.5	178.9	-168.3	177.8	-178	0	0	111.3	I57 A58 L62 K63	I57-E60 HydrophobicContact CB-CB 4.41Å; I57-E60 PolarHBondContact O-N 3.46Å; I57-E60 VanDerWaalsContact O-N 3.17Å; A58-E60 VanDerWaalsContact C-N 3.34Å; A58-E60 PolarHBondContact O-N 3.05Å; E60-L62 VanDerWaalsContact C-N 3.27Å; E60-L62 PolarHBondContact O-N 2.84Å; E60-K63 PolarHBondContact O-N 3.32Å
61	A	91.2	Very high	92.7	Very high	59 Å²	59	67.8 Å²	67.8	49%	0.488	38%	0.375	S	S	.	.	H	α-helix	trans	-71.3	-20.1	177	0	0	0	0	0	114.1	V49 I57 A58 R65	V49-A61 HydrophobicContact CG2-CB 3.93Å; I57-A61 PolarHBondContact O-N 2.92Å; A58-A61 PolarHBondContact O-N 3.5Å; A61-R65 PolarHBondContact O-NE 3.28Å
62	L	92.3	Very high	92.7	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-87	-35.3	175	-83.5	173.2	0	0	0	112.2	Y31 T47 V49 A58 S59 E60 R65 I91	Y31-L62 HydrophobicContact CD1-CD1 3.62Å; Y31-L62 HydrophobicContact CD2-CD1 3.66Å; Y31-L62 HydrophobicContact CE1-CD1 3.86Å; Y31-L62 HydrophobicContact CE2-CD1 3.93Å; Y31-L62 HydrophobicContact CG-CD1 3.53Å; T47-L62 HydrophobicContact CG2-CD2 3.54Å; V49-L62 HydrophobicContact CB-CD1 4.07Å; V49-L62 HydrophobicContact CB-CD2 3.87Å; V49-L62 HydrophobicContact CB-CG 3.71Å; V49-L62 HydrophobicContact CG1-CD1 3.55Å; V49-L62 HydrophobicContact CG1-CD2 4.26Å; V49-L62 HydrophobicContact CG1-CG 3.77Å; V49-L62 HydrophobicContact CG2-CD2 4.46Å; V49-L62 HydrophobicContact CG2-CG 4Å; A58-L62 PolarHBondContact O-N 3.39Å; A58-L62 VanDerWaalsContact O-N 3.17Å; S59-L62 PolarHBondContact O-N 3.33Å; E60-L62 VanDerWaalsContact C-N 3.27Å; E60-L62 PolarHBondContact O-N 2.84Å; L62-R65 WeakPolarHBondContact O-CB 3.48Å; L62-R65 WeakPolarHBondContact O-CG 3.18Å; L62-R65 PolarHBondContact O-N 3.5Å; L62-I91 HydrophobicContact CB-CD1 3.3Å; L62-I91 HydrophobicContact CB-CG1 4.38Å; L62-I91 HydrophobicContact CD1-CD1 3.88Å; L62-I91 HydrophobicContact CG-CD1 4.24Å
63	K	92.8	Very high	92.6	Very high	88 Å²	88	64.9 Å²	64.9	38%	0.383	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	141.4	173.8	-74.9	176.3	-178.9	-178.5	0	110.4	S59 E60 R65 E89 I91	S59-K63 VanDerWaalsContact O-CG 3.31Å; S59-K63 WeakPolarHBondContact O-CG 3.46Å; S59-K63 PolarHBondContact O-N 3.45Å; S59-K63 VanDerWaalsContact O-N 3.08Å; E60-K63 PolarHBondContact O-N 3.32Å; K63-R65 VanDerWaalsContact C-N 3.26Å; K63-R65 PolarHBondContact O-N 3.34Å; K63-E89 WeakPolarHBondContact CE-O 3.42Å; K63-E89 WeakPolarHBondContact CG-O 3.44Å; K63-I91 HydrophobicContact CG-CD1 4.14Å
64	G	92.6	Very high	92.7	Very high	48 Å²	48	60.1 Å²	60.1	50%	0.495	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.2	-7.6	-178.5	0	0	0	0	0	115.1	V66 C88	G64-V66 PolarHBondContact O-N 3.03Å; G64-C88 PolarHBondContact N-O 3.23Å
65	R	95.3	Very high	92.6	Very high	81 Å²	81	57.8 Å²	57.8	31%	0.306	31%	0.312	S	S	.	.			trans	-63.5	136.2	168.9	-68.8	-174.5	-176.7	-169.1	-0.6	110	T47 L48 A61 L62 K63 F67 I87 C88	T47-R65 PolarHBondContact OG1-NH1 2.96Å; L48-R65 PolarHBondContact O-NH1 3.09Å; L48-R65 PolarHBondContact O-NH2 3.48Å; A61-R65 PolarHBondContact O-NE 3.28Å; L62-R65 WeakPolarHBondContact O-CB 3.48Å; L62-R65 WeakPolarHBondContact O-CG 3.18Å; L62-R65 PolarHBondContact O-N 3.5Å; K63-R65 VanDerWaalsContact C-N 3.26Å; K63-R65 PolarHBondContact O-N 3.34Å; R65-F67 HydrophobicContact CB-CE1 4.44Å; R65-F67 HydrophobicContact CB-CE2 4.31Å; R65-F67 HydrophobicContact CB-CZ 3.95Å; R65-I87 CarbonylContact O-C 3.43Å; R65-I87 WeakPolarHBondContact O-CA 3.36Å; R65-C88 PolarHBondContact O-N 3.32Å
66	V	96.1	Very high	92.1	Very high	49 Å²	49	56.4 Å²	56.4	30%	0.297	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	120.3	178	-177.2	0	0	0	0	108.7	G64 R85 L86 I87	G64-V66 PolarHBondContact O-N 3.03Å; V66-R85 HydrophobicContact CG1-CB 3.77Å; V66-R85 HydrophobicContact CG1-CG 4.38Å; V66-L86 CarbonylContact C-O 3.55Å; V66-L86 WeakPolarHBondContact CA-O 3.22Å; V66-I87 HydrophobicContact CG2-CB 4.17Å; V66-I87 HydrophobicContact CG2-CD1 4.18Å; V66-I87 HydrophobicContact CG2-CG1 4.03Å
67	F	95.3	Very high	91.5	Very high	35 Å²	35	52.5 Å²	52.5	15%	0.154	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	130.9	175.3	-53.1	-71.1	0	0	0	108.9	I33 T47 R65 V69 R85 L86 C88 T98	I33-F67 HydrophobicContact CD1-CD1 3.69Å; I33-F67 HydrophobicContact CD1-CD2 4.08Å; I33-F67 HydrophobicContact CD1-CE1 3.5Å; I33-F67 HydrophobicContact CD1-CE2 3.89Å; I33-F67 HydrophobicContact CD1-CG 3.98Å; I33-F67 HydrophobicContact CD1-CZ 3.61Å; I33-F67 HydrophobicContact CG1-CD2 4.49Å; I33-F67 HydrophobicContact CG1-CE1 4.37Å; I33-F67 HydrophobicContact CG1-CE2 4.03Å; I33-F67 HydrophobicContact CG1-CZ 3.97Å; I33-F67 HydrophobicContact CG2-CD2 3.91Å; I33-F67 HydrophobicContact CG2-CE2 4.03Å; T47-F67 HydrophobicContact CG2-CZ 4.07Å; R65-F67 HydrophobicContact CB-CE1 4.44Å; R65-F67 HydrophobicContact CB-CE2 4.31Å; R65-F67 HydrophobicContact CB-CZ 3.95Å; F67-V69 HydrophobicContact CB-CG2 4.37Å; F67-R85 CarbonylContact O-C 3.53Å; F67-R85 VanDerWaalsContact O-CA 3.31Å; F67-R85 WeakPolarHBondContact O-CA 3.35Å; F67-L86 PolarHBondContact N-O 3.36Å; F67-L86 PolarHBondContact O-N 2.99Å; F67-C88 HydrophobicContact CE2-CB 4.14Å; F67-T98 HydrophobicContact CD2-CG2 4.13Å; F67-T98 HydrophobicContact CE2-CG2 4.31Å
68	E	95.6	Very high	90.7	Very high	95 Å²	95	58 Å²	58	44%	0.444	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	120.3	172.5	-172.9	172.9	148.6	0	0	108	K83 F84 R85	E68-K83 HydrophobicContact CG-CB 3.95Å; E68-K83 HydrophobicContact CG-CD 4.33Å; E68-K83 VanDerWaalsContact OE1-CD 3.26Å; E68-K83 WeakPolarHBondContact OE1-CD 3.35Å; E68-K83 WeakPolarHBondContact OE1-CE 3.3Å; E68-K83 IonicContact OE1-NZ 2.73Å; E68-K83 PolarHBondContact OE1-NZ 3.26Å; E68-F84 WeakPolarHBondContact CA-O 3.43Å; E68-R85 HydrophobicContact CG-CG 4.47Å
69	V	94.1	Very high	90.3	Very high	7 Å²	7	58.8 Å²	58.8	4%	0.042	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	142.2	-173	-168	0	0	0	0	108.6	V44 F67 E73 L74 K83 F84 L86	V44-V69 HydrophobicContact CG1-CB 4.39Å; V44-V69 HydrophobicContact CG1-CG1 4.06Å; V44-V69 HydrophobicContact CG1-CG2 3.38Å; F67-V69 HydrophobicContact CB-CG2 4.37Å; V69-E73 HydrophobicContact CG1-CB 4.25Å; V69-E73 WeakPolarHBondContact CG1-OE2 3.49Å; V69-L74 HydrophobicContact CB-CD1 4.16Å; V69-L74 HydrophobicContact CB-CG 4.35Å; V69-L74 HydrophobicContact CG1-CD1 4.14Å; V69-L74 HydrophobicContact CG1-CD2 4.07Å; V69-L74 HydrophobicContact CG1-CG 3.79Å; V69-K83 CarbonylContact O-C 3.49Å; V69-K83 WeakPolarHBondContact O-CA 3.48Å; V69-F84 PolarHBondContact N-O 3.49Å; V69-F84 PolarHBondContact O-N 3.39Å; V69-L86 HydrophobicContact CG2-CD1 4.34Å
70	S	93.8	Very high	90.2	Very high	16 Å²	16	63.2 Å²	63.2	11%	0.112	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	144.3	173.9	-179	0	0	0	0	111	G72 E73 L74 E80	S70-G72 PolarHBondContact O-N 2.85Å; S70-G72 PolarHBondContact OG-N 3.19Å; S70-E73 PolarHBondContact O-N 3.47Å; S70-L74 PolarHBondContact O-N 3.05Å; S70-E80 WeakPolarHBondContact OG-CG 3.49Å; S70-E80 PolarHBondContact OG-O 2.57Å; S70-E80 VanDerWaalsContact OG-O 3.07Å
71	L	92.8	Very high	90.3	Very high	1 Å²	1	58.9 Å²	58.9	1%	0.005	31%	0.313	C	S	.	.	H	α-helix	trans	-64.1	-27.5	171.6	-177.6	59.2	0	0	0	111.7	F39 E73 L74 N75 A79 R82 F84 I189	F39-L71 HydrophobicContact CD1-CD1 4.38Å; F39-L71 HydrophobicContact CE1-CD1 4.27Å; L71-E73 VanDerWaalsContact C-N 3.3Å; L71-E73 PolarHBondContact O-N 3.47Å; L71-L74 HydrophobicContact CD1-CB 4.4Å; L71-L74 PolarHBondContact O-N 2.84Å; L71-N75 HydrophobicContact CD1-CB 4.16Å; L71-N75 PolarHBondContact O-N 3.32Å; L71-A79 HydrophobicContact CD2-CB 3.82Å; L71-R82 HydrophobicContact CB-CB 4Å; L71-R82 WeakPolarHBondContact CB-O 3.17Å; L71-R82 HydrophobicContact CD2-CB 4.14Å; L71-R82 PolarHBondContact N-O 2.86Å; L71-F84 HydrophobicContact CB-CD2 4.18Å; L71-F84 HydrophobicContact CB-CE2 4.05Å; L71-F84 HydrophobicContact CD1-CD2 4.23Å; L71-F84 HydrophobicContact CD1-CE2 3.77Å; L71-F84 HydrophobicContact CD2-CE2 4.12Å; L71-F84 HydrophobicContact CG-CE2 4.19Å; L71-I189 HydrophobicContact CD1-CG1 4.24Å; L71-I189 HydrophobicContact CD1-CG2 4.25Å; L71-I189 HydrophobicContact CD2-CG2 4.35Å
72	G	91.7	Very high	90.5	Very high	16 Å²	16	56.2 Å²	56.2	17%	0.165	29%	0.29	C	S	.	.	H	α-helix	trans	-59.4	-41.1	174.8	0	0	0	0	0	112	S70 N76 D77	S70-G72 PolarHBondContact O-N 2.85Å; S70-G72 PolarHBondContact OG-N 3.19Å; G72-N76 WeakPolarHBondContact O-CA 3.41Å; G72-N76 PolarHBondContact O-N 2.85Å; G72-D77 WeakPolarHBondContact CA-O 3.42Å
73	E	91.1	Very high	90.6	Very high	125 Å²	125	59.1 Å²	59.1	58%	0.584	30%	0.303	S	S	*	.	H	α-helix	trans	-74.5	-30.8	176.6	-64.5	174.5	160.1	0	0	112.5	N41 V69 S70 L71	N41-E73 WeakPolarHBondContact CB-O 3.47Å; N41-E73 PolarHBondContact ND2-O 3.31Å; V69-E73 HydrophobicContact CG1-CB 4.25Å; V69-E73 WeakPolarHBondContact CG1-OE2 3.49Å; S70-E73 PolarHBondContact O-N 3.47Å; L71-E73 VanDerWaalsContact C-N 3.3Å; L71-E73 PolarHBondContact O-N 3.47Å
74	L	91.7	Very high	90.7	Very high	2 Å²	2	54.9 Å²	54.9	1%	0.01	28%	0.284	C	S	.	.	H	α-helix	trans	-80	-30.2	-178.3	-71	170.7	0	0	0	113.6	A35 F39 R40 N41 V44 V69 S70 L71 F84 L86	A35-L74 HydrophobicContact CB-CD2 4.05Å; F39-L74 HydrophobicContact CB-CB 4.18Å; F39-L74 HydrophobicContact CB-CD2 4.3Å; F39-L74 HydrophobicContact CD1-CB 3.79Å; F39-L74 HydrophobicContact CD1-CD1 3.89Å; F39-L74 HydrophobicContact CD1-CG 4.31Å; F39-L74 HydrophobicContact CD2-CD1 4.45Å; F39-L74 HydrophobicContact CD2-CD2 4.47Å; F39-L74 HydrophobicContact CE1-CB 4.48Å; F39-L74 HydrophobicContact CE1-CD1 3.84Å; F39-L74 HydrophobicContact CE2-CD1 4.41Å; F39-L74 HydrophobicContact CG-CB 4.1Å; F39-L74 HydrophobicContact CG-CD1 4.2Å; F39-L74 HydrophobicContact CG-CD2 4.21Å; F39-L74 HydrophobicContact CG-CG 4.41Å; F39-L74 HydrophobicContact CZ-CD1 4.11Å; R40-L74 PolarHBondContact N-O 3.41Å; N41-L74 WeakPolarHBondContact CB-O 3.28Å; N41-L74 PolarHBondContact N-O 2.93Å; V44-L74 HydrophobicContact CG2-CD2 4.05Å; V69-L74 HydrophobicContact CB-CD1 4.16Å; V69-L74 HydrophobicContact CB-CG 4.35Å; V69-L74 HydrophobicContact CG1-CD1 4.14Å; V69-L74 HydrophobicContact CG1-CD2 4.07Å; V69-L74 HydrophobicContact CG1-CG 3.79Å; S70-L74 PolarHBondContact O-N 3.05Å; L71-L74 HydrophobicContact CD1-CB 4.4Å; L71-L74 PolarHBondContact O-N 2.84Å; L74-F84 HydrophobicContact CD1-CB 4.07Å; L74-F84 HydrophobicContact CD1-CD2 4.34Å; L74-F84 HydrophobicContact CD1-CG 4.42Å; L74-L86 HydrophobicContact CD2-CD1 4.44Å
75	N	88.2	Confident	90.9	Very high	30 Å²	30	57.5 Å²	57.5	16%	0.16	28%	0.279	C	S	.	.	H	α-helix	trans	-125.9	-4.1	-174.9	-141	37.1	0	0	0	115.3	R40 L71 D77	R40-N75 VanDerWaalsContact CB-OD1 3.23Å; R40-N75 WeakPolarHBondContact CB-OD1 3.45Å; L71-N75 HydrophobicContact CD1-CB 4.16Å; L71-N75 PolarHBondContact O-N 3.32Å; N75-D77 HydrophobicContact CB-CB 4.45Å; N75-D77 PolarHBondContact ND2-OD2 3.34Å; N75-D77 PolarHBondContact O-N 2.86Å
76	N	82.5	Confident	90.9	Very high	106 Å²	106	53.7 Å²	53.7	57%	0.567	27%	0.265	S	S	*	.	S	Bend	trans	55.6	33.8	-171.7	-58.5	-31.9	0	0	0	113.2	N41 G72	N41-N76 VanDerWaalsContact ND2-CG 3.32Å; N41-N76 PolarHBondContact ND2-ND2 3.25Å; N41-N76 PolarHBondContact ND2-OD1 3.5Å; N41-N76 PolarHBondContact OD1-ND2 3.35Å; G72-N76 WeakPolarHBondContact O-CA 3.41Å; G72-N76 PolarHBondContact O-N 2.85Å
77	D	78.2	Confident	90.8	Very high	84 Å²	84	52.4 Å²	52.4	45%	0.449	26%	0.256	S	S	.	.	S	Bend	trans	-109.9	161.1	-179.6	-77.9	-30.9	0	0	0	112.2	G72 N75 A79	G72-D77 WeakPolarHBondContact CA-O 3.42Å; N75-D77 HydrophobicContact CB-CB 4.45Å; N75-D77 PolarHBondContact ND2-OD2 3.34Å; N75-D77 PolarHBondContact O-N 2.86Å; D77-A79 PolarHBondContact O-N 2.96Å
78	E	76.2	Confident	90.8	Very high	197 Å²	197	50.8 Å²	50.8	92%	0.921	25%	0.249	S	C	*	.	S	Bend	trans	-65.4	-4.9	179.4	-64.6	-175.2	162.3	0	0	115	E80	E78-E80 PolarHBondContact O-N 3.38Å
79	A	82.7	Confident	90.7	Very high	21 Å²	21	47.7 Å²	47.7	17%	0.174	24%	0.235	C	C	.	.			trans	-81.4	39.9	-176.7	0	0	0	0	0	113.8	L71 D77 F81 R82	L71-A79 HydrophobicContact CD2-CB 3.82Å; D77-A79 PolarHBondContact O-N 2.96Å; A79-F81 HydrophobicContact CB-CE1 4.38Å; A79-F81 PolarHBondContact O-N 3.28Å; A79-F81 VanDerWaalsContact O-N 3.1Å; A79-R82 PolarHBondContact O-N 3.47Å; A79-R82 VanDerWaalsContact O-N 3.13Å
80	E	89	Confident	90.7	Very high	134 Å²	134	50.6 Å²	50.6	63%	0.626	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61	-22.8	-174.9	-160.7	-176.9	173	0	0	113.6	S70 E78 R82	S70-E80 WeakPolarHBondContact OG-CG 3.49Å; S70-E80 PolarHBondContact OG-O 2.57Å; S70-E80 VanDerWaalsContact OG-O 3.07Å; E78-E80 PolarHBondContact O-N 3.38Å; E80-R82 PolarHBondContact O-N 3.04Å; E80-R82 VanDerWaalsContact O-N 3.12Å
81	F	93.1	Very high	90.7	Very high	42 Å²	42	50.6 Å²	50.6	18%	0.184	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-8.3	177.9	62.3	-95.5	0	0	0	114.4	A79 F105 T106 K109	A79-F81 HydrophobicContact CB-CE1 4.38Å; A79-F81 PolarHBondContact O-N 3.28Å; A79-F81 VanDerWaalsContact O-N 3.1Å; F81-F105 AromaticContact CD2-CD1 3.95Å; F81-F105 HydrophobicContact CD2-CD1 3.95Å; F81-F105 AromaticContact CD2-CE1 3.56Å; F81-F105 HydrophobicContact CD2-CE1 3.56Å; F81-F105 HydrophobicContact CD2-CE2 4.27Å; F81-F105 HydrophobicContact CD2-CG 4.47Å; F81-F105 AromaticContact CD2-CZ 3.74Å; F81-F105 HydrophobicContact CD2-CZ 3.74Å; F81-F105 HydrophobicContact CE2-CD1 4.43Å; F81-F105 AromaticContact CE2-CE1 3.6Å; F81-F105 HydrophobicContact CE2-CE1 3.6Å; F81-F105 HydrophobicContact CE2-CE2 4.13Å; F81-F105 AromaticContact CE2-CZ 3.41Å; F81-F105 HydrophobicContact CE2-CZ 3.41Å; F81-F105 VanDerWaalsContact CE2-CZ 3.41Å; F81-F105 CarbonylContact O-C 3.57Å; F81-F105 WeakPolarHBondContact O-CA 3.47Å; F81-T106 WeakPolarHBondContact O-CG2 3.16Å; F81-T106 PolarHBondContact O-N 3.04Å; F81-K109 HydrophobicContact CB-CB 3.56Å; F81-K109 HydrophobicContact CB-CD 4.28Å; F81-K109 HydrophobicContact CB-CG 3.69Å; F81-K109 HydrophobicContact CD1-CD 4.32Å; F81-K109 HydrophobicContact CD1-CG 4.37Å; F81-K109 HydrophobicContact CD2-CG 3.84Å; F81-K109 HydrophobicContact CG-CB 4.18Å; F81-K109 HydrophobicContact CG-CD 4.15Å; F81-K109 HydrophobicContact CG-CG 3.71Å
82	R	94.3	Very high	90.6	Very high	4 Å²	4	55.1 Å²	55.1	2%	0.015	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	127.9	175.4	-63.7	-175.9	-176.5	-117.3	-16.4	109.9	L71 A79 E80 F84 F105 L188 D191 F211	L71-R82 HydrophobicContact CB-CB 4Å; L71-R82 WeakPolarHBondContact CB-O 3.17Å; L71-R82 HydrophobicContact CD2-CB 4.14Å; L71-R82 PolarHBondContact N-O 2.86Å; A79-R82 PolarHBondContact O-N 3.47Å; A79-R82 VanDerWaalsContact O-N 3.13Å; E80-R82 PolarHBondContact O-N 3.04Å; E80-R82 VanDerWaalsContact O-N 3.12Å; R82-F84 HydrophobicContact CB-CE2 4.46Å; R82-F105 HydrophobicContact CG-CE2 4.14Å; R82-L188 PolarHBondContact NH1-O 3.04Å; R82-D191 VanDerWaalsContact CZ-CB 3.45Å; R82-D191 VanDerWaalsContact CZ-CG 3.44Å; R82-D191 IonicContact CZ-OD1 3.59Å; R82-D191 IonicContact CZ-OD2 3.78Å; R82-D191 VanDerWaalsContact NH1-CB 3.32Å; R82-D191 IonicContact NH1-OD1 3.59Å; R82-D191 PolarHBondContact NH1-OD1 3.08Å; R82-D191 IonicContact NH1-OD2 2.73Å; R82-D191 IonicContact NH2-OD1 3.92Å; R82-D191 IonicContact NH2-OD2 2.83Å; R82-D191 PolarHBondContact NH2-OD2 2.71Å; R82-F211 VanDerWaalsContact NH2-CD1 3.26Å
83	K	95.2	Very high	90.6	Very high	60 Å²	60	57.5 Å²	57.5	26%	0.261	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	125.1	177.9	-62.4	-169.2	-76.3	165.7	0	110.4	E68 V69 M103 N104 T106	E68-K83 HydrophobicContact CG-CB 3.95Å; E68-K83 HydrophobicContact CG-CD 4.33Å; E68-K83 VanDerWaalsContact OE1-CD 3.26Å; E68-K83 WeakPolarHBondContact OE1-CD 3.35Å; E68-K83 WeakPolarHBondContact OE1-CE 3.3Å; E68-K83 IonicContact OE1-NZ 2.73Å; E68-K83 PolarHBondContact OE1-NZ 3.26Å; V69-K83 CarbonylContact O-C 3.49Å; V69-K83 WeakPolarHBondContact O-CA 3.48Å; K83-M103 CarbonylContact O-C 3.53Å; K83-M103 WeakPolarHBondContact O-CA 3.48Å; K83-N104 PolarHBondContact N-O 3.02Å; K83-N104 PolarHBondContact O-N 2.91Å; K83-T106 HydrophobicContact CD-CG2 3.81Å; K83-T106 HydrophobicContact CG-CG2 3.93Å
84	F	95.3	Very high	90.6	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	136.3	176.8	-77.9	-91.5	0	0	0	109.9	F39 E68 V69 L71 L74 R82 F100 M103 V185 I189	F39-F84 HydrophobicContact CE1-CD1 4.28Å; F39-F84 HydrophobicContact CE1-CD2 4.23Å; F39-F84 HydrophobicContact CE1-CE1 4.35Å; F39-F84 HydrophobicContact CE1-CE2 4.31Å; F39-F84 HydrophobicContact CE1-CG 4.23Å; F39-F84 HydrophobicContact CE1-CZ 4.36Å; F39-F84 HydrophobicContact CZ-CB 4.49Å; F39-F84 AromaticContact CZ-CD1 3.81Å; F39-F84 HydrophobicContact CZ-CD1 3.81Å; F39-F84 HydrophobicContact CZ-CD2 4.46Å; F39-F84 HydrophobicContact CZ-CE1 4.14Å; F39-F84 AromaticContact CZ-CG 3.99Å; F39-F84 HydrophobicContact CZ-CG 3.99Å; E68-F84 WeakPolarHBondContact CA-O 3.43Å; V69-F84 PolarHBondContact N-O 3.49Å; V69-F84 PolarHBondContact O-N 3.39Å; L71-F84 HydrophobicContact CB-CD2 4.18Å; L71-F84 HydrophobicContact CB-CE2 4.05Å; L71-F84 HydrophobicContact CD1-CD2 4.23Å; L71-F84 HydrophobicContact CD1-CE2 3.77Å; L71-F84 HydrophobicContact CD2-CE2 4.12Å; L71-F84 HydrophobicContact CG-CE2 4.19Å; L74-F84 HydrophobicContact CD1-CB 4.07Å; L74-F84 HydrophobicContact CD1-CD2 4.34Å; L74-F84 HydrophobicContact CD1-CG 4.42Å; R82-F84 HydrophobicContact CB-CE2 4.46Å; F84-F100 AromaticContact CD1-CD2 3.79Å; F84-F100 HydrophobicContact CD1-CD2 3.79Å; F84-F100 AromaticContact CD1-CE2 3.55Å; F84-F100 HydrophobicContact CD1-CE2 3.55Å; F84-F100 HydrophobicContact CE1-CD2 4.17Å; F84-F100 AromaticContact CE1-CE2 3.71Å; F84-F100 HydrophobicContact CE1-CE2 3.71Å; F84-M103 HydrophobicContact CE1-CB 4.38Å; F84-M103 HydrophobicContact CE1-CG 4.19Å; F84-M103 HydrophobicContact CE1-SD 4.29Å; F84-M103 HydrophobicContact CE2-CG 4.46Å; F84-M103 HydrophobicContact CE2-SD 4.48Å; F84-M103 HydrophobicContact CZ-CG 4.17Å; F84-M103 HydrophobicContact CZ-SD 3.93Å; F84-V185 HydrophobicContact CE1-CG1 3.98Å; F84-I189 HydrophobicContact CZ-CG1 4.36Å
85	R	96	Very high	90.7	Very high	103 Å²	103	56.2 Å²	56.2	39%	0.389	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	115.4	171.5	-62.8	-173.5	82.2	-161.4	5.4	107.7	V66 F67 E68 H101 G102	V66-R85 HydrophobicContact CG1-CB 3.77Å; V66-R85 HydrophobicContact CG1-CG 4.38Å; F67-R85 CarbonylContact O-C 3.53Å; F67-R85 VanDerWaalsContact O-CA 3.31Å; F67-R85 WeakPolarHBondContact O-CA 3.35Å; E68-R85 HydrophobicContact CG-CG 4.47Å; R85-H101 HydrophobicContact CB-CB 4.18Å; R85-H101 WeakPolarHBondContact O-CA 3.35Å; R85-H101 VanDerWaalsContact O-CB 3.31Å; R85-H101 WeakPolarHBondContact O-CB 3.48Å; R85-H101 PolarHBondContact O-N 3.5Å; R85-G102 PolarHBondContact N-O 2.83Å; R85-G102 PolarHBondContact O-N 2.95Å
86	L	95.7	Very high	91	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	120.9	179.6	-61.7	179.5	0	0	0	109	A35 F39 V44 V66 F67 V69 L74 T98 N99	A35-L86 HydrophobicContact CB-CD1 4.15Å; F39-L86 HydrophobicContact CE2-CD2 4.01Å; V44-L86 HydrophobicContact CG2-CD1 4.25Å; V66-L86 CarbonylContact C-O 3.55Å; V66-L86 WeakPolarHBondContact CA-O 3.22Å; F67-L86 PolarHBondContact N-O 3.36Å; F67-L86 PolarHBondContact O-N 2.99Å; V69-L86 HydrophobicContact CG2-CD1 4.34Å; L74-L86 HydrophobicContact CD2-CD1 4.44Å; L86-T98 HydrophobicContact CB-CG2 4.44Å; L86-N99 CarbonylContact C-O 3.53Å; L86-N99 VanDerWaalsContact CA-O 3.32Å; L86-N99 WeakPolarHBondContact CA-O 3.43Å
87	I	95.3	Very high	91.6	Very high	23 Å²	23	49.9 Å²	49.9	12%	0.118	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	132.4	179.3	-171.9	169.4	0	0	0	110.5	R65 V66 E89 T98 N99 H101	R65-I87 CarbonylContact O-C 3.43Å; R65-I87 WeakPolarHBondContact O-CA 3.36Å; V66-I87 HydrophobicContact CG2-CB 4.17Å; V66-I87 HydrophobicContact CG2-CD1 4.18Å; V66-I87 HydrophobicContact CG2-CG1 4.03Å; I87-E89 HydrophobicContact CG2-CG 4Å; I87-E89 PolarHBondContact O-N 3.47Å; I87-T98 CarbonylContact O-C 3.57Å; I87-T98 WeakPolarHBondContact O-CA 3.46Å; I87-N99 HydrophobicContact CG2-CB 4.22Å; I87-N99 WeakPolarHBondContact CG2-O 3.43Å; I87-N99 PolarHBondContact N-O 3.44Å; I87-N99 PolarHBondContact O-N 2.7Å; I87-H101 HydrophobicContact CB-CB 4.01Å; I87-H101 HydrophobicContact CG2-CB 3.96Å
88	C	94.7	Very high	92.4	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.007	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	116.6	171.1	-174.2	0	0	0	0	109.7	G64 R65 F67	G64-C88 PolarHBondContact N-O 3.23Å; R65-C88 PolarHBondContact O-N 3.32Å; F67-C88 HydrophobicContact CE2-CB 4.14Å
89	E	93.6	Very high	93.3	Very high	30 Å²	30	36.5 Å²	36.5	14%	0.14	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	-35.1	178.8	-67.6	-169.6	163.6	0	0	112.1	K63 I87 L97 N99 K220 F223 L228	K63-E89 WeakPolarHBondContact CE-O 3.42Å; K63-E89 WeakPolarHBondContact CG-O 3.44Å; I87-E89 HydrophobicContact CG2-CG 4Å; I87-E89 PolarHBondContact O-N 3.47Å; E89-L97 PolarHBondContact N-O 3.4Å; E89-L97 VanDerWaalsContact N-O 3.1Å; E89-N99 VanDerWaalsContact CD-CB 3.5Å; E89-N99 VanDerWaalsContact CD-ND2 3.34Å; E89-N99 HydrophobicContact CG-CB 4.02Å; E89-N99 PolarHBondContact OE1-ND2 2.69Å; E89-N99 WeakPolarHBondContact OE2-CB 3.38Å; E89-N99 PolarHBondContact OE2-ND2 3.06Å; E89-K220 IonicContact OE1-NZ 2.74Å; E89-K220 PolarHBondContact OE1-NZ 2.92Å; E89-F223 HydrophobicContact CB-CD2 4.32Å; E89-F223 HydrophobicContact CB-CE2 3.85Å; E89-L228 HydrophobicContact CB-CD2 4.15Å
90	Y	94.3	Very high	93.8	Very high	67 Å²	67	35.5 Å²	35.5	26%	0.263	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	152.5	-178.7	-168.7	-102.3	0	0	0	111.7	Q92 L97 F223 L225 L228 M229	Y90-Q92 HydrophobicContact CD1-CB 4.34Å; Y90-Q92 HydrophobicContact CE1-CB 4.09Å; Y90-L97 HydrophobicContact CD1-CD1 4.08Å; Y90-L97 PolarHBondContact N-O 3.46Å; Y90-L97 PolarHBondContact O-N 3.3Å; Y90-F223 HydrophobicContact CD2-CZ 4.32Å; Y90-L225 HydrophobicContact CD1-CD1 3.79Å; Y90-L225 HydrophobicContact CD2-CD1 3.58Å; Y90-L225 HydrophobicContact CE1-CD1 3.98Å; Y90-L225 HydrophobicContact CE2-CD1 3.79Å; Y90-L225 HydrophobicContact CE2-CD2 4.31Å; Y90-L225 HydrophobicContact CG-CD1 3.57Å; Y90-L228 VanDerWaalsContact CB-CD2 3.4Å; Y90-L228 HydrophobicContact CG-CD2 4.49Å; Y90-M229 HydrophobicContact CD1-CE 3.97Å; Y90-M229 HydrophobicContact CE1-CE 3.92Å
91	I	93.2	Very high	94.1	Very high	17 Å²	17	31.4 Å²	31.4	9%	0.087	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	123.3	178.9	-64.8	158	0	0	0	107.1	Y31 S59 L62 K63 G93 V95	Y31-I91 HydrophobicContact CD1-CG2 3.91Å; Y31-I91 HydrophobicContact CE1-CG2 3.68Å; S59-I91 VanDerWaalsContact CA-CD1 3.4Å; S59-I91 WeakPolarHBondContact O-CD1 3.2Å; L62-I91 HydrophobicContact CB-CD1 3.3Å; L62-I91 HydrophobicContact CB-CG1 4.38Å; L62-I91 HydrophobicContact CD1-CD1 3.88Å; L62-I91 HydrophobicContact CG-CD1 4.24Å; K63-I91 HydrophobicContact CG-CD1 4.14Å; I91-G93 VanDerWaalsContact CG2-O 3.32Å; I91-G93 WeakPolarHBondContact CG2-O 3.39Å; I91-V95 CarbonylContact C-O 3.48Å; I91-V95 VanDerWaalsContact CA-O 3.31Å; I91-V95 WeakPolarHBondContact CA-O 3.12Å
92	Q	91.7	Very high	94.2	Very high	95 Å²	95	29.6 Å²	29.6	44%	0.444	16%	0.16	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	102	179.1	-177.8	178.6	-9.7	0	0	108	Y90 S94 V95	Y90-Q92 HydrophobicContact CD1-CB 4.34Å; Y90-Q92 HydrophobicContact CE1-CB 4.09Å; Q92-S94 PolarHBondContact O-N 3.1Å; Q92-V95 PolarHBondContact N-O 2.92Å; Q92-V95 WeakPolarHBondContact O-CB 3.46Å; Q92-V95 PolarHBondContact O-N 3.05Å
93	G	89.9	Confident	94.3	Very high	66 Å²	66	29.4 Å²	29.4	68%	0.68	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.4	-120.6	-172.3	0	0	0	0	0	110.7	Y31 I91	Y31-G93 VanDerWaalsContact CE1-O 3.28Å; Y31-G93 WeakPolarHBondContact CE1-O 3.49Å; I91-G93 VanDerWaalsContact CG2-O 3.32Å; I91-G93 WeakPolarHBondContact CG2-O 3.39Å
94	S	91.5	Very high	94.3	Very high	75 Å²	75	28.8 Å²	28.8	52%	0.524	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.5	9.5	176.3	56.6	0	0	0	0	114.2	Y31 S32 Q92	Y31-S94 CarbonylContact C-O 3.58Å; Y31-S94 WeakPolarHBondContact CA-O 3.37Å; Y31-S94 WeakPolarHBondContact CB-O 3.45Å; S32-S94 PolarHBondContact N-O 3.28Å; Q92-S94 PolarHBondContact O-N 3.1Å
95	V	94	Very high	94.3	Very high	25 Å²	25	29.2 Å²	29.2	15%	0.152	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	125.9	-175.4	-179.5	0	0	0	0	111.2	S32 K34 I91 Q92 L97	S32-V95 CarbonylContact O-C 3.52Å; S32-V95 WeakPolarHBondContact O-CA 3.32Å; K34-V95 HydrophobicContact CB-CG1 4.03Å; K34-V95 HydrophobicContact CD-CG1 3.53Å; K34-V95 HydrophobicContact CG-CG1 3.6Å; I91-V95 CarbonylContact C-O 3.48Å; I91-V95 VanDerWaalsContact CA-O 3.31Å; I91-V95 WeakPolarHBondContact CA-O 3.12Å; Q92-V95 PolarHBondContact N-O 2.92Å; Q92-V95 WeakPolarHBondContact O-CB 3.46Å; Q92-V95 PolarHBondContact O-N 3.05Å; V95-L97 HydrophobicContact CG1-CD2 4.19Å
96	C	94.2	Very high	94.3	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	113.7	171.7	-67.8	0	0	0	0	109.9	S32 K34	S32-C96 PolarHBondContact O-N 3.42Å; K34-C96 PolarHBondContact N-O 3.38Å
97	L	95.1	Very high	94.2	Very high	4 Å²	4	34.9 Å²	34.9	2%	0.021	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	122.6	172.5	-64	-173.2	0	0	0	109.7	K34 E89 Y90 V95 L228 M229 H232	K34-L97 HydrophobicContact CB-CD2 4.4Å; E89-L97 PolarHBondContact N-O 3.4Å; E89-L97 VanDerWaalsContact N-O 3.1Å; Y90-L97 HydrophobicContact CD1-CD1 4.08Å; Y90-L97 PolarHBondContact N-O 3.46Å; Y90-L97 PolarHBondContact O-N 3.3Å; V95-L97 HydrophobicContact CG1-CD2 4.19Å; L97-L228 HydrophobicContact CB-CD2 4.05Å; L97-L228 HydrophobicContact CD1-CD2 4.46Å; L97-M229 HydrophobicContact CD1-CE 3.69Å; L97-M229 HydrophobicContact CD1-SD 3.78Å; L97-H232 WeakPolarHBondContact CB-NE2 3.44Å
98	T	95.5	Very high	94.2	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	146.8	-175.7	65.9	0	0	0	0	113.1	I33 K34 P36 F67 L86 I87 H232	I33-T98 HydrophobicContact CG2-CG2 3.56Å; K34-T98 PolarHBondContact O-N 3.26Å; K34-T98 PolarHBondContact O-OG1 2.79Å; P36-T98 WeakPolarHBondContact CD-O 3.39Å; P36-T98 WeakPolarHBondContact CG-O 3.36Å; F67-T98 HydrophobicContact CD2-CG2 4.13Å; F67-T98 HydrophobicContact CE2-CG2 4.31Å; L86-T98 HydrophobicContact CB-CG2 4.44Å; I87-T98 CarbonylContact O-C 3.57Å; I87-T98 WeakPolarHBondContact O-CA 3.46Å; T98-H232 PolarHBondContact N-NE2 3.27Å; T98-H232 PolarHBondContact O-CE1 3.29Å; T98-H232 VanDerWaalsContact O-CE1 3.29Å; T98-H232 PolarHBondContact O-NE2 2.61Å
99	N	94.4	Very high	94.2	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	158.9	176.5	-169.8	3.4	0	0	0	110.2	L86 I87 E89 H101 Y133 L228 M231	L86-N99 CarbonylContact C-O 3.53Å; L86-N99 VanDerWaalsContact CA-O 3.32Å; L86-N99 WeakPolarHBondContact CA-O 3.43Å; I87-N99 HydrophobicContact CG2-CB 4.22Å; I87-N99 WeakPolarHBondContact CG2-O 3.43Å; I87-N99 PolarHBondContact N-O 3.44Å; I87-N99 PolarHBondContact O-N 2.7Å; E89-N99 VanDerWaalsContact CD-CB 3.5Å; E89-N99 VanDerWaalsContact CD-ND2 3.34Å; E89-N99 HydrophobicContact CG-CB 4.02Å; E89-N99 PolarHBondContact OE1-ND2 2.69Å; E89-N99 WeakPolarHBondContact OE2-CB 3.38Å; E89-N99 PolarHBondContact OE2-ND2 3.06Å; N99-H101 PolarHBondContact O-N 2.67Å; N99-Y133 PolarHBondContact ND2-OH 3.18Å; N99-L228 HydrophobicContact CB-CD1 4.11Å; N99-M231 HydrophobicContact CB-CE 4.33Å; N99-M231 VanDerWaalsContact CG-CE 3.43Å; N99-M231 WeakPolarHBondContact OD1-CE 3.29Å
100	F	94.7	Very high	94.3	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	129.6	174.8	177.1	-94.9	0	0	0	111.4	F84 G102 M103 L181 V185 L188 V215 V217	F84-F100 AromaticContact CD1-CD2 3.79Å; F84-F100 HydrophobicContact CD1-CD2 3.79Å; F84-F100 AromaticContact CD1-CE2 3.55Å; F84-F100 HydrophobicContact CD1-CE2 3.55Å; F84-F100 HydrophobicContact CE1-CD2 4.17Å; F84-F100 AromaticContact CE1-CE2 3.71Å; F84-F100 HydrophobicContact CE1-CE2 3.71Å; F100-G102 VanDerWaalsContact CE2-C 3.45Å; F100-G102 VanDerWaalsContact CE2-O 3.31Å; F100-G102 WeakPolarHBondContact CE2-O 3.33Å; F100-G102 VanDerWaalsContact CZ-C 3.46Å; F100-M103 HydrophobicContact CE2-CB 4.24Å; F100-M103 HydrophobicContact CZ-CB 4.27Å; F100-L181 HydrophobicContact CB-CD2 4.31Å; F100-L181 HydrophobicContact CD1-CD1 3.86Å; F100-L181 HydrophobicContact CD1-CD2 4.49Å; F100-L181 HydrophobicContact CD1-CG 4.46Å; F100-L181 HydrophobicContact CE1-CD1 4.36Å; F100-V185 HydrophobicContact CB-CG2 4.04Å; F100-V185 HydrophobicContact CD1-CG2 4.14Å; F100-V185 HydrophobicContact CD2-CG2 3.69Å; F100-V185 HydrophobicContact CE2-CG2 4.11Å; F100-V185 HydrophobicContact CG-CG2 3.69Å; F100-V185 HydrophobicContact CZ-CG2 4.48Å; F100-L188 HydrophobicContact CZ-CD1 4.14Å; F100-V215 HydrophobicContact CE1-CG1 4.07Å; F100-V215 HydrophobicContact CZ-CB 4.19Å; F100-V215 HydrophobicContact CZ-CG1 3.99Å; F100-V217 HydrophobicContact CD1-CG2 4.17Å; F100-V217 HydrophobicContact CE1-CG2 4.19Å
101	H	94.9	Very high	94.3	Very high	48 Å²	48	43 Å²	43	22%	0.222	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	-24.9	176.6	-171.3	49.5	0	0	0	113.1	R85 I87 N99 V217	R85-H101 HydrophobicContact CB-CB 4.18Å; R85-H101 WeakPolarHBondContact O-CA 3.35Å; R85-H101 VanDerWaalsContact O-CB 3.31Å; R85-H101 WeakPolarHBondContact O-CB 3.48Å; R85-H101 PolarHBondContact O-N 3.5Å; I87-H101 HydrophobicContact CB-CB 4.01Å; I87-H101 HydrophobicContact CG2-CB 3.96Å; N99-H101 PolarHBondContact O-N 2.67Å; H101-V217 WeakPolarHBondContact O-CB 3.47Å; H101-V217 WeakPolarHBondContact O-CG2 3.42Å; H101-V217 PolarHBondContact O-N 2.75Å
102	G	95.6	Very high	94.4	Very high	3 Å²	3	45.6 Å²	45.6	3%	0.031	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	170.3	175.1	177.2	0	0	0	0	0	112.8	R85 F100 V215	R85-G102 PolarHBondContact N-O 2.83Å; R85-G102 PolarHBondContact O-N 2.95Å; F100-G102 VanDerWaalsContact CE2-C 3.45Å; F100-G102 VanDerWaalsContact CE2-O 3.31Å; F100-G102 WeakPolarHBondContact CE2-O 3.33Å; F100-G102 VanDerWaalsContact CZ-C 3.46Å; G102-V215 CarbonylContact C-O 3.59Å; G102-V215 WeakPolarHBondContact CA-O 3.25Å
103	M	95.9	Very high	94.5	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.005	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	144.1	177.1	-172.4	-173.6	68.7	0	0	108.7	K83 F84 F100 L188 I212 K214 V215	K83-M103 CarbonylContact O-C 3.53Å; K83-M103 WeakPolarHBondContact O-CA 3.48Å; F84-M103 HydrophobicContact CE1-CB 4.38Å; F84-M103 HydrophobicContact CE1-CG 4.19Å; F84-M103 HydrophobicContact CE1-SD 4.29Å; F84-M103 HydrophobicContact CE2-CG 4.46Å; F84-M103 HydrophobicContact CE2-SD 4.48Å; F84-M103 HydrophobicContact CZ-CG 4.17Å; F84-M103 HydrophobicContact CZ-SD 3.93Å; F100-M103 HydrophobicContact CE2-CB 4.24Å; F100-M103 HydrophobicContact CZ-CB 4.27Å; M103-L188 HydrophobicContact CE-CD2 4.07Å; M103-L188 HydrophobicContact SD-CB 4.2Å; M103-L188 HydrophobicContact SD-CD2 4.44Å; M103-I212 HydrophobicContact CE-CB 3.88Å; M103-I212 HydrophobicContact CE-CG2 3.56Å; M103-I212 WeakPolarHBondContact CE-O 3.39Å; M103-K214 CarbonylContact O-C 3.52Å; M103-K214 VanDerWaalsContact O-CA 3.32Å; M103-K214 WeakPolarHBondContact O-CA 3.28Å; M103-K214 WeakPolarHBondContact O-CG 3.32Å; M103-V215 HydrophobicContact CB-CB 4.06Å; M103-V215 HydrophobicContact CB-CG2 4.22Å; M103-V215 HydrophobicContact CE-CG2 3.97Å; M103-V215 PolarHBondContact N-O 2.94Å; M103-V215 PolarHBondContact O-N 3.22Å
104	N	95.8	Very high	94.8	Very high	47 Å²	47	41.9 Å²	41.9	25%	0.251	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	150.9	174.6	-160.5	22.3	0	0	0	110.8	K83	K83-N104 PolarHBondContact N-O 3.02Å; K83-N104 PolarHBondContact O-N 2.91Å
105	F	94.4	Very high	95	Very high	8 Å²	8	44.3 Å²	44.3	4%	0.035	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	152.4	168.8	-94.4	-130.9	0	0	0	111.4	F81 R82 K109 L113 F211 I212 R213	F81-F105 AromaticContact CD2-CD1 3.95Å; F81-F105 HydrophobicContact CD2-CD1 3.95Å; F81-F105 AromaticContact CD2-CE1 3.56Å; F81-F105 HydrophobicContact CD2-CE1 3.56Å; F81-F105 HydrophobicContact CD2-CE2 4.27Å; F81-F105 HydrophobicContact CD2-CG 4.47Å; F81-F105 AromaticContact CD2-CZ 3.74Å; F81-F105 HydrophobicContact CD2-CZ 3.74Å; F81-F105 HydrophobicContact CE2-CD1 4.43Å; F81-F105 AromaticContact CE2-CE1 3.6Å; F81-F105 HydrophobicContact CE2-CE1 3.6Å; F81-F105 HydrophobicContact CE2-CE2 4.13Å; F81-F105 AromaticContact CE2-CZ 3.41Å; F81-F105 HydrophobicContact CE2-CZ 3.41Å; F81-F105 VanDerWaalsContact CE2-CZ 3.41Å; F81-F105 CarbonylContact O-C 3.57Å; F81-F105 WeakPolarHBondContact O-CA 3.47Å; R82-F105 HydrophobicContact CG-CE2 4.14Å; F105-K109 HydrophobicContact CD1-CB 4.43Å; F105-K109 HydrophobicContact CD1-CG 4.02Å; F105-K109 HydrophobicContact CE1-CG 4.09Å; F105-L113 HydrophobicContact CE1-CD1 4.34Å; F105-F211 HydrophobicContact CE1-CB 4.12Å; F105-F211 HydrophobicContact CE1-CD2 4.13Å; F105-F211 HydrophobicContact CE1-CG 4.09Å; F105-F211 HydrophobicContact CE2-CB 4.2Å; F105-F211 HydrophobicContact CZ-CB 3.48Å; F105-F211 VanDerWaalsContact CZ-CB 3.48Å; F105-F211 HydrophobicContact CZ-CD1 4.1Å; F105-F211 HydrophobicContact CZ-CD2 4.18Å; F105-F211 AromaticContact CZ-CG 3.66Å; F105-F211 HydrophobicContact CZ-CG 3.66Å; F105-I212 WeakPolarHBondContact CE2-O 3.46Å; F105-R213 WeakPolarHBondContact CD2-O 3.37Å; F105-R213 PolarHBondContact N-O 3.41Å; F105-R213 VanDerWaalsContact N-O 3.15Å
106	T	96.1	Very high	95.1	Very high	17 Å²	17	51.6 Å²	51.6	10%	0.104	26%	0.255	C	S	.	.			trans	-66.8	151.5	163.5	66.1	0	0	0	0	110.5	F81 K83 D108 K109 L110	F81-T106 WeakPolarHBondContact O-CG2 3.16Å; F81-T106 PolarHBondContact O-N 3.04Å; K83-T106 HydrophobicContact CD-CG2 3.81Å; K83-T106 HydrophobicContact CG-CG2 3.93Å; T106-D108 WeakPolarHBondContact CB-OD1 3.34Å; T106-D108 PolarHBondContact OG1-OD1 3.25Å; T106-D108 PolarHBondContact OG1-OD2 3.09Å; T106-K109 WeakPolarHBondContact OG1-CB 3.48Å; T106-L110 PolarHBondContact O-N 3.06Å
107	R	94.5	Very high	95.2	Very high	205 Å²	205	57.3 Å²	57.3	77%	0.774	28%	0.277	S	S	*	.	H	α-helix	trans	-70.6	-41.7	-174.2	176.8	178.3	166.7	163	-3.5	111.3	L110 C111	R107-L110 PolarHBondContact O-N 2.85Å; R107-C111 WeakPolarHBondContact O-CB 3.32Å; R107-C111 PolarHBondContact O-N 3.47Å; R107-C111 PolarHBondContact O-SG 3.06Å
108	D	95	Very high	95.2	Very high	109 Å²	109	58.5 Å²	58.5	58%	0.583	28%	0.282	S	S	*	.	H	α-helix	trans	-53.7	-51.6	174.8	51	-69	0	0	0	111.4	T106 L110 C111 S112	T106-D108 WeakPolarHBondContact CB-OD1 3.34Å; T106-D108 PolarHBondContact OG1-OD1 3.25Å; T106-D108 PolarHBondContact OG1-OD2 3.09Å; D108-L110 PolarHBondContact O-N 2.52Å; D108-C111 PolarHBondContact O-N 2.78Å; D108-S112 WeakPolarHBondContact O-CB 3.43Å; D108-S112 PolarHBondContact O-N 2.93Å
109	K	94.4	Very high	95.3	Very high	59 Å²	59	59.6 Å²	59.6	26%	0.257	29%	0.289	S	S	.	.	H	α-helix	trans	-62.2	-46.6	177.4	-173.9	65.5	173.1	-179.1	0	111.9	F81 F105 T106 C111 S112 L113	F81-K109 HydrophobicContact CB-CB 3.56Å; F81-K109 HydrophobicContact CB-CD 4.28Å; F81-K109 HydrophobicContact CB-CG 3.69Å; F81-K109 HydrophobicContact CD1-CD 4.32Å; F81-K109 HydrophobicContact CD1-CG 4.37Å; F81-K109 HydrophobicContact CD2-CG 3.84Å; F81-K109 HydrophobicContact CG-CB 4.18Å; F81-K109 HydrophobicContact CG-CD 4.15Å; F81-K109 HydrophobicContact CG-CG 3.71Å; F105-K109 HydrophobicContact CD1-CB 4.43Å; F105-K109 HydrophobicContact CD1-CG 4.02Å; F105-K109 HydrophobicContact CE1-CG 4.09Å; T106-K109 WeakPolarHBondContact OG1-CB 3.48Å; K109-C111 VanDerWaalsContact C-N 3.35Å; K109-C111 PolarHBondContact O-N 2.8Å; K109-S112 WeakPolarHBondContact O-CB 3.43Å; K109-S112 PolarHBondContact O-N 3.15Å; K109-L113 HydrophobicContact CG-CD1 4.42Å; K109-L113 VanDerWaalsContact O-CG 3.31Å; K109-L113 WeakPolarHBondContact O-CG 3.16Å; K109-L113 PolarHBondContact O-N 2.89Å
110	L	94.8	Very high	95.5	Very high	52 Å²	52	62.7 Å²	62.7	27%	0.272	31%	0.305	S	S	.	.	H	α-helix	trans	-58.3	-47.5	178.5	-171.4	160	0	0	0	111.2	T106 R107 D108 S112 L113 R213	T106-L110 PolarHBondContact O-N 3.06Å; R107-L110 PolarHBondContact O-N 2.85Å; D108-L110 PolarHBondContact O-N 2.52Å; L110-S112 VanDerWaalsContact C-N 3.3Å; L110-S112 PolarHBondContact O-N 3.36Å; L110-L113 PolarHBondContact O-N 2.81Å; L110-R213 HydrophobicContact CD1-CG 4.08Å
111	C	94.7	Very high	95.6	Very high	72 Å²	72	62.7 Å²	62.7	49%	0.486	31%	0.305	S	S	.	.	H	α-helix	trans	-64.4	-33.6	178.2	-70.6	0	0	0	0	112.8	R107 D108 K109 L113	R107-C111 WeakPolarHBondContact O-CB 3.32Å; R107-C111 PolarHBondContact O-N 3.47Å; R107-C111 PolarHBondContact O-SG 3.06Å; D108-C111 PolarHBondContact O-N 2.78Å; K109-C111 VanDerWaalsContact C-N 3.35Å; K109-C111 PolarHBondContact O-N 2.8Å; C111-L113 VanDerWaalsContact C-N 3.35Å
112	S	95.3	Very high	95.7	Very high	71 Å²	71	63.8 Å²	63.8	50%	0.497	31%	0.311	S	S	.	.	H	α-helix	trans	-67.7	-33	178.7	-175.9	0	0	0	0	113.1	D108 K109 L110 K115	D108-S112 WeakPolarHBondContact O-CB 3.43Å; D108-S112 PolarHBondContact O-N 2.93Å; K109-S112 WeakPolarHBondContact O-CB 3.43Å; K109-S112 PolarHBondContact O-N 3.15Å; L110-S112 VanDerWaalsContact C-N 3.3Å; L110-S112 PolarHBondContact O-N 3.36Å; S112-K115 WeakPolarHBondContact O-CE 3.33Å
113	L	95	Very high	95.8	Very high	8 Å²	8	64.1 Å²	64.1	4%	0.042	31%	0.313	C	S	.	.	H	α-helix	trans	-73.3	-33.3	-179.8	-64	171	0	0	0	112.6	F105 K109 L110 C111 K115 Q118 F142 D209 F211	F105-L113 HydrophobicContact CE1-CD1 4.34Å; K109-L113 HydrophobicContact CG-CD1 4.42Å; K109-L113 VanDerWaalsContact O-CG 3.31Å; K109-L113 WeakPolarHBondContact O-CG 3.16Å; K109-L113 PolarHBondContact O-N 2.89Å; L110-L113 PolarHBondContact O-N 2.81Å; C111-L113 VanDerWaalsContact C-N 3.35Å; L113-K115 PolarHBondContact O-N 2.85Å; L113-Q118 PolarHBondContact O-NE2 2.92Å; L113-Q118 VanDerWaalsContact O-NE2 3.17Å; L113-F142 HydrophobicContact CB-CD2 4.42Å; L113-F142 HydrophobicContact CB-CE2 3.57Å; L113-F142 HydrophobicContact CB-CZ 3.84Å; L113-F142 HydrophobicContact CD1-CE2 4.45Å; L113-D209 HydrophobicContact CD2-CB 3.86Å; L113-F211 HydrophobicContact CD1-CD2 3.96Å; L113-F211 HydrophobicContact CD1-CE2 4.13Å; L113-F211 HydrophobicContact CD2-CE2 4.18Å
114	V	95.1	Very high	95.8	Very high	76 Å²	76	71.3 Å²	71.3	46%	0.461	34%	0.341	S	S	.	.			trans	-76.7	95.6	-177.6	-177.1	0	0	0	0	110.3	L120 F142	V114-L120 HydrophobicContact CG2-CD1 4.3Å; V114-F142 HydrophobicContact CG2-CE1 4.14Å; V114-F142 HydrophobicContact CG2-CZ 3.91Å
115	K	95.4	Very high	95.8	Very high	126 Å²	126	69.3 Å²	69.3	55%	0.548	33%	0.331	S	S	.	.			trans	-109.7	159.3	176.9	-59.9	172.9	-175.6	169.1	0	111.9	S112 L113 Q118	S112-K115 WeakPolarHBondContact O-CE 3.33Å; L113-K115 PolarHBondContact O-N 2.85Å; K115-Q118 WeakPolarHBondContact O-CG 3.33Å
116	K	96	Very high	95.9	Very high	178 Å²	178	72.4 Å²	72.4	77%	0.774	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	160.9	172.8	-68.5	-177.6	178.6	178.9	0	111	Q118	K116-Q118 VanDerWaalsContact C-N 3.26Å; K116-Q118 PolarHBondContact O-N 3.41Å
117	W	95.9	Very high	95.9	Very high	120 Å²	120	71.9 Å²	71.9	46%	0.455	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.7	9.9	173.5	-44.4	113	0	0	0	116.7	K152 T153 S154 Y155	W117-K152 HydrophobicContact CG-CG 4.3Å; W117-T153 HydrophobicContact CB-CG2 4.16Å; W117-T153 HydrophobicContact CD2-CG2 4.04Å; W117-T153 HydrophobicContact CE3-CG2 3.29Å; W117-T153 HydrophobicContact CG-CG2 4.43Å; W117-T153 HydrophobicContact CZ3-CG2 3.95Å; W117-T153 CarbonylContact O-C 3.58Å; W117-T153 WeakPolarHBondContact O-CA 3.16Å; W117-S154 PolarHBondContact O-N 2.89Å; W117-S154 PolarHBondContact O-OG 3.35Å; W117-Y155 VanDerWaalsContact C-CE1 3.46Å
118	Q	96.7	Very high	96	Very high	29 Å²	29	68.7 Å²	68.7	14%	0.136	34%	0.336	C	S	.	.	B	Isolated β-bridge	trans	-127.8	160.5	171.4	61.9	-172.8	17.6	0	0	109.5	L113 K115 K116 F142 H208	L113-Q118 PolarHBondContact O-NE2 2.92Å; L113-Q118 VanDerWaalsContact O-NE2 3.17Å; K115-Q118 WeakPolarHBondContact O-CG 3.33Å; K116-Q118 VanDerWaalsContact C-N 3.26Å; K116-Q118 PolarHBondContact O-N 3.41Å; Q118-F142 HydrophobicContact CG-CD1 4.32Å; Q118-H208 PolarHBondContact OE1-CE1 3.35Å; Q118-H208 PolarHBondContact OE1-NE2 3.32Å
119	T	97.7	Very high	95.9	Very high	22 Å²	22	63.7 Å²	63.7	14%	0.135	31%	0.31	C	S	.	.			trans	-93.2	127.9	175.6	-56.9	0	0	0	0	108.9	I121 T143 Y155 A156 I161	T119-I121 HydrophobicContact CG2-CG1 4.13Å; T119-T143 PolarHBondContact N-OG1 3.39Å; T119-T143 PolarHBondContact O-N 3.47Å; T119-Y155 WeakPolarHBondContact OG1-CA 3.19Å; T119-A156 PolarHBondContact OG1-N 3.27Å; T119-I161 HydrophobicContact CG2-CD1 3.67Å; T119-I161 HydrophobicContact CG2-CG1 4.12Å
120	L	97.4	Very high	95.9	Very high	65 Å²	65	67.7 Å²	67.7	34%	0.34	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	127.8	165.9	172.2	163.5	0	0	0	108.7	V114 E122 I140 F142	V114-L120 HydrophobicContact CG2-CD1 4.3Å; L120-E122 HydrophobicContact CD2-CB 4.11Å; L120-E122 HydrophobicContact CD2-CG 3.5Å; L120-E122 HydrophobicContact CG-CG 4.33Å; L120-I140 HydrophobicContact CD1-CD1 4.34Å; L120-F142 HydrophobicContact CB-CD1 4.19Å; L120-F142 HydrophobicContact CB-CE1 3.9Å; L120-F142 HydrophobicContact CD1-CE1 4.13Å; L120-F142 HydrophobicContact CD1-CZ 4.49Å; L120-F142 HydrophobicContact CG-CE1 4.07Å
121	I	97.4	Very high	95.7	Very high	0 Å²	0	67 Å²	67	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	116.5	174.8	-54	177.3	0	0	0	107.8	T119 I140 G141 T143 I161 I164 R165 M168 L207	T119-I121 HydrophobicContact CG2-CG1 4.13Å; I121-I140 CarbonylContact O-C 3.49Å; I121-G141 PolarHBondContact N-O 2.77Å; I121-G141 PolarHBondContact O-N 3.37Å; I121-T143 HydrophobicContact CD1-CG2 4.33Å; I121-I161 HydrophobicContact CD1-CG1 4.44Å; I121-I161 HydrophobicContact CG1-CG2 4.36Å; I121-I161 HydrophobicContact CG2-CG2 4.32Å; I121-I164 HydrophobicContact CD1-CB 4.25Å; I121-I164 HydrophobicContact CD1-CD1 3.62Å; I121-I164 HydrophobicContact CD1-CG2 3.93Å; I121-I164 HydrophobicContact CG2-CG2 3.92Å; I121-R165 HydrophobicContact CG2-CG 3.84Å; I121-M168 HydrophobicContact CG2-CE 4.21Å; I121-M168 HydrophobicContact CG2-SD 4.03Å; I121-L207 HydrophobicContact CD1-CD2 4.06Å
122	E	96.8	Very high	95.6	Very high	72 Å²	72	64.7 Å²	64.7	34%	0.336	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	143.2	175.3	-81.5	176.9	166.2	0	0	110.2	L120 C139 I140 R165 R213	L120-E122 HydrophobicContact CD2-CB 4.11Å; L120-E122 HydrophobicContact CD2-CG 3.5Å; L120-E122 HydrophobicContact CG-CG 4.33Å; E122-C139 WeakPolarHBondContact CA-O 3.09Å; E122-I140 HydrophobicContact CG-CG1 4.15Å; E122-R165 PolarHBondContact O-NE 2.92Å; E122-R213 IonicContact OE1-CZ 3.64Å; E122-R213 IonicContact OE1-NH1 2.87Å; E122-R213 PolarHBondContact OE1-NH1 3.17Å
123	A	97.1	Very high	95.5	Very high	10 Å²	10	62.4 Å²	62.4	8%	0.083	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	153.6	172.7	0	0	0	0	0	109.9	F138 C139 R165 M168 V169 M172	A123-F138 WeakPolarHBondContact O-CA 3.17Å; A123-C139 PolarHBondContact N-O 3.27Å; A123-C139 PolarHBondContact O-N 3.09Å; A123-R165 HydrophobicContact CB-CG 4.45Å; A123-M168 HydrophobicContact CB-CB 3.8Å; A123-M168 HydrophobicContact CB-CG 4.47Å; A123-M168 HydrophobicContact CB-SD 3.87Å; A123-V169 HydrophobicContact CB-CG2 4.29Å; A123-M172 HydrophobicContact CB-CE 4.21Å
124	Y	96.7	Very high	95.6	Very high	152 Å²	152	64.8 Å²	64.8	60%	0.596	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.2	150.1	169.9	69.4	-88	0	0	0	109.8	M137	Y124-M137 CarbonylContact C-O 3.6Å; Y124-M137 WeakPolarHBondContact CA-O 3.31Å; Y124-M137 WeakPolarHBondContact CB-O 3.33Å
125	A	95.8	Very high	95.6	Very high	5 Å²	5	61.1 Å²	61.1	4%	0.041	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	138.6	175.4	0	0	0	0	0	109.6	V127 R136 M137 V169 M172	A125-V127 HydrophobicContact CB-CG2 3.98Å; A125-R136 WeakPolarHBondContact O-CA 3.14Å; A125-M137 PolarHBondContact N-O 3.43Å; A125-M137 PolarHBondContact O-N 3.19Å; A125-V169 HydrophobicContact CB-CG1 4.15Å; A125-M172 HydrophobicContact CB-CB 4.18Å; A125-M172 HydrophobicContact CB-CE 3.86Å; A125-M172 HydrophobicContact CB-SD 4.44Å
126	D	96.9	Very high	95.7	Very high	72 Å²	72	58.9 Å²	58.9	39%	0.385	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	111.5	169.9	-70.4	-14.6	0	0	0	107.8	L135 R136	D126-L135 CarbonylContact C-O 3.58Å; D126-L135 WeakPolarHBondContact CA-O 2.99Å; D126-R136 VanDerWaalsContact OD1-CB 3.28Å; D126-R136 WeakPolarHBondContact OD1-CB 3.39Å; D126-R136 WeakPolarHBondContact OD1-CD 3.35Å; D126-R136 WeakPolarHBondContact OD1-CG 3.44Å; D126-R136 IonicContact OD1-CZ 3.48Å; D126-R136 IonicContact OD1-NE 2.67Å; D126-R136 PolarHBondContact OD1-NE 3.27Å; D126-R136 IonicContact OD1-NH2 3.44Å; D126-R136 PolarHBondContact OD1-NH2 3.49Å; D126-R136 IonicContact OD2-CZ 3.51Å; D126-R136 IonicContact OD2-NE 3.5Å; D126-R136 PolarHBondContact OD2-NE 3.03Å; D126-R136 IonicContact OD2-NH2 2.7Å; D126-R136 PolarHBondContact OD2-NH2 3.16Å
127	V	95.5	Very high	95.7	Very high	6 Å²	6	50.4 Å²	50.4	4%	0.036	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	133.9	-173.3	-159.7	0	0	0	0	109.4	A125 L135 N173 V176	A125-V127 HydrophobicContact CB-CG2 3.98Å; V127-L135 PolarHBondContact N-O 3.17Å; V127-L135 PolarHBondContact O-N 3.18Å; V127-N173 WeakPolarHBondContact CG2-OD1 3.31Å; V127-V176 HydrophobicContact CB-CB 4.21Å; V127-V176 HydrophobicContact CB-CG1 3.87Å; V127-V176 HydrophobicContact CG1-CB 3.83Å; V127-V176 HydrophobicContact CG1-CG1 3.77Å
128	K	95.7	Very high	95.8	Very high	138 Å²	138	46.5 Å²	46.5	60%	0.6	22%	0.223	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-93.8	128.6	171.5	-169.7	-176.2	174.1	-169.8	0	108.5	Y133 L134	K128-Y133 CarbonylContact C-O 3.54Å; K128-Y133 WeakPolarHBondContact CA-O 3.45Å; K128-L134 HydrophobicContact CB-CD1 4.11Å
129	T	94.9	Very high	95.7	Very high	4 Å²	4	45.2 Å²	45.2	3%	0.025	22%	0.217	C	C	.	.			trans	-80	165.6	172	57.4	0	0	0	0	110.8	D131 G132 Y133 L135 V176 S179 V184	T129-D131 VanDerWaalsContact C-N 3.29Å; T129-D131 WeakPolarHBondContact CB-OD1 3.47Å; T129-D131 PolarHBondContact O-N 3.14Å; T129-D131 PolarHBondContact OG1-OD1 2.95Å; T129-G132 PolarHBondContact O-N 3.41Å; T129-G132 VanDerWaalsContact O-N 3.09Å; T129-Y133 PolarHBondContact N-O 3.12Å; T129-Y133 WeakPolarHBondContact OG1-CB 3.48Å; T129-Y133 PolarHBondContact OG1-N 3.46Å; T129-Y133 PolarHBondContact OG1-O 3.39Å; T129-L135 HydrophobicContact CG2-CD1 3.74Å; T129-L135 HydrophobicContact CG2-CG 4.23Å; T129-V176 HydrophobicContact CG2-CG1 3.76Å; T129-S179 WeakPolarHBondContact CB-O 3.06Å; T129-V184 HydrophobicContact CG2-CG2 3.99Å
130	E	93.7	Very high	95.7	Very high	144 Å²	144	44.4 Å²	44.4	67%	0.673	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-39.8	179.5	-171.9	-179.5	-179.2	0	0	112.5	G132 S179 T180	E130-G132 PolarHBondContact O-N 3.35Å; E130-S179 PolarHBondContact N-O 3.08Å; E130-T180 HydrophobicContact CB-CG2 4.47Å
131	D	90.2	Very high	95.7	Very high	38 Å²	38	41.3 Å²	41.3	20%	0.203	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	4.7	178.9	56.5	-8.6	0	0	0	114.1	T129 Y133 L181	T129-D131 VanDerWaalsContact C-N 3.29Å; T129-D131 WeakPolarHBondContact CB-OD1 3.47Å; T129-D131 PolarHBondContact O-N 3.14Å; T129-D131 PolarHBondContact OG1-OD1 2.95Å; D131-Y133 HydrophobicContact CB-CD2 4.46Å; D131-Y133 WeakPolarHBondContact OD1-CD2 3.22Å; D131-L181 PolarHBondContact OD1-N 2.97Å; D131-L181 WeakPolarHBondContact OD2-CB 3.32Å; D131-L181 PolarHBondContact OD2-N 2.69Å
132	G	91.7	Very high	95.7	Very high	23 Å²	23	41.4 Å²	41.4	24%	0.237	20%	0.196	C	C	.	.	S	Bend	trans	88.5	11.3	169.5	0	0	0	0	0	115.6	T129 E130	T129-G132 PolarHBondContact O-N 3.41Å; T129-G132 VanDerWaalsContact O-N 3.09Å; E130-G132 PolarHBondContact O-N 3.35Å
133	Y	94.5	Very high	95.7	Very high	22 Å²	22	38 Å²	38	9%	0.086	18%	0.18	C	C	.	.			trans	-73.9	136.6	167.1	-67.2	-97	0	0	0	109.9	N99 K128 T129 D131 L181 V217 K219 K220 P221	N99-Y133 PolarHBondContact ND2-OH 3.18Å; K128-Y133 CarbonylContact C-O 3.54Å; K128-Y133 WeakPolarHBondContact CA-O 3.45Å; T129-Y133 PolarHBondContact N-O 3.12Å; T129-Y133 WeakPolarHBondContact OG1-CB 3.48Å; T129-Y133 PolarHBondContact OG1-N 3.46Å; T129-Y133 PolarHBondContact OG1-O 3.39Å; D131-Y133 HydrophobicContact CB-CD2 4.46Å; D131-Y133 WeakPolarHBondContact OD1-CD2 3.22Å; Y133-L181 HydrophobicContact CD1-CD2 4.05Å; Y133-L181 HydrophobicContact CD2-CB 4Å; Y133-L181 HydrophobicContact CD2-CD2 3.93Å; Y133-L181 HydrophobicContact CD2-CG 4.42Å; Y133-L181 HydrophobicContact CE1-CD2 3.79Å; Y133-L181 HydrophobicContact CE2-CB 4.11Å; Y133-L181 HydrophobicContact CE2-CD2 3.68Å; Y133-L181 HydrophobicContact CE2-CG 4.49Å; Y133-L181 HydrophobicContact CG-CD1 4.47Å; Y133-L181 HydrophobicContact CG-CD2 4.12Å; Y133-V217 HydrophobicContact CD1-CG1 4.1Å; Y133-K219 WeakPolarHBondContact CA-O 3.18Å; Y133-K220 HydrophobicContact CD1-CB 4.36Å; Y133-K220 HydrophobicContact CD1-CG 4.05Å; Y133-K220 HydrophobicContact CE1-CB 4.17Å; Y133-K220 HydrophobicContact CE1-CD 4.41Å; Y133-K220 HydrophobicContact CE1-CG 3.89Å; Y133-P221 HydrophobicContact CD2-CG 4.05Å; Y133-P221 HydrophobicContact CE1-CG 4.32Å; Y133-P221 HydrophobicContact CE2-CG 3.72Å; Y133-P221 HydrophobicContact CG-CG 4.48Å
134	L	96	Very high	95.7	Very high	58 Å²	58	42.3 Å²	42.3	30%	0.304	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	113.6	169.7	-171.4	70.9	0	0	0	108.2	K128 L218 K219	K128-L134 HydrophobicContact CB-CD1 4.11Å; L134-L218 HydrophobicContact CB-CB 4.31Å; L134-L218 HydrophobicContact CD2-CB 4.02Å; L134-L218 HydrophobicContact CD2-CD1 3.94Å; L134-L218 HydrophobicContact CG-CB 4.2Å; L134-L218 HydrophobicContact CG-CD1 4.17Å; L134-L218 WeakPolarHBondContact O-CB 3.48Å; L134-L218 PolarHBondContact O-N 2.8Å; L134-K219 HydrophobicContact CB-CB 3.79Å; L134-K219 HydrophobicContact CD2-CB 4.49Å; L134-K219 PolarHBondContact N-O 3.12Å; L134-K219 PolarHBondContact O-N 3.47Å
135	L	96.3	Very high	95.5	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	136.9	-178	-56.5	-179.1	0	0	0	110.2	D126 V127 T129 V176 L181 V184 V215 K216 V217	D126-L135 CarbonylContact C-O 3.58Å; D126-L135 WeakPolarHBondContact CA-O 2.99Å; V127-L135 PolarHBondContact N-O 3.17Å; V127-L135 PolarHBondContact O-N 3.18Å; T129-L135 HydrophobicContact CG2-CD1 3.74Å; T129-L135 HydrophobicContact CG2-CG 4.23Å; L135-V176 HydrophobicContact CD1-CG1 4.18Å; L135-L181 HydrophobicContact CD1-CD1 4.14Å; L135-L181 HydrophobicContact CD2-CD1 4.31Å; L135-V184 HydrophobicContact CD1-CG1 4.07Å; L135-V215 HydrophobicContact CB-CG1 4.4Å; L135-V215 HydrophobicContact CD2-CG1 4.45Å; L135-K216 CarbonylContact C-O 3.53Å; L135-K216 WeakPolarHBondContact CA-O 3.28Å; L135-V217 HydrophobicContact CD2-CB 4.27Å; L135-V217 HydrophobicContact CD2-CG2 3.59Å
136	R	97	Very high	95.4	Very high	78 Å²	78	46.3 Å²	46.3	29%	0.294	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	111.3	165	-179.5	170.5	-67.9	165.7	2.6	109.3	A125 D126 F138 V215 K216 L218	A125-R136 WeakPolarHBondContact O-CA 3.14Å; D126-R136 VanDerWaalsContact OD1-CB 3.28Å; D126-R136 WeakPolarHBondContact OD1-CB 3.39Å; D126-R136 WeakPolarHBondContact OD1-CD 3.35Å; D126-R136 WeakPolarHBondContact OD1-CG 3.44Å; D126-R136 IonicContact OD1-CZ 3.48Å; D126-R136 IonicContact OD1-NE 2.67Å; D126-R136 PolarHBondContact OD1-NE 3.27Å; D126-R136 IonicContact OD1-NH2 3.44Å; D126-R136 PolarHBondContact OD1-NH2 3.49Å; D126-R136 IonicContact OD2-CZ 3.51Å; D126-R136 IonicContact OD2-NE 3.5Å; D126-R136 PolarHBondContact OD2-NE 3.03Å; D126-R136 IonicContact OD2-NH2 2.7Å; D126-R136 PolarHBondContact OD2-NH2 3.16Å; R136-F138 HydrophobicContact CG-CD2 4.35Å; R136-F138 HydrophobicContact CG-CE2 3.63Å; R136-F138 HydrophobicContact CG-CZ 3.82Å; R136-V215 WeakPolarHBondContact O-CA 3.45Å; R136-K216 HydrophobicContact CB-CB 4.33Å; R136-K216 PolarHBondContact N-O 3.19Å; R136-K216 PolarHBondContact O-N 2.89Å; R136-L218 HydrophobicContact CB-CD1 3.94Å; R136-L218 HydrophobicContact CB-CD2 4.23Å; R136-L218 HydrophobicContact CB-CG 3.99Å
137	M	96	Very high	95.3	Very high	1 Å²	1	49.7 Å²	49.7	1%	0.005	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	141.8	178.2	-64.5	175.1	50.4	0	0	110.2	Y124 A125 M172 V176 I193 I212 K214 V215	Y124-M137 CarbonylContact C-O 3.6Å; Y124-M137 WeakPolarHBondContact CA-O 3.31Å; Y124-M137 WeakPolarHBondContact CB-O 3.33Å; A125-M137 PolarHBondContact N-O 3.43Å; A125-M137 PolarHBondContact O-N 3.19Å; M137-M172 HydrophobicContact CB-SD 3.94Å; M137-M172 HydrophobicContact CE-CB 4.14Å; M137-M172 HydrophobicContact CE-CG 3.79Å; M137-M172 HydrophobicContact CE-SD 3.97Å; M137-V176 HydrophobicContact CE-CG2 4.2Å; M137-V176 HydrophobicContact SD-CB 4.3Å; M137-V176 HydrophobicContact SD-CG1 4.44Å; M137-V176 HydrophobicContact SD-CG2 3.5Å; M137-V176 VanDerWaalsContact SD-CG2 3.5Å; M137-I193 HydrophobicContact CE-CD1 4.13Å; M137-I212 HydrophobicContact CE-CD1 3.49Å; M137-I212 VanDerWaalsContact CE-CD1 3.49Å; M137-I212 HydrophobicContact CE-CG1 4.13Å; M137-I212 HydrophobicContact CE-CG2 4.42Å; M137-K214 CarbonylContact C-O 3.48Å; M137-V215 HydrophobicContact CG-CG1 4.33Å; M137-V215 HydrophobicContact CG-CG2 4.14Å
138	F	97.5	Very high	95.2	Very high	38 Å²	38	57 Å²	57	17%	0.167	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	121.7	173.7	-64.7	-93	0	0	0	108.2	A123 R136 I212 R213 K214 K216	A123-F138 WeakPolarHBondContact O-CA 3.17Å; R136-F138 HydrophobicContact CG-CD2 4.35Å; R136-F138 HydrophobicContact CG-CE2 3.63Å; R136-F138 HydrophobicContact CG-CZ 3.82Å; F138-I212 CarbonylContact O-C 3.59Å; F138-I212 WeakPolarHBondContact O-CA 3.44Å; F138-R213 HydrophobicContact CB-CB 4.38Å; F138-R213 PolarHBondContact O-N 2.87Å; F138-K214 HydrophobicContact CB-CB 4.12Å; F138-K214 HydrophobicContact CD2-CB 3.78Å; F138-K214 HydrophobicContact CD2-CD 4.44Å; F138-K214 HydrophobicContact CD2-CG 4.13Å; F138-K214 HydrophobicContact CG-CB 4.25Å; F138-K214 PolarHBondContact N-O 3.28Å; F138-K214 PolarHBondContact O-N 2.74Å; F138-K216 HydrophobicContact CE2-CD 4.04Å; F138-K216 HydrophobicContact CE2-CG 4.29Å
139	C	96.1	Very high	95.1	Very high	2 Å²	2	52.5 Å²	52.5	1%	0.014	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	141.4	173	-175.3	0	0	0	0	109.5	E122 A123 M172 F211	E122-C139 WeakPolarHBondContact CA-O 3.09Å; A123-C139 PolarHBondContact N-O 3.27Å; A123-C139 PolarHBondContact O-N 3.09Å; C139-M172 HydrophobicContact CB-CE 3.99Å; C139-M172 HydrophobicContact CB-SD 3.75Å; C139-F211 WeakPolarHBondContact CA-O 3.19Å
140	I	96.7	Very high	95.1	Very high	4 Å²	4	61.1 Å²	61.1	2%	0.021	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	144.1	171.2	-168.1	168.1	0	0	0	108.3	L120 I121 E122 F142 V210 F211 R213	L120-I140 HydrophobicContact CD1-CD1 4.34Å; I121-I140 CarbonylContact O-C 3.49Å; E122-I140 HydrophobicContact CG-CG1 4.15Å; I140-F142 HydrophobicContact CD1-CE2 3.93Å; I140-F142 HydrophobicContact CD1-CZ 3.66Å; I140-F142 HydrophobicContact CG1-CE2 3.92Å; I140-F142 HydrophobicContact CG1-CZ 3.99Å; I140-V210 CarbonylContact O-C 3.52Å; I140-V210 VanDerWaalsContact O-CA 3.32Å; I140-V210 WeakPolarHBondContact O-CA 3.45Å; I140-F211 HydrophobicContact CG2-CB 4.24Å; I140-F211 PolarHBondContact N-O 3.34Å; I140-F211 PolarHBondContact O-N 3.38Å; I140-R213 HydrophobicContact CB-CB 4.4Å; I140-R213 HydrophobicContact CG2-CB 4.07Å
141	G	96.9	Very high	95.1	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	155.3	172.1	0	0	0	0	0	111.6	I121	I121-G141 PolarHBondContact N-O 2.77Å; I121-G141 PolarHBondContact O-N 3.37Å
142	F	97.7	Very high	95.2	Very high	2 Å²	2	65.7 Å²	65.7	1%	0.009	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	144.9	-177.4	-61.1	-86.8	0	0	0	111.3	L113 V114 Q118 L120 I140 K144 L207 H208 D209	L113-F142 HydrophobicContact CB-CD2 4.42Å; L113-F142 HydrophobicContact CB-CE2 3.57Å; L113-F142 HydrophobicContact CB-CZ 3.84Å; L113-F142 HydrophobicContact CD1-CE2 4.45Å; V114-F142 HydrophobicContact CG2-CE1 4.14Å; V114-F142 HydrophobicContact CG2-CZ 3.91Å; Q118-F142 HydrophobicContact CG-CD1 4.32Å; L120-F142 HydrophobicContact CB-CD1 4.19Å; L120-F142 HydrophobicContact CB-CE1 3.9Å; L120-F142 HydrophobicContact CD1-CE1 4.13Å; L120-F142 HydrophobicContact CD1-CZ 4.49Å; L120-F142 HydrophobicContact CG-CE1 4.07Å; I140-F142 HydrophobicContact CD1-CE2 3.93Å; I140-F142 HydrophobicContact CD1-CZ 3.66Å; I140-F142 HydrophobicContact CG1-CE2 3.92Å; I140-F142 HydrophobicContact CG1-CZ 3.99Å; F142-K144 PolarHBondContact O-N 2.89Å; F142-L207 CarbonylContact O-C 3.59Å; F142-L207 VanDerWaalsContact O-CA 3.3Å; F142-L207 WeakPolarHBondContact O-CA 3.36Å; F142-H208 VanDerWaalsContact CB-CE1 3.46Å; F142-H208 WeakPolarHBondContact CB-CE1 3.32Å; F142-H208 PolarHBondContact N-O 2.87Å; F142-H208 VanDerWaalsContact N-O 3.09Å; F142-H208 PolarHBondContact O-N 2.79Å; F142-H208 PolarHBondContact O-ND1 3.46Å; F142-D209 HydrophobicContact CD2-CB 3.93Å
143	T	97.5	Very high	95.4	Very high	0 Å²	0	65.5 Å²	65.5	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	125.9	176.9	50.2	0	0	0	0	111.7	T119 I121 S154 A156 Y205 L207 H208	T119-T143 PolarHBondContact N-OG1 3.39Å; T119-T143 PolarHBondContact O-N 3.47Å; I121-T143 HydrophobicContact CD1-CG2 4.33Å; T143-S154 WeakPolarHBondContact CB-O 3.46Å; T143-S154 PolarHBondContact O-OG 3.45Å; T143-S154 PolarHBondContact OG1-O 3.06Å; T143-S154 PolarHBondContact OG1-OG 2.87Å; T143-A156 HydrophobicContact CG2-CB 3.86Å; T143-Y205 HydrophobicContact CG2-CD1 3.72Å; T143-Y205 HydrophobicContact CG2-CE1 3.73Å; T143-Y205 HydrophobicContact CG2-CG 4.47Å; T143-L207 HydrophobicContact CG2-CD2 4.35Å; T143-H208 PolarHBondContact O-CE1 2.83Å; T143-H208 VanDerWaalsContact O-CE1 3.23Å; T143-H208 PolarHBondContact O-ND1 2.8Å
144	K	95.9	Very high	95.5	Very high	102 Å²	102	64.7 Å²	64.7	44%	0.443	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-79.6	140	179.8	-169.2	173.9	-174.2	166.9	0	110.6	F142 P206 H208	F142-K144 PolarHBondContact O-N 2.89Å; K144-P206 HydrophobicContact CB-CB 4.21Å; K144-P206 WeakPolarHBondContact CB-O 3.05Å; K144-P206 PolarHBondContact N-O 3.5Å; K144-H208 HydrophobicContact CB-CB 4.12Å; K144-H208 HydrophobicContact CD-CB 4.2Å; K144-H208 HydrophobicContact CG-CB 4.18Å; K144-H208 PolarHBondContact N-ND1 3.15Å
145	R	94.3	Very high	95.5	Very high	127 Å²	127	67.7 Å²	67.7	48%	0.479	31%	0.308	S	S	.	.	P	Polyproline II helix	trans	-82.2	134	168.5	-175	176.7	172.8	-166.5	-3.4	109.3	Q149	R145-Q149 HydrophobicContact CG-CB 4.03Å; R145-Q149 HydrophobicContact CG-CG 4.4Å; R145-Q149 PolarHBondContact NE-O 3.27Å; R145-Q149 PolarHBondContact NH2-O 3.01Å
146	H	93.4	Very high	95.6	Very high	113 Å²	113	68.2 Å²	68.2	52%	0.523	31%	0.312	S	S	.	.	P	Polyproline II helix	trans	-72.6	144.5	174.1	-173.2	-95.3	0	0	0	110.3	Q148 Q149	H146-Q148 VanDerWaalsContact C-N 3.27Å; H146-Q148 PolarHBondContact ND1-N 2.73Å; H146-Q148 PolarHBondContact O-N 3.02Å; H146-Q149 HydrophobicContact CB-CB 4.06Å; H146-Q149 WeakPolarHBondContact O-CB 3.4Å; H146-Q149 PolarHBondContact O-N 3.02Å
147	V	93.5	Very high	95.6	Very high	144 Å²	144	71.9 Å²	71.9	87%	0.873	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-39.6	-172.3	-177.3	0	0	0	0	111.6	Q149	V147-Q149 VanDerWaalsContact C-N 3.32Å; V147-Q149 PolarHBondContact O-N 3.19Å
148	Q	94.4	Very high	95.6	Very high	158 Å²	158	77.7 Å²	77.7	74%	0.738	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	11.5	178.3	-64.6	169.1	-24.4	0	0	113.6	H146 H150	H146-Q148 VanDerWaalsContact C-N 3.27Å; H146-Q148 PolarHBondContact ND1-N 2.73Å; H146-Q148 PolarHBondContact O-N 3.02Å; Q148-H150 PolarHBondContact O-N 3.09Å
149	Q	93.4	Very high	95.7	Very high	44 Å²	44	79.8 Å²	79.8	21%	0.206	38%	0.377	C	S	.	.			trans	-77.6	111.7	-177.4	-171.6	174.2	-13.6	0	0	111.4	R145 H146 V147 K151 T153	R145-Q149 HydrophobicContact CG-CB 4.03Å; R145-Q149 HydrophobicContact CG-CG 4.4Å; R145-Q149 PolarHBondContact NE-O 3.27Å; R145-Q149 PolarHBondContact NH2-O 3.01Å; H146-Q149 HydrophobicContact CB-CB 4.06Å; H146-Q149 WeakPolarHBondContact O-CB 3.4Å; H146-Q149 PolarHBondContact O-N 3.02Å; V147-Q149 VanDerWaalsContact C-N 3.32Å; V147-Q149 PolarHBondContact O-N 3.19Å; Q149-K151 HydrophobicContact CG-CB 4.21Å; Q149-T153 PolarHBondContact NE2-O 3.47Å
150	H	93.9	Very high	95.7	Very high	186 Å²	186	82.2 Å²	82.2	86%	0.861	39%	0.388	S	S	*	.			trans	-67.7	-35.1	174.3	-64.9	-76.6	0	0	0	113	Q148 K152	Q148-H150 PolarHBondContact O-N 3.09Å; H150-K152 PolarHBondContact O-N 2.98Å
151	K	94.2	Very high	95.7	Very high	139 Å²	139	83.1 Å²	83.1	60%	0.604	39%	0.392	S	S	*	.	S	Bend	trans	-63.3	131.9	179.1	-164.7	-177.5	-170.3	-177.1	0	110.6	Q149 T153	Q149-K151 HydrophobicContact CG-CB 4.21Å; K151-T153 WeakPolarHBondContact CE-OG1 3.34Å; K151-T153 PolarHBondContact O-N 3.48Å
152	K	93.1	Very high	95.7	Very high	138 Å²	138	91 Å²	91	60%	0.6	42%	0.422	S	S	*	.	S	Bend	trans	-63.7	-28.2	177.4	-169.5	173.8	-175.4	176.2	0	113.3	W117 H150	W117-K152 HydrophobicContact CG-CG 4.3Å; H150-K152 PolarHBondContact O-N 2.98Å
153	T	96.2	Very high	95.7	Very high	19 Å²	19	92.9 Å²	92.9	12%	0.117	44%	0.438	C	S	.	.			trans	-105.8	138	-173.1	70.5	0	0	0	0	113.1	W117 Q149 K151 Y155	W117-T153 HydrophobicContact CB-CG2 4.16Å; W117-T153 HydrophobicContact CD2-CG2 4.04Å; W117-T153 HydrophobicContact CE3-CG2 3.29Å; W117-T153 HydrophobicContact CG-CG2 4.43Å; W117-T153 HydrophobicContact CZ3-CG2 3.95Å; W117-T153 CarbonylContact O-C 3.58Å; W117-T153 WeakPolarHBondContact O-CA 3.16Å; Q149-T153 PolarHBondContact NE2-O 3.47Å; K151-T153 WeakPolarHBondContact CE-OG1 3.34Å; K151-T153 PolarHBondContact O-N 3.48Å; T153-Y155 HydrophobicContact CG2-CD2 4.49Å; T153-Y155 HydrophobicContact CG2-CE2 3.9Å
154	S	95.6	Very high	95.7	Very high	5 Å²	5	92.9 Å²	92.9	4%	0.035	44%	0.438	C	S	.	.	B	Isolated β-bridge	trans	-114.3	59.8	175.4	56.8	0	0	0	0	110.6	W117 T143	W117-S154 PolarHBondContact O-N 2.89Å; W117-S154 PolarHBondContact O-OG 3.35Å; T143-S154 WeakPolarHBondContact CB-O 3.46Å; T143-S154 PolarHBondContact O-OG 3.45Å; T143-S154 PolarHBondContact OG1-O 3.06Å; T143-S154 PolarHBondContact OG1-OG 2.87Å
155	Y	96.9	Very high	95.8	Very high	121 Å²	121	93.1 Å²	93.1	48%	0.475	44%	0.436	S	S	.	.	P	Polyproline II helix	trans	-86.6	128.8	-179.1	-60.5	-37.4	0	0	0	112.7	W117 T119 T153	W117-Y155 VanDerWaalsContact C-CE1 3.46Å; T119-Y155 WeakPolarHBondContact OG1-CA 3.19Å; T153-Y155 HydrophobicContact CG2-CD2 4.49Å; T153-Y155 HydrophobicContact CG2-CE2 3.9Å
156	A	96.6	Very high	95.9	Very high	12 Å²	12	90 Å²	90	10%	0.099	44%	0.437	C	S	.	.	P	Polyproline II helix	trans	-80.9	143.8	170.3	0	0	0	0	0	110.6	T119 T143 Q160 I161 Y205	T119-A156 PolarHBondContact OG1-N 3.27Å; T143-A156 HydrophobicContact CG2-CB 3.86Å; A156-Q160 HydrophobicContact CB-CB 4.29Å; A156-I161 HydrophobicContact CB-CG1 3.91Å; A156-Y205 HydrophobicContact CB-CD2 4.07Å; A156-Y205 HydrophobicContact CB-CE2 4.33Å; A156-Y205 HydrophobicContact CB-CG 4.32Å
157	K	97.3	Very high	96	Very high	155 Å²	155	87.8 Å²	87.8	67%	0.674	43%	0.426	S	S	*	.	P	Polyproline II helix	trans	-66.7	154.2	172.6	-67.6	-177.2	178.7	-179.7	0	110.4	S159 Q160 I161	K157-S159 PolarHBondContact O-N 2.69Å; K157-Q160 HydrophobicContact CB-CG 4.38Å; K157-Q160 WeakPolarHBondContact O-CB 3.38Å; K157-Q160 PolarHBondContact O-N 3.42Å; K157-I161 WeakPolarHBondContact O-CG1 3.44Å; K157-I161 PolarHBondContact O-N 2.99Å
158	H	97.5	Very high	96.2	Very high	122 Å²	122	80.9 Å²	80.9	57%	0.565	39%	0.385	S	S	*	.	H	α-helix	trans	-56	-37.6	-179.8	-173.1	77.7	0	0	0	113.3	I161 R162	H158-I161 PolarHBondContact O-N 3.34Å; H158-R162 PolarHBondContact NE2-NH2 3.32Å; H158-R162 VanDerWaalsContact NE2-NH2 3.17Å; H158-R162 PolarHBondContact O-N 3.43Å; H158-R162 VanDerWaalsContact O-N 3.07Å
159	S	97.6	Very high	96.3	Very high	83 Å²	83	75.5 Å²	75.5	58%	0.58	36%	0.362	S	S	*	.	H	α-helix	trans	-62.3	-43	174.8	54.3	0	0	0	0	112.6	K157 R162 A163	K157-S159 PolarHBondContact O-N 2.69Å; S159-R162 PolarHBondContact O-N 3.24Å; S159-A163 PolarHBondContact O-N 3.28Å
160	Q	97	Very high	96.4	Very high	52 Å²	52	79 Å²	79	24%	0.243	38%	0.378	C	S	.	.	H	α-helix	trans	-64.2	-42.1	176.2	-67.3	173.3	-47.2	0	0	111.3	A156 K157 R162 A163 I164 I204	A156-Q160 HydrophobicContact CB-CB 4.29Å; K157-Q160 HydrophobicContact CB-CG 4.38Å; K157-Q160 WeakPolarHBondContact O-CB 3.38Å; K157-Q160 PolarHBondContact O-N 3.42Å; Q160-R162 VanDerWaalsContact C-N 3.31Å; Q160-R162 PolarHBondContact O-N 3.35Å; Q160-A163 PolarHBondContact O-N 3Å; Q160-I164 WeakPolarHBondContact O-CB 3.44Å; Q160-I164 WeakPolarHBondContact O-CD1 3.35Å; Q160-I164 VanDerWaalsContact O-CG1 3.24Å; Q160-I164 WeakPolarHBondContact O-CG1 3.44Å; Q160-I164 PolarHBondContact O-N 3.38Å; Q160-I204 HydrophobicContact CB-CG2 3.95Å; Q160-I204 HydrophobicContact CG-CG2 4.07Å; Q160-I204 PolarHBondContact NE2-O 2.79Å
161	I	97.3	Very high	96.5	Very high	23 Å²	23	72.8 Å²	72.8	12%	0.118	35%	0.348	C	S	.	.	H	α-helix	trans	-59.5	-43.6	176.6	-62.1	167.8	0	0	0	110.6	T119 I121 A156 K157 H158 I164 R165	T119-I161 HydrophobicContact CG2-CD1 3.67Å; T119-I161 HydrophobicContact CG2-CG1 4.12Å; I121-I161 HydrophobicContact CD1-CG1 4.44Å; I121-I161 HydrophobicContact CG1-CG2 4.36Å; I121-I161 HydrophobicContact CG2-CG2 4.32Å; A156-I161 HydrophobicContact CB-CG1 3.91Å; K157-I161 WeakPolarHBondContact O-CG1 3.44Å; K157-I161 PolarHBondContact O-N 2.99Å; H158-I161 PolarHBondContact O-N 3.34Å; I161-I164 PolarHBondContact O-N 3.37Å; I161-R165 WeakPolarHBondContact O-CG 3.31Å; I161-R165 PolarHBondContact O-N 2.9Å
162	R	97.3	Very high	96.5	Very high	167 Å²	167	66.2 Å²	66.2	63%	0.63	32%	0.319	S	S	*	.	H	α-helix	trans	-64.3	-43.3	177.9	-166.8	-179.7	-63.4	-176.6	0.5	111.8	H158 S159 Q160 R165 A166	H158-R162 PolarHBondContact NE2-NH2 3.32Å; H158-R162 VanDerWaalsContact NE2-NH2 3.17Å; H158-R162 PolarHBondContact O-N 3.43Å; H158-R162 VanDerWaalsContact O-N 3.07Å; S159-R162 PolarHBondContact O-N 3.24Å; Q160-R162 VanDerWaalsContact C-N 3.31Å; Q160-R162 PolarHBondContact O-N 3.35Å; R162-R165 PolarHBondContact O-N 3.41Å; R162-A166 PolarHBondContact O-N 3.38Å
163	A	97.5	Very high	96.6	Very high	41 Å²	41	62.4 Å²	62.4	34%	0.339	31%	0.305	S	S	.	.	H	α-helix	trans	-64.2	-39.7	177.1	0	0	0	0	0	112.4	S159 Q160 A166 K167 I204	S159-A163 PolarHBondContact O-N 3.28Å; Q160-A163 PolarHBondContact O-N 3Å; A163-A166 PolarHBondContact O-N 2.95Å; A163-K167 PolarHBondContact O-N 3.28Å; A163-K167 VanDerWaalsContact O-N 3.1Å; A163-I204 HydrophobicContact CB-CD1 3.87Å; A163-I204 HydrophobicContact CB-CG2 4.42Å
164	I	97.5	Very high	96.5	Very high	0 Å²	0	68.4 Å²	68.4	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-65.4	-44.2	175.3	-68.7	162.4	0	0	0	110.8	I121 Q160 I161 A166 K167 M168 I204 L207	I121-I164 HydrophobicContact CD1-CB 4.25Å; I121-I164 HydrophobicContact CD1-CD1 3.62Å; I121-I164 HydrophobicContact CD1-CG2 3.93Å; I121-I164 HydrophobicContact CG2-CG2 3.92Å; Q160-I164 WeakPolarHBondContact O-CB 3.44Å; Q160-I164 WeakPolarHBondContact O-CD1 3.35Å; Q160-I164 VanDerWaalsContact O-CG1 3.24Å; Q160-I164 WeakPolarHBondContact O-CG1 3.44Å; Q160-I164 PolarHBondContact O-N 3.38Å; I161-I164 PolarHBondContact O-N 3.37Å; I164-A166 VanDerWaalsContact C-N 3.32Å; I164-A166 PolarHBondContact O-N 3.01Å; I164-K167 PolarHBondContact O-N 2.79Å; I164-M168 HydrophobicContact CG2-CE 3.92Å; I164-M168 HydrophobicContact CG2-CG 4.37Å; I164-M168 HydrophobicContact CG2-SD 4.16Å; I164-M168 WeakPolarHBondContact O-CG 3.48Å; I164-M168 PolarHBondContact O-N 2.81Å; I164-I204 HydrophobicContact CD1-CG2 4.23Å; I164-I204 HydrophobicContact CG1-CB 4.22Å; I164-I204 HydrophobicContact CG1-CD1 4.24Å; I164-I204 HydrophobicContact CG1-CG2 3.98Å; I164-L207 HydrophobicContact CD1-CD2 4.31Å; I164-L207 HydrophobicContact CG2-CD1 3.84Å
165	R	97.3	Very high	96.4	Very high	107 Å²	107	69.9 Å²	69.9	40%	0.404	33%	0.332	S	S	.	.	H	α-helix	trans	-60.2	-40.8	176.2	-76.9	179.1	172.3	160.8	3.2	112.3	I121 E122 A123 I161 R162 M168 V169	I121-R165 HydrophobicContact CG2-CG 3.84Å; E122-R165 PolarHBondContact O-NE 2.92Å; A123-R165 HydrophobicContact CB-CG 4.45Å; I161-R165 WeakPolarHBondContact O-CG 3.31Å; I161-R165 PolarHBondContact O-N 2.9Å; R162-R165 PolarHBondContact O-N 3.41Å; R165-M168 PolarHBondContact O-N 3.18Å; R165-V169 WeakPolarHBondContact O-CG2 3.47Å; R165-V169 PolarHBondContact O-N 3.19Å; R165-V169 VanDerWaalsContact O-N 3.09Å
166	A	96.8	Very high	96.3	Very high	60 Å²	60	64.1 Å²	64.1	50%	0.496	31%	0.309	S	S	.	.	H	α-helix	trans	-61.1	-47.6	175.5	0	0	0	0	0	111.3	R162 A163 I164 M168 V169 E170	R162-A166 PolarHBondContact O-N 3.38Å; A163-A166 PolarHBondContact O-N 2.95Å; I164-A166 VanDerWaalsContact C-N 3.32Å; I164-A166 PolarHBondContact O-N 3.01Å; A166-M168 PolarHBondContact O-N 2.79Å; A166-V169 PolarHBondContact O-N 3.18Å; A166-E170 WeakPolarHBondContact O-CB 3.36Å; A166-E170 PolarHBondContact O-N 3.26Å
167	K	96	Very high	96.1	Very high	67 Å²	67	65.9 Å²	65.9	29%	0.291	32%	0.321	S	S	.	.	H	α-helix	trans	-61.8	-40	175.3	-80.4	-165.2	173.3	178.1	0	113.4	A163 I164 V169 E170 W171 A200 I204	A163-K167 PolarHBondContact O-N 3.28Å; A163-K167 VanDerWaalsContact O-N 3.1Å; I164-K167 PolarHBondContact O-N 2.79Å; K167-V169 VanDerWaalsContact C-N 3.35Å; K167-V169 PolarHBondContact O-N 2.92Å; K167-E170 PolarHBondContact O-N 3.18Å; K167-W171 PolarHBondContact O-N 2.83Å; K167-A200 PolarHBondContact NZ-O 3.48Å; K167-I204 HydrophobicContact CD-CD1 3.76Å; K167-I204 HydrophobicContact CG-CD1 4.39Å
168	M	96.6	Very high	95.9	Very high	0 Å²	0	64.6 Å²	64.6	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-58.2	-47.7	175.9	-77	176.7	164.7	0	0	111.2	I121 A123 I164 R165 A166 M172 I197 L207	I121-M168 HydrophobicContact CG2-CE 4.21Å; I121-M168 HydrophobicContact CG2-SD 4.03Å; A123-M168 HydrophobicContact CB-CB 3.8Å; A123-M168 HydrophobicContact CB-CG 4.47Å; A123-M168 HydrophobicContact CB-SD 3.87Å; I164-M168 HydrophobicContact CG2-CE 3.92Å; I164-M168 HydrophobicContact CG2-CG 4.37Å; I164-M168 HydrophobicContact CG2-SD 4.16Å; I164-M168 WeakPolarHBondContact O-CG 3.48Å; I164-M168 PolarHBondContact O-N 2.81Å; R165-M168 PolarHBondContact O-N 3.18Å; A166-M168 PolarHBondContact O-N 2.79Å; M168-M172 HydrophobicContact CB-CE 4.35Å; M168-M172 WeakPolarHBondContact O-CB 3.48Å; M168-M172 WeakPolarHBondContact O-CE 3.23Å; M168-M172 VanDerWaalsContact O-CG 3.28Å; M168-M172 WeakPolarHBondContact O-CG 3.4Å; M168-M172 PolarHBondContact O-N 3.49Å; M168-I197 HydrophobicContact CE-CG2 4.15Å; M168-I197 HydrophobicContact CG-CG2 3.61Å; M168-L207 HydrophobicContact CE-CD1 4.07Å
169	V	96.9	Very high	95.7	Very high	44 Å²	44	59.2 Å²	59.2	27%	0.267	30%	0.297	S	S	.	.	H	α-helix	trans	-66	-43.3	179.5	173.4	0	0	0	0	111.4	A123 A125 R165 A166 K167 W171 M172 N173	A123-V169 HydrophobicContact CB-CG2 4.29Å; A125-V169 HydrophobicContact CB-CG1 4.15Å; R165-V169 WeakPolarHBondContact O-CG2 3.47Å; R165-V169 PolarHBondContact O-N 3.19Å; R165-V169 VanDerWaalsContact O-N 3.09Å; A166-V169 PolarHBondContact O-N 3.18Å; K167-V169 VanDerWaalsContact C-N 3.35Å; K167-V169 PolarHBondContact O-N 2.92Å; V169-W171 PolarHBondContact O-N 3Å; V169-M172 HydrophobicContact CG2-CE 4.29Å; V169-M172 PolarHBondContact O-N 3.2Å; V169-N173 WeakPolarHBondContact O-CB 3.48Å; V169-N173 VanDerWaalsContact O-CG 3.23Å; V169-N173 PolarHBondContact O-N 3.14Å; V169-N173 PolarHBondContact O-ND2 3.13Å
170	E	96	Very high	95.5	Very high	117 Å²	117	58 Å²	58	55%	0.547	29%	0.286	S	S	.	.	H	α-helix	trans	-57.6	-50	177.8	-174.6	-171.5	167.6	0	0	112	A166 K167 N173 R174	A166-E170 WeakPolarHBondContact O-CB 3.36Å; A166-E170 PolarHBondContact O-N 3.26Å; K167-E170 PolarHBondContact O-N 3.18Å; E170-N173 PolarHBondContact O-N 3.21Å; E170-R174 WeakPolarHBondContact O-CB 3.44Å; E170-R174 PolarHBondContact O-N 3.11Å
171	W	94.5	Very high	95.3	Very high	57 Å²	57	55.5 Å²	55.5	22%	0.216	28%	0.275	C	S	.	.	H	α-helix	trans	-67.8	-39.9	179.7	-86.5	93.2	0	0	0	112.9	K167 V169 N173 R174 E175 D196 I197 A200	K167-W171 PolarHBondContact O-N 2.83Å; V169-W171 PolarHBondContact O-N 3Å; W171-N173 VanDerWaalsContact C-N 3.34Å; W171-N173 PolarHBondContact O-N 3.44Å; W171-R174 PolarHBondContact O-N 3.12Å; W171-E175 HydrophobicContact CE3-CG 4.35Å; W171-E175 PolarHBondContact O-N 3.1Å; W171-D196 HydrophobicContact CE3-CB 4.18Å; W171-D196 HydrophobicContact CZ3-CB 4.28Å; W171-I197 HydrophobicContact CB-CG1 3.86Å; W171-A200 HydrophobicContact CZ2-CB 4.35Å; W171-A200 VanDerWaalsContact NE1-CB 3.27Å
172	M	95.4	Very high	95	Very high	0 Å²	0	58 Å²	58	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-60.5	-43.9	173.5	-74.2	-172.5	-70.7	0	0	111.6	A123 A125 M137 C139 M168 V169 V176 I193 I197	A123-M172 HydrophobicContact CB-CE 4.21Å; A125-M172 HydrophobicContact CB-CB 4.18Å; A125-M172 HydrophobicContact CB-CE 3.86Å; A125-M172 HydrophobicContact CB-SD 4.44Å; M137-M172 HydrophobicContact CB-SD 3.94Å; M137-M172 HydrophobicContact CE-CB 4.14Å; M137-M172 HydrophobicContact CE-CG 3.79Å; M137-M172 HydrophobicContact CE-SD 3.97Å; C139-M172 HydrophobicContact CB-CE 3.99Å; C139-M172 HydrophobicContact CB-SD 3.75Å; M168-M172 HydrophobicContact CB-CE 4.35Å; M168-M172 WeakPolarHBondContact O-CB 3.48Å; M168-M172 WeakPolarHBondContact O-CE 3.23Å; M168-M172 VanDerWaalsContact O-CG 3.28Å; M168-M172 WeakPolarHBondContact O-CG 3.4Å; M168-M172 PolarHBondContact O-N 3.49Å; V169-M172 HydrophobicContact CG2-CE 4.29Å; V169-M172 PolarHBondContact O-N 3.2Å; M172-V176 WeakPolarHBondContact O-CB 3.34Å; M172-V176 PolarHBondContact O-N 3.02Å; M172-I193 HydrophobicContact CG-CG2 4.34Å; M172-I197 HydrophobicContact CG-CD1 4.09Å
173	N	95.6	Very high	94.8	Very high	59 Å²	59	51.4 Å²	51.4	32%	0.316	27%	0.266	S	S	.	.	H	α-helix	trans	-63.9	-46.6	177.6	-74	-14.3	0	0	0	111.5	V127 V169 E170 W171 E175 S177	V127-N173 WeakPolarHBondContact CG2-OD1 3.31Å; V169-N173 WeakPolarHBondContact O-CB 3.48Å; V169-N173 VanDerWaalsContact O-CG 3.23Å; V169-N173 PolarHBondContact O-N 3.14Å; V169-N173 PolarHBondContact O-ND2 3.13Å; E170-N173 PolarHBondContact O-N 3.21Å; W171-N173 VanDerWaalsContact C-N 3.34Å; W171-N173 PolarHBondContact O-N 3.44Å; N173-E175 PolarHBondContact O-N 3.28Å; N173-S177 WeakPolarHBondContact O-CB 3.26Å; N173-S177 PolarHBondContact O-N 3.2Å; N173-S177 PolarHBondContact O-OG 2.95Å
174	R	94.2	Very high	94.6	Very high	145 Å²	145	49.5 Å²	49.5	55%	0.547	25%	0.25	S	S	.	.	H	α-helix	trans	-60.1	-45.3	-178.9	178.9	-179.7	172.5	161.7	1	112.5	E170 W171	E170-R174 WeakPolarHBondContact O-CB 3.44Å; E170-R174 PolarHBondContact O-N 3.11Å; W171-R174 PolarHBondContact O-N 3.12Å
175	E	92.6	Very high	94.4	Very high	35 Å²	35	49.5 Å²	49.5	16%	0.164	25%	0.25	C	S	.	.	H	α-helix	trans	-74.2	-31.6	-175.2	-75.4	-56.9	134.7	0	0	113.6	W171 N173 S179 K187 I193	W171-E175 HydrophobicContact CE3-CG 4.35Å; W171-E175 PolarHBondContact O-N 3.1Å; N173-E175 PolarHBondContact O-N 3.28Å; E175-S179 PolarHBondContact O-OG 2.82Å; E175-K187 PolarHBondContact O-NZ 3.01Å; E175-K187 IonicContact OE2-NZ 2.69Å; E175-K187 PolarHBondContact OE2-NZ 3.03Å; E175-I193 HydrophobicContact CB-CD1 4.35Å; E175-I193 HydrophobicContact CB-CG1 4.17Å; E175-I193 HydrophobicContact CG-CG1 4.39Å
176	V	94.6	Very high	94.2	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-96.9	-30.5	-173.8	174.8	0	0	0	0	113.4	V127 T129 L135 M137 M172 N178 S179 V184 I193	V127-V176 HydrophobicContact CB-CB 4.21Å; V127-V176 HydrophobicContact CB-CG1 3.87Å; V127-V176 HydrophobicContact CG1-CB 3.83Å; V127-V176 HydrophobicContact CG1-CG1 3.77Å; T129-V176 HydrophobicContact CG2-CG1 3.76Å; L135-V176 HydrophobicContact CD1-CG1 4.18Å; M137-V176 HydrophobicContact CE-CG2 4.2Å; M137-V176 HydrophobicContact SD-CB 4.3Å; M137-V176 HydrophobicContact SD-CG1 4.44Å; M137-V176 HydrophobicContact SD-CG2 3.5Å; M137-V176 VanDerWaalsContact SD-CG2 3.5Å; M172-V176 WeakPolarHBondContact O-CB 3.34Å; M172-V176 PolarHBondContact O-N 3.02Å; V176-N178 VanDerWaalsContact C-N 3.32Å; V176-N178 PolarHBondContact O-N 3.16Å; V176-S179 PolarHBondContact O-N 3.05Å; V176-S179 PolarHBondContact O-OG 3.45Å; V176-V184 HydrophobicContact CB-CG2 4.42Å; V176-V184 HydrophobicContact CG1-CG2 3.95Å; V176-V184 HydrophobicContact CG2-CG1 4.22Å; V176-V184 HydrophobicContact CG2-CG2 4.29Å; V176-I193 HydrophobicContact CG2-CD1 4.19Å
177	S	93.3	Very high	94	Very high	49 Å²	49	48.5 Å²	48.5	34%	0.343	24%	0.239	S	C	.	.	H	α-helix	trans	-63.8	-35.2	-179.6	53.3	0	0	0	0	113.8	N173	N173-S177 WeakPolarHBondContact O-CB 3.26Å; N173-S177 PolarHBondContact O-N 3.2Å; N173-S177 PolarHBondContact O-OG 2.95Å
178	N	91.3	Very high	93.9	Very high	129 Å²	129	45.3 Å²	45.3	69%	0.69	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.6	13.5	-178.1	-61.4	-35	0	0	0	113.6	V176	V176-N178 VanDerWaalsContact C-N 3.32Å; V176-N178 PolarHBondContact O-N 3.16Å
179	S	93.3	Very high	93.6	Very high	8 Å²	8	46.4 Å²	46.4	6%	0.056	23%	0.231	C	C	.	.	S	Bend	trans	-127.9	148.4	-178.3	51.4	0	0	0	0	112.2	T129 E130 E175 V176 V184	T129-S179 WeakPolarHBondContact CB-O 3.06Å; E130-S179 PolarHBondContact N-O 3.08Å; E175-S179 PolarHBondContact O-OG 2.82Å; V176-S179 PolarHBondContact O-N 3.05Å; V176-S179 PolarHBondContact O-OG 3.45Å; S179-V184 WeakPolarHBondContact OG-CG2 3.18Å
180	T	93.5	Very high	93.3	Very high	57 Å²	57	47.7 Å²	47.7	35%	0.35	24%	0.24	S	C	.	.			trans	-74.4	161.7	169.2	59.6	0	0	0	0	110.3	E130 K182 A183 V184	E130-T180 HydrophobicContact CB-CG2 4.47Å; T180-K182 PolarHBondContact O-N 3.23Å; T180-K182 VanDerWaalsContact O-N 3.14Å; T180-A183 PolarHBondContact O-N 3.04Å; T180-A183 VanDerWaalsContact O-N 3.08Å; T180-V184 WeakPolarHBondContact O-CG2 3.03Å; T180-V184 PolarHBondContact O-N 3.03Å
181	L	92.7	Very high	93.1	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-55.7	-36.8	-178.4	-173.8	65.2	0	0	0	112.7	F100 D131 Y133 L135 V184 V185	F100-L181 HydrophobicContact CB-CD2 4.31Å; F100-L181 HydrophobicContact CD1-CD1 3.86Å; F100-L181 HydrophobicContact CD1-CD2 4.49Å; F100-L181 HydrophobicContact CD1-CG 4.46Å; F100-L181 HydrophobicContact CE1-CD1 4.36Å; D131-L181 PolarHBondContact OD1-N 2.97Å; D131-L181 WeakPolarHBondContact OD2-CB 3.32Å; D131-L181 PolarHBondContact OD2-N 2.69Å; Y133-L181 HydrophobicContact CD1-CD2 4.05Å; Y133-L181 HydrophobicContact CD2-CB 4Å; Y133-L181 HydrophobicContact CD2-CD2 3.93Å; Y133-L181 HydrophobicContact CD2-CG 4.42Å; Y133-L181 HydrophobicContact CE1-CD2 3.79Å; Y133-L181 HydrophobicContact CE2-CB 4.11Å; Y133-L181 HydrophobicContact CE2-CD2 3.68Å; Y133-L181 HydrophobicContact CE2-CG 4.49Å; Y133-L181 HydrophobicContact CG-CD1 4.47Å; Y133-L181 HydrophobicContact CG-CD2 4.12Å; L135-L181 HydrophobicContact CD1-CD1 4.14Å; L135-L181 HydrophobicContact CD2-CD1 4.31Å; L181-V184 PolarHBondContact O-N 3.34Å; L181-V185 WeakPolarHBondContact O-CG2 3.2Å; L181-V185 PolarHBondContact O-N 3.34Å
182	K	91.9	Very high	93	Very high	75 Å²	75	41.2 Å²	41.2	33%	0.326	22%	0.216	S	C	.	.	H	α-helix	trans	-59.1	-52.6	176.2	-179.6	-179.9	173.9	-175.9	0	111.4	M38 T180 V184 V185 E186	M38-K182 HydrophobicContact CE-CB 4.38Å; M38-K182 HydrophobicContact CE-CG 4.34Å; T180-K182 PolarHBondContact O-N 3.23Å; T180-K182 VanDerWaalsContact O-N 3.14Å; K182-V184 VanDerWaalsContact C-N 3.3Å; K182-V184 PolarHBondContact O-N 3.29Å; K182-V185 PolarHBondContact O-N 3.34Å; K182-E186 WeakPolarHBondContact CE-OE1 3.35Å; K182-E186 WeakPolarHBondContact O-CG 3.31Å; K182-E186 PolarHBondContact O-N 3.1Å
183	A	93.2	Very high	93	Very high	29 Å²	29	41.3 Å²	41.3	24%	0.24	22%	0.217	C	C	.	.	H	α-helix	trans	-65.2	-33.8	179.1	0	0	0	0	0	112.2	T180 E186 K187	T180-A183 PolarHBondContact O-N 3.04Å; T180-A183 VanDerWaalsContact O-N 3.08Å; A183-E186 PolarHBondContact O-N 2.74Å; A183-K187 WeakPolarHBondContact O-CG 3.32Å; A183-K187 PolarHBondContact O-N 2.73Å; A183-K187 VanDerWaalsContact O-N 3.12Å
184	V	94.2	Very high	92.9	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.006	20%	0.202	C	C	.	.	H	α-helix	trans	-61.3	-47.1	172.9	175.3	0	0	0	0	110.7	T129 L135 V176 S179 T180 L181 K182 E186 K187 L188	T129-V184 HydrophobicContact CG2-CG2 3.99Å; L135-V184 HydrophobicContact CD1-CG1 4.07Å; V176-V184 HydrophobicContact CB-CG2 4.42Å; V176-V184 HydrophobicContact CG1-CG2 3.95Å; V176-V184 HydrophobicContact CG2-CG1 4.22Å; V176-V184 HydrophobicContact CG2-CG2 4.29Å; S179-V184 WeakPolarHBondContact OG-CG2 3.18Å; T180-V184 WeakPolarHBondContact O-CG2 3.03Å; T180-V184 PolarHBondContact O-N 3.03Å; L181-V184 PolarHBondContact O-N 3.34Å; K182-V184 VanDerWaalsContact C-N 3.3Å; K182-V184 PolarHBondContact O-N 3.29Å; V184-E186 PolarHBondContact O-N 2.83Å; V184-K187 WeakPolarHBondContact O-CB 3.46Å; V184-K187 PolarHBondContact O-N 2.84Å; V184-L188 HydrophobicContact CG1-CD1 4.12Å; V184-L188 HydrophobicContact CG1-CG 4.37Å; V184-L188 WeakPolarHBondContact O-CG 3.43Å; V184-L188 PolarHBondContact O-N 3.18Å
185	V	92.9	Very high	92.9	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-66.1	-39.2	-179.8	179	0	0	0	0	111.6	M38 F39 F84 F100 L181 K182 K187 L188 I189	M38-V185 HydrophobicContact CE-CB 4.39Å; M38-V185 HydrophobicContact CG-CG1 4.1Å; M38-V185 HydrophobicContact SD-CB 3.56Å; M38-V185 VanDerWaalsContact SD-CB 3.56Å; M38-V185 HydrophobicContact SD-CG1 3.35Å; M38-V185 WeakPolarHBondContact SD-CG1 3.43Å; M38-V185 HydrophobicContact SD-CG2 3.87Å; F39-V185 HydrophobicContact CE1-CG1 4.36Å; F39-V185 HydrophobicContact CZ-CG1 3.91Å; F84-V185 HydrophobicContact CE1-CG1 3.98Å; F100-V185 HydrophobicContact CB-CG2 4.04Å; F100-V185 HydrophobicContact CD1-CG2 4.14Å; F100-V185 HydrophobicContact CD2-CG2 3.69Å; F100-V185 HydrophobicContact CE2-CG2 4.11Å; F100-V185 HydrophobicContact CG-CG2 3.69Å; F100-V185 HydrophobicContact CZ-CG2 4.48Å; L181-V185 WeakPolarHBondContact O-CG2 3.2Å; L181-V185 PolarHBondContact O-N 3.34Å; K182-V185 PolarHBondContact O-N 3.34Å; V185-K187 PolarHBondContact O-N 2.79Å; V185-L188 WeakPolarHBondContact O-CB 3.49Å; V185-L188 PolarHBondContact O-N 3.01Å; V185-I189 HydrophobicContact CG1-CD1 4.41Å; V185-I189 HydrophobicContact CG1-CG1 4.49Å; V185-I189 WeakPolarHBondContact O-CG1 3.48Å; V185-I189 PolarHBondContact O-N 3.29Å; V185-I189 VanDerWaalsContact O-N 3.09Å
186	E	92.6	Very high	93.1	Very high	94 Å²	94	38.8 Å²	38.8	44%	0.439	21%	0.209	S	C	.	.	H	α-helix	trans	-58.8	-33	173.9	-73.3	171	-171.7	0	0	112.5	M38 K182 A183 V184 P190	M38-E186 HydrophobicContact CB-CG 4.47Å; K182-E186 WeakPolarHBondContact CE-OE1 3.35Å; K182-E186 WeakPolarHBondContact O-CG 3.31Å; K182-E186 PolarHBondContact O-N 3.1Å; A183-E186 PolarHBondContact O-N 2.74Å; V184-E186 PolarHBondContact O-N 2.83Å; E186-P190 WeakPolarHBondContact O-CD 3.5Å
187	K	93.2	Very high	93.1	Very high	53 Å²	53	38.8 Å²	38.8	23%	0.23	21%	0.209	C	C	.	.	H	α-helix	trans	-75.1	-31.3	171.7	-68.2	177.1	-171	-175.9	0	113.4	E175 A183 V184 V185 D191 S192 I193	E175-K187 PolarHBondContact O-NZ 3.01Å; E175-K187 IonicContact OE2-NZ 2.69Å; E175-K187 PolarHBondContact OE2-NZ 3.03Å; A183-K187 WeakPolarHBondContact O-CG 3.32Å; A183-K187 PolarHBondContact O-N 2.73Å; A183-K187 VanDerWaalsContact O-N 3.12Å; V184-K187 WeakPolarHBondContact O-CB 3.46Å; V184-K187 PolarHBondContact O-N 2.84Å; V185-K187 PolarHBondContact O-N 2.79Å; K187-D191 WeakPolarHBondContact O-CA 3.16Å; K187-D191 PolarHBondContact O-N 2.89Å; K187-S192 WeakPolarHBondContact CB-OG 3.41Å; K187-S192 PolarHBondContact O-N 2.82Å; K187-S192 VanDerWaalsContact O-N 3.12Å; K187-S192 PolarHBondContact O-OG 3.27Å; K187-I193 HydrophobicContact CB-CD1 4.29Å; K187-I193 HydrophobicContact CB-CG1 4.31Å
188	L	92.9	Very high	93.2	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-73.2	-27.3	179.8	-70.3	175.3	0	0	0	113.6	R82 F100 M103 V184 V185 D191 I193 I212 V215	R82-L188 PolarHBondContact NH1-O 3.04Å; F100-L188 HydrophobicContact CZ-CD1 4.14Å; M103-L188 HydrophobicContact CE-CD2 4.07Å; M103-L188 HydrophobicContact SD-CB 4.2Å; M103-L188 HydrophobicContact SD-CD2 4.44Å; V184-L188 HydrophobicContact CG1-CD1 4.12Å; V184-L188 HydrophobicContact CG1-CG 4.37Å; V184-L188 WeakPolarHBondContact O-CG 3.43Å; V184-L188 PolarHBondContact O-N 3.18Å; V185-L188 WeakPolarHBondContact O-CB 3.49Å; V185-L188 PolarHBondContact O-N 3.01Å; L188-D191 PolarHBondContact O-N 3.37Å; L188-I193 HydrophobicContact CD2-CD1 4.48Å; L188-I212 HydrophobicContact CD2-CB 4.32Å; L188-I212 HydrophobicContact CD2-CD1 3.42Å; L188-I212 VanDerWaalsContact CD2-CD1 3.42Å; L188-I212 HydrophobicContact CD2-CG1 4.47Å; L188-I212 HydrophobicContact CD2-CG2 4.16Å; L188-V215 HydrophobicContact CD1-CG2 4.03Å; L188-V215 HydrophobicContact CD2-CG2 4.16Å
189	I	91	Very high	93.5	Very high	22 Å²	22	41.8 Å²	41.8	11%	0.113	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-58.7	179.3	-68.9	166	0	0	0	111.3	M38 F39 L71 F84 V185 D191	M38-I189 WeakPolarHBondContact O-CD1 3.34Å; F39-I189 HydrophobicContact CD1-CD1 4.04Å; F39-I189 HydrophobicContact CE1-CD1 3.97Å; F39-I189 HydrophobicContact CE1-CG1 4.18Å; L71-I189 HydrophobicContact CD1-CG1 4.24Å; L71-I189 HydrophobicContact CD1-CG2 4.25Å; L71-I189 HydrophobicContact CD2-CG2 4.35Å; F84-I189 HydrophobicContact CZ-CG1 4.36Å; V185-I189 HydrophobicContact CG1-CD1 4.41Å; V185-I189 HydrophobicContact CG1-CG1 4.49Å; V185-I189 WeakPolarHBondContact O-CG1 3.48Å; V185-I189 PolarHBondContact O-N 3.29Å; V185-I189 VanDerWaalsContact O-N 3.09Å; I189-D191 VanDerWaalsContact C-N 3.28Å; I189-D191 PolarHBondContact O-N 3.5Å
190	P	90.4	Very high	93.6	Very high	71 Å²	71	42.5 Å²	42.5	46%	0.461	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-1.5	175.6	36.1	-37.3	0	0	0	113.7	E186 K195	E186-P190 WeakPolarHBondContact O-CD 3.5Å; P190-K195 PolarHBondContact O-NZ 3.43Å
191	D	90.8	Very high	93.7	Very high	5 Å²	5	39.8 Å²	39.8	3%	0.027	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.9	47.7	-175.6	-150.7	45	0	0	0	114.9	R82 K187 L188 I189 I193 G194 K195 F211 I212	R82-D191 VanDerWaalsContact CZ-CB 3.45Å; R82-D191 VanDerWaalsContact CZ-CG 3.44Å; R82-D191 IonicContact CZ-OD1 3.59Å; R82-D191 IonicContact CZ-OD2 3.78Å; R82-D191 VanDerWaalsContact NH1-CB 3.32Å; R82-D191 IonicContact NH1-OD1 3.59Å; R82-D191 PolarHBondContact NH1-OD1 3.08Å; R82-D191 IonicContact NH1-OD2 2.73Å; R82-D191 IonicContact NH2-OD1 3.92Å; R82-D191 IonicContact NH2-OD2 2.83Å; R82-D191 PolarHBondContact NH2-OD2 2.71Å; K187-D191 WeakPolarHBondContact O-CA 3.16Å; K187-D191 PolarHBondContact O-N 2.89Å; L188-D191 PolarHBondContact O-N 3.37Å; I189-D191 VanDerWaalsContact C-N 3.28Å; I189-D191 PolarHBondContact O-N 3.5Å; D191-I193 PolarHBondContact O-N 3.35Å; D191-G194 PolarHBondContact O-N 2.95Å; D191-G194 VanDerWaalsContact O-N 3.16Å; D191-K195 PolarHBondContact O-N 3.38Å; D191-F211 WeakPolarHBondContact OD2-CA 3.19Å; D191-F211 WeakPolarHBondContact OD2-CD1 3.31Å; D191-I212 PolarHBondContact OD2-N 3.43Å
192	S	93.1	Very high	93.7	Very high	34 Å²	34	47.2 Å²	47.2	24%	0.238	23%	0.233	C	C	.	.	H	α-helix	trans	-56.8	-40	179.5	53.2	0	0	0	0	112.1	K187 G194 K195 D196	K187-S192 WeakPolarHBondContact CB-OG 3.41Å; K187-S192 PolarHBondContact O-N 2.82Å; K187-S192 VanDerWaalsContact O-N 3.12Å; K187-S192 PolarHBondContact O-OG 3.27Å; S192-G194 VanDerWaalsContact C-N 3.3Å; S192-G194 PolarHBondContact O-N 2.82Å; S192-K195 WeakPolarHBondContact O-CB 3.41Å; S192-K195 PolarHBondContact O-N 3.22Å; S192-K195 VanDerWaalsContact O-N 3.1Å; S192-D196 PolarHBondContact O-N 3.07Å
193	I	94.7	Very high	93.8	Very high	1 Å²	1	47.4 Å²	47.4	1%	0.005	26%	0.256	C	S	.	.	H	α-helix	trans	-58.7	-40.9	179.4	-54.6	171.8	0	0	0	111.4	M137 M172 E175 V176 K187 L188 D191 D196 I197 I212	M137-I193 HydrophobicContact CE-CD1 4.13Å; M172-I193 HydrophobicContact CG-CG2 4.34Å; E175-I193 HydrophobicContact CB-CD1 4.35Å; E175-I193 HydrophobicContact CB-CG1 4.17Å; E175-I193 HydrophobicContact CG-CG1 4.39Å; V176-I193 HydrophobicContact CG2-CD1 4.19Å; K187-I193 HydrophobicContact CB-CD1 4.29Å; K187-I193 HydrophobicContact CB-CG1 4.31Å; L188-I193 HydrophobicContact CD2-CD1 4.48Å; D191-I193 PolarHBondContact O-N 3.35Å; I193-D196 PolarHBondContact O-N 3.26Å; I193-I197 HydrophobicContact CG2-CD1 4.02Å; I193-I197 WeakPolarHBondContact O-CD1 3.5Å; I193-I197 VanDerWaalsContact O-CG1 3.22Å; I193-I197 WeakPolarHBondContact O-CG1 3.43Å; I193-I197 PolarHBondContact O-N 2.73Å; I193-I212 HydrophobicContact CB-CD1 3.6Å; I193-I212 HydrophobicContact CD1-CD1 3.69Å; I193-I212 HydrophobicContact CG1-CD1 4.17Å; I193-I212 HydrophobicContact CG2-CD1 3.8Å
194	G	94.1	Very high	93.9	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-63.1	-43.1	177.1	0	0	0	0	0	112.2	D191 S192 I197 E198 V210	D191-G194 PolarHBondContact O-N 2.95Å; D191-G194 VanDerWaalsContact O-N 3.16Å; S192-G194 VanDerWaalsContact C-N 3.3Å; S192-G194 PolarHBondContact O-N 2.82Å; G194-I197 PolarHBondContact O-N 2.9Å; G194-E198 PolarHBondContact O-N 2.9Å; G194-V210 WeakPolarHBondContact O-CG1 3.43Å
195	K	95.1	Very high	94	Very high	132 Å²	132	49.7 Å²	49.7	57%	0.574	26%	0.261	S	S	*	.	H	α-helix	trans	-66.8	-39.6	178.2	-64.4	174.2	-178	165.9	0	112.2	P190 D191 S192 E198 K199	P190-K195 PolarHBondContact O-NZ 3.43Å; D191-K195 PolarHBondContact O-N 3.38Å; S192-K195 WeakPolarHBondContact O-CB 3.41Å; S192-K195 PolarHBondContact O-N 3.22Å; S192-K195 VanDerWaalsContact O-N 3.1Å; K195-E198 WeakPolarHBondContact O-CB 3.31Å; K195-E198 PolarHBondContact O-N 3.47Å; K195-K199 PolarHBondContact O-N 3.29Å
196	D	95.3	Very high	94.2	Very high	55 Å²	55	52.2 Å²	52.2	29%	0.294	28%	0.277	S	S	.	.	H	α-helix	trans	-66.3	-40	177.5	-69.5	-33.1	0	0	0	111.7	W171 S192 I193 E198 K199 A200	W171-D196 HydrophobicContact CE3-CB 4.18Å; W171-D196 HydrophobicContact CZ3-CB 4.28Å; S192-D196 PolarHBondContact O-N 3.07Å; I193-D196 PolarHBondContact O-N 3.26Å; D196-E198 PolarHBondContact O-N 2.92Å; D196-K199 PolarHBondContact O-N 3.38Å; D196-A200 WeakPolarHBondContact O-CB 3.15Å; D196-A200 PolarHBondContact O-N 3.37Å
197	I	96	Very high	94.4	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-61	-44.8	172.7	-69.8	168.2	0	0	0	110.8	M168 W171 M172 I193 G194 K199 A200 C201 V210	M168-I197 HydrophobicContact CE-CG2 4.15Å; M168-I197 HydrophobicContact CG-CG2 3.61Å; W171-I197 HydrophobicContact CB-CG1 3.86Å; M172-I197 HydrophobicContact CG-CD1 4.09Å; I193-I197 HydrophobicContact CG2-CD1 4.02Å; I193-I197 WeakPolarHBondContact O-CD1 3.5Å; I193-I197 VanDerWaalsContact O-CG1 3.22Å; I193-I197 WeakPolarHBondContact O-CG1 3.43Å; I193-I197 PolarHBondContact O-N 2.73Å; G194-I197 PolarHBondContact O-N 2.9Å; I197-K199 VanDerWaalsContact C-N 3.34Å; I197-K199 PolarHBondContact O-N 3.2Å; I197-A200 PolarHBondContact O-N 3.42Å; I197-C201 WeakPolarHBondContact O-CB 3.21Å; I197-C201 PolarHBondContact O-N 2.82Å; I197-C201 PolarHBondContact O-SG 2.81Å; I197-V210 HydrophobicContact CB-CG1 4Å; I197-V210 HydrophobicContact CG2-CG1 3.7Å
198	E	95.9	Very high	94.5	Very high	70 Å²	70	47.3 Å²	47.3	33%	0.327	26%	0.255	S	S	.	.	H	α-helix	trans	-58	-47	177.5	-172.4	-177.9	160.7	0	0	111.2	G194 K195 D196 C201 K202 L207 V210	G194-E198 PolarHBondContact O-N 2.9Å; K195-E198 WeakPolarHBondContact O-CB 3.31Å; K195-E198 PolarHBondContact O-N 3.47Å; D196-E198 PolarHBondContact O-N 2.92Å; E198-C201 PolarHBondContact O-N 2.88Å; E198-K202 PolarHBondContact O-N 3.5Å; E198-L207 HydrophobicContact CG-CB 4.48Å; E198-V210 HydrophobicContact CB-CB 4.26Å; E198-V210 HydrophobicContact CB-CG2 3.97Å; E198-V210 HydrophobicContact CG-CG2 4.26Å
199	K	96.3	Very high	94.6	Very high	171 Å²	171	49.6 Å²	49.6	74%	0.743	27%	0.267	S	S	*	.	H	α-helix	trans	-62.3	-44.6	178.2	-171.8	178	-179.5	-179.2	0	111.9	K195 D196 I197 C201 K202	K195-K199 PolarHBondContact O-N 3.29Å; D196-K199 PolarHBondContact O-N 3.38Å; I197-K199 VanDerWaalsContact C-N 3.34Å; I197-K199 PolarHBondContact O-N 3.2Å; K199-C201 VanDerWaalsContact C-N 3.34Å; K199-C201 PolarHBondContact O-N 3.32Å; K199-K202 PolarHBondContact O-N 3.13Å
200	A	95.4	Very high	94.8	Very high	22 Å²	22	48.8 Å²	48.8	18%	0.182	26%	0.264	C	S	.	.	H	α-helix	trans	-69.1	-29.7	-179.1	0	0	0	0	0	113.6	K167 W171 D196 I197	K167-A200 PolarHBondContact NZ-O 3.48Å; W171-A200 HydrophobicContact CZ2-CB 4.35Å; W171-A200 VanDerWaalsContact NE1-CB 3.27Å; D196-A200 WeakPolarHBondContact O-CB 3.15Å; D196-A200 PolarHBondContact O-N 3.37Å; I197-A200 PolarHBondContact O-N 3.42Å
201	C	95.8	Very high	95.1	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-83.8	-17.2	-178.8	-67.2	0	0	0	0	113.8	I197 E198 K199 G203 I204 Y205 L207	I197-C201 WeakPolarHBondContact O-CB 3.21Å; I197-C201 PolarHBondContact O-N 2.82Å; I197-C201 PolarHBondContact O-SG 2.81Å; E198-C201 PolarHBondContact O-N 2.88Å; K199-C201 VanDerWaalsContact C-N 3.34Å; K199-C201 PolarHBondContact O-N 3.32Å; C201-G203 PolarHBondContact O-N 2.79Å; C201-I204 PolarHBondContact O-N 2.8Å; C201-Y205 PolarHBondContact O-N 2.8Å; C201-Y205 VanDerWaalsContact O-N 3.17Å; C201-Y205 VanDerWaalsContact O-O 3.07Å; C201-L207 HydrophobicContact CB-CD1 3.6Å; C201-L207 HydrophobicContact CB-CG 4.12Å
202	K	93.9	Very high	95.3	Very high	157 Å²	157	47 Å²	47	68%	0.683	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.4	-33	-177	-168.3	176.2	-179.9	-178.2	0	114.1	E198 K199 I204	E198-K202 PolarHBondContact O-N 3.5Å; K199-K202 PolarHBondContact O-N 3.13Å; K202-I204 VanDerWaalsContact C-N 3.31Å; K202-I204 PolarHBondContact O-N 2.86Å
203	G	93.6	Very high	95.4	Very high	78 Å²	78	48.3 Å²	48.3	80%	0.804	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-16.8	177.1	0	0	0	0	0	115.4	C201	C201-G203 PolarHBondContact O-N 2.79Å
204	I	95.8	Very high	95.5	Very high	45 Å²	45	51.2 Å²	51.2	23%	0.231	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.4	-54.5	177.3	-58.2	166.8	0	0	0	109.9	Q160 A163 I164 K167 C201 K202	Q160-I204 HydrophobicContact CB-CG2 3.95Å; Q160-I204 HydrophobicContact CG-CG2 4.07Å; Q160-I204 PolarHBondContact NE2-O 2.79Å; A163-I204 HydrophobicContact CB-CD1 3.87Å; A163-I204 HydrophobicContact CB-CG2 4.42Å; I164-I204 HydrophobicContact CD1-CG2 4.23Å; I164-I204 HydrophobicContact CG1-CB 4.22Å; I164-I204 HydrophobicContact CG1-CD1 4.24Å; I164-I204 HydrophobicContact CG1-CG2 3.98Å; K167-I204 HydrophobicContact CD-CD1 3.76Å; K167-I204 HydrophobicContact CG-CD1 4.39Å; C201-I204 PolarHBondContact O-N 2.8Å; K202-I204 VanDerWaalsContact C-N 3.31Å; K202-I204 PolarHBondContact O-N 2.86Å
205	Y	95.8	Very high	95.6	Very high	34 Å²	34	51.4 Å²	51.4	13%	0.133	26%	0.262	C	S	.	.	S	Bend	trans	-158.1	135.9	177.8	-159.2	-77.3	0	0	0	108.2	T143 A156 C201 L207	T143-Y205 HydrophobicContact CG2-CD1 3.72Å; T143-Y205 HydrophobicContact CG2-CE1 3.73Å; T143-Y205 HydrophobicContact CG2-CG 4.47Å; A156-Y205 HydrophobicContact CB-CD2 4.07Å; A156-Y205 HydrophobicContact CB-CE2 4.33Å; A156-Y205 HydrophobicContact CB-CG 4.32Å; C201-Y205 PolarHBondContact O-N 2.8Å; C201-Y205 VanDerWaalsContact O-N 3.17Å; C201-Y205 VanDerWaalsContact O-O 3.07Å; Y205-L207 PolarHBondContact O-N 3.03Å
206	P	96.1	Very high	95.7	Very high	52 Å²	52	49 Å²	49	34%	0.338	25%	0.252	S	S	.	.			trans	-66.1	125.2	178	27.6	-35.6	0	0	0	111.2	K144	K144-P206 HydrophobicContact CB-CB 4.21Å; K144-P206 WeakPolarHBondContact CB-O 3.05Å; K144-P206 PolarHBondContact N-O 3.5Å
207	L	96.9	Very high	95.7	Very high	4 Å²	4	47.4 Å²	47.4	2%	0.021	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	163.3	175.2	-58	-178.2	0	0	0	110.7	I121 F142 T143 I164 M168 E198 C201 Y205 V210	I121-L207 HydrophobicContact CD1-CD2 4.06Å; F142-L207 CarbonylContact O-C 3.59Å; F142-L207 VanDerWaalsContact O-CA 3.3Å; F142-L207 WeakPolarHBondContact O-CA 3.36Å; T143-L207 HydrophobicContact CG2-CD2 4.35Å; I164-L207 HydrophobicContact CD1-CD2 4.31Å; I164-L207 HydrophobicContact CG2-CD1 3.84Å; M168-L207 HydrophobicContact CE-CD1 4.07Å; E198-L207 HydrophobicContact CG-CB 4.48Å; C201-L207 HydrophobicContact CB-CD1 3.6Å; C201-L207 HydrophobicContact CB-CG 4.12Å; Y205-L207 PolarHBondContact O-N 3.03Å; L207-V210 HydrophobicContact CB-CG2 3.68Å; L207-V210 HydrophobicContact CD1-CG2 4.05Å
208	H	95.2	Very high	95.7	Very high	40 Å²	40	51 Å²	51	19%	0.185	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	165.9	164.8	69.4	-52.7	0	0	0	108.2	Q118 F142 T143 K144 V210	Q118-H208 PolarHBondContact OE1-CE1 3.35Å; Q118-H208 PolarHBondContact OE1-NE2 3.32Å; F142-H208 VanDerWaalsContact CB-CE1 3.46Å; F142-H208 WeakPolarHBondContact CB-CE1 3.32Å; F142-H208 PolarHBondContact N-O 2.87Å; F142-H208 VanDerWaalsContact N-O 3.09Å; F142-H208 PolarHBondContact O-N 2.79Å; F142-H208 PolarHBondContact O-ND1 3.46Å; T143-H208 PolarHBondContact O-CE1 2.83Å; T143-H208 VanDerWaalsContact O-CE1 3.23Å; T143-H208 PolarHBondContact O-ND1 2.8Å; K144-H208 HydrophobicContact CB-CB 4.12Å; K144-H208 HydrophobicContact CD-CB 4.2Å; K144-H208 HydrophobicContact CG-CB 4.18Å; K144-H208 PolarHBondContact N-ND1 3.15Å; H208-V210 PolarHBondContact O-N 3.42Å
209	D	95.1	Very high	95.7	Very high	48 Å²	48	54.6 Å²	54.6	26%	0.257	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	52	45.5	178.5	-67.7	-35.4	0	0	0	112.1	L113 F142 F211	L113-D209 HydrophobicContact CD2-CB 3.86Å; F142-D209 HydrophobicContact CD2-CB 3.93Å; D209-F211 HydrophobicContact CB-CD2 4.41Å; D209-F211 HydrophobicContact CB-CE2 3.91Å; D209-F211 WeakPolarHBondContact O-CD2 3.42Å
210	V	95.9	Very high	95.5	Very high	6 Å²	6	49.3 Å²	49.3	4%	0.036	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	116.2	175.8	-175.5	0	0	0	0	108.6	I140 G194 I197 E198 L207 H208	I140-V210 CarbonylContact O-C 3.52Å; I140-V210 VanDerWaalsContact O-CA 3.32Å; I140-V210 WeakPolarHBondContact O-CA 3.45Å; G194-V210 WeakPolarHBondContact O-CG1 3.43Å; I197-V210 HydrophobicContact CB-CG1 4Å; I197-V210 HydrophobicContact CG2-CG1 3.7Å; E198-V210 HydrophobicContact CB-CB 4.26Å; E198-V210 HydrophobicContact CB-CG2 3.97Å; E198-V210 HydrophobicContact CG-CG2 4.26Å; L207-V210 HydrophobicContact CB-CG2 3.68Å; L207-V210 HydrophobicContact CD1-CG2 4.05Å; H208-V210 PolarHBondContact O-N 3.42Å
211	F	95.6	Very high	95.3	Very high	37 Å²	37	50.3 Å²	50.3	16%	0.162	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	154.2	-177.5	-62.2	-66.8	0	0	0	112.1	R82 F105 L113 C139 I140 D191 D209 R213	R82-F211 VanDerWaalsContact NH2-CD1 3.26Å; F105-F211 HydrophobicContact CE1-CB 4.12Å; F105-F211 HydrophobicContact CE1-CD2 4.13Å; F105-F211 HydrophobicContact CE1-CG 4.09Å; F105-F211 HydrophobicContact CE2-CB 4.2Å; F105-F211 HydrophobicContact CZ-CB 3.48Å; F105-F211 VanDerWaalsContact CZ-CB 3.48Å; F105-F211 HydrophobicContact CZ-CD1 4.1Å; F105-F211 HydrophobicContact CZ-CD2 4.18Å; F105-F211 AromaticContact CZ-CG 3.66Å; F105-F211 HydrophobicContact CZ-CG 3.66Å; L113-F211 HydrophobicContact CD1-CD2 3.96Å; L113-F211 HydrophobicContact CD1-CE2 4.13Å; L113-F211 HydrophobicContact CD2-CE2 4.18Å; C139-F211 WeakPolarHBondContact CA-O 3.19Å; I140-F211 HydrophobicContact CG2-CB 4.24Å; I140-F211 PolarHBondContact N-O 3.34Å; I140-F211 PolarHBondContact O-N 3.38Å; D191-F211 WeakPolarHBondContact OD2-CA 3.19Å; D191-F211 WeakPolarHBondContact OD2-CD1 3.31Å; D209-F211 HydrophobicContact CB-CD2 4.41Å; D209-F211 HydrophobicContact CB-CE2 3.91Å; D209-F211 WeakPolarHBondContact O-CD2 3.42Å; F211-R213 PolarHBondContact O-N 3.08Å
212	I	95.7	Very high	95.1	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	102.3	161.6	-62.1	168.8	0	0	0	108.3	M103 F105 M137 F138 L188 D191 I193 V215	M103-I212 HydrophobicContact CE-CB 3.88Å; M103-I212 HydrophobicContact CE-CG2 3.56Å; M103-I212 WeakPolarHBondContact CE-O 3.39Å; F105-I212 WeakPolarHBondContact CE2-O 3.46Å; M137-I212 HydrophobicContact CE-CD1 3.49Å; M137-I212 VanDerWaalsContact CE-CD1 3.49Å; M137-I212 HydrophobicContact CE-CG1 4.13Å; M137-I212 HydrophobicContact CE-CG2 4.42Å; F138-I212 CarbonylContact O-C 3.59Å; F138-I212 WeakPolarHBondContact O-CA 3.44Å; L188-I212 HydrophobicContact CD2-CB 4.32Å; L188-I212 HydrophobicContact CD2-CD1 3.42Å; L188-I212 VanDerWaalsContact CD2-CD1 3.42Å; L188-I212 HydrophobicContact CD2-CG1 4.47Å; L188-I212 HydrophobicContact CD2-CG2 4.16Å; D191-I212 PolarHBondContact OD2-N 3.43Å; I193-I212 HydrophobicContact CB-CD1 3.6Å; I193-I212 HydrophobicContact CD1-CD1 3.69Å; I193-I212 HydrophobicContact CG1-CD1 4.17Å; I193-I212 HydrophobicContact CG2-CD1 3.8Å; I212-V215 HydrophobicContact CG2-CG2 3.6Å
213	R	95	Very high	94.9	Very high	63 Å²	63	56.6 Å²	56.6	24%	0.238	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	-42.7	-177.4	-171.5	-177.5	91.2	170.9	3.5	112.6	F105 L110 E122 F138 I140 F211	F105-R213 WeakPolarHBondContact CD2-O 3.37Å; F105-R213 PolarHBondContact N-O 3.41Å; F105-R213 VanDerWaalsContact N-O 3.15Å; L110-R213 HydrophobicContact CD1-CG 4.08Å; E122-R213 IonicContact OE1-CZ 3.64Å; E122-R213 IonicContact OE1-NH1 2.87Å; E122-R213 PolarHBondContact OE1-NH1 3.17Å; F138-R213 HydrophobicContact CB-CB 4.38Å; F138-R213 PolarHBondContact O-N 2.87Å; I140-R213 HydrophobicContact CB-CB 4.4Å; I140-R213 HydrophobicContact CG2-CB 4.07Å; F211-R213 PolarHBondContact O-N 3.08Å
214	K	96.2	Very high	94.7	Very high	62 Å²	62	57.6 Å²	57.6	27%	0.27	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	140.9	-171.1	-172.9	169.1	-168.7	160.7	0	110.9	M103 M137 F138 K216	M103-K214 CarbonylContact O-C 3.52Å; M103-K214 VanDerWaalsContact O-CA 3.32Å; M103-K214 WeakPolarHBondContact O-CA 3.28Å; M103-K214 WeakPolarHBondContact O-CG 3.32Å; M137-K214 CarbonylContact C-O 3.48Å; F138-K214 HydrophobicContact CB-CB 4.12Å; F138-K214 HydrophobicContact CD2-CB 3.78Å; F138-K214 HydrophobicContact CD2-CD 4.44Å; F138-K214 HydrophobicContact CD2-CG 4.13Å; F138-K214 HydrophobicContact CG-CB 4.25Å; F138-K214 PolarHBondContact N-O 3.28Å; F138-K214 PolarHBondContact O-N 2.74Å; K214-K216 HydrophobicContact CD-CG 4.42Å; K214-K216 VanDerWaalsContact CE-CE 3.45Å; K214-K216 HydrophobicContact CG-CG 4.31Å
215	V	96.9	Very high	94.3	Very high	3 Å²	3	58.7 Å²	58.7	2%	0.018	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	128.5	169.5	-177.2	0	0	0	0	107.9	F100 G102 M103 L135 R136 M137 L188 I212	F100-V215 HydrophobicContact CE1-CG1 4.07Å; F100-V215 HydrophobicContact CZ-CB 4.19Å; F100-V215 HydrophobicContact CZ-CG1 3.99Å; G102-V215 CarbonylContact C-O 3.59Å; G102-V215 WeakPolarHBondContact CA-O 3.25Å; M103-V215 HydrophobicContact CB-CB 4.06Å; M103-V215 HydrophobicContact CB-CG2 4.22Å; M103-V215 HydrophobicContact CE-CG2 3.97Å; M103-V215 PolarHBondContact N-O 2.94Å; M103-V215 PolarHBondContact O-N 3.22Å; L135-V215 HydrophobicContact CB-CG1 4.4Å; L135-V215 HydrophobicContact CD2-CG1 4.45Å; R136-V215 WeakPolarHBondContact O-CA 3.45Å; M137-V215 HydrophobicContact CG-CG1 4.33Å; M137-V215 HydrophobicContact CG-CG2 4.14Å; L188-V215 HydrophobicContact CD1-CG2 4.03Å; L188-V215 HydrophobicContact CD2-CG2 4.16Å; I212-V215 HydrophobicContact CG2-CG2 3.6Å
216	K	97.2	Very high	94.1	Very high	83 Å²	83	59.7 Å²	59.7	36%	0.361	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	132.6	174.6	-61.1	-179.2	178.1	-177.7	0	108.9	L135 R136 F138 K214 L218	L135-K216 CarbonylContact C-O 3.53Å; L135-K216 WeakPolarHBondContact CA-O 3.28Å; R136-K216 HydrophobicContact CB-CB 4.33Å; R136-K216 PolarHBondContact N-O 3.19Å; R136-K216 PolarHBondContact O-N 2.89Å; F138-K216 HydrophobicContact CE2-CD 4.04Å; F138-K216 HydrophobicContact CE2-CG 4.29Å; K214-K216 HydrophobicContact CD-CG 4.42Å; K214-K216 VanDerWaalsContact CE-CE 3.45Å; K214-K216 HydrophobicContact CG-CG 4.31Å; K216-L218 PolarHBondContact O-N 3.44Å
217	V	95.8	Very high	93.7	Very high	20 Å²	20	61.9 Å²	61.9	12%	0.121	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	114.4	163.6	178.6	0	0	0	0	108	F100 H101 Y133 L135 K220	F100-V217 HydrophobicContact CD1-CG2 4.17Å; F100-V217 HydrophobicContact CE1-CG2 4.19Å; H101-V217 WeakPolarHBondContact O-CB 3.47Å; H101-V217 WeakPolarHBondContact O-CG2 3.42Å; H101-V217 PolarHBondContact O-N 2.75Å; Y133-V217 HydrophobicContact CD1-CG1 4.1Å; L135-V217 HydrophobicContact CD2-CB 4.27Å; L135-V217 HydrophobicContact CD2-CG2 3.59Å; V217-K220 HydrophobicContact CG1-CD 4.48Å; V217-K220 HydrophobicContact CG1-CG 3.57Å
218	L	95.5	Very high	93.4	Very high	76 Å²	76	61.8 Å²	61.8	40%	0.398	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	-45.5	176.6	-64.5	-179.2	0	0	0	111.4	L134 R136 K216	L134-L218 HydrophobicContact CB-CB 4.31Å; L134-L218 HydrophobicContact CD2-CB 4.02Å; L134-L218 HydrophobicContact CD2-CD1 3.94Å; L134-L218 HydrophobicContact CG-CB 4.2Å; L134-L218 HydrophobicContact CG-CD1 4.17Å; L134-L218 WeakPolarHBondContact O-CB 3.48Å; L134-L218 PolarHBondContact O-N 2.8Å; R136-L218 HydrophobicContact CB-CD1 3.94Å; R136-L218 HydrophobicContact CB-CD2 4.23Å; R136-L218 HydrophobicContact CB-CG 3.99Å; K216-L218 PolarHBondContact O-N 3.44Å
219	K	95.1	Very high	93.2	Very high	145 Å²	145	61.6 Å²	61.6	63%	0.63	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.6	136.6	-179.6	-166.8	174.1	-178.4	176.8	0	109.4	Y133 L134	Y133-K219 WeakPolarHBondContact CA-O 3.18Å; L134-K219 HydrophobicContact CB-CB 3.79Å; L134-K219 HydrophobicContact CD2-CB 4.49Å; L134-K219 PolarHBondContact N-O 3.12Å; L134-K219 PolarHBondContact O-N 3.47Å
220	K	92.1	Very high	92.9	Very high	61 Å²	61	65.6 Å²	65.6	27%	0.265	32%	0.317	S	S	.	.			trans	-104.9	146	171.8	-65.7	-173.8	170	-165.6	0	109.7	E89 Y133 V217	E89-K220 IonicContact OE1-NZ 2.74Å; E89-K220 PolarHBondContact OE1-NZ 2.92Å; Y133-K220 HydrophobicContact CD1-CB 4.36Å; Y133-K220 HydrophobicContact CD1-CG 4.05Å; Y133-K220 HydrophobicContact CE1-CB 4.17Å; Y133-K220 HydrophobicContact CE1-CD 4.41Å; Y133-K220 HydrophobicContact CE1-CG 3.89Å; V217-K220 HydrophobicContact CG1-CD 4.48Å; V217-K220 HydrophobicContact CG1-CG 3.57Å
221	P	92.8	Very high	92.6	Very high	43 Å²	43	66.1 Å²	66.1	28%	0.279	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-65.2	170.5	166.7	31.1	-35.1	0	0	0	110.5	Y133 F223	Y133-P221 HydrophobicContact CD2-CG 4.05Å; Y133-P221 HydrophobicContact CE1-CG 4.32Å; Y133-P221 HydrophobicContact CE2-CG 3.72Å; Y133-P221 HydrophobicContact CG-CG 4.48Å; P221-F223 PolarHBondContact O-N 3.4Å
222	K	91.1	Very high	92.3	Very high	190 Å²	190	64.4 Å²	64.4	83%	0.826	31%	0.311	S	S	*	.	P	Polyproline II helix	trans	-59.5	138.1	174.2	-170.1	176.8	179.5	-178.1	0	109.1	E224	K222-E224 PolarHBondContact O-N 3.12Å
223	F	88.8	Confident	91.6	Very high	99 Å²	99	66.1 Å²	66.1	43%	0.434	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-63.2	123.3	-179.1	177.3	-106.4	0	0	0	110.8	E89 Y90 P221 L225 L228	E89-F223 HydrophobicContact CB-CD2 4.32Å; E89-F223 HydrophobicContact CB-CE2 3.85Å; Y90-F223 HydrophobicContact CD2-CZ 4.32Å; P221-F223 PolarHBondContact O-N 3.4Å; F223-L225 HydrophobicContact CE1-CB 4.39Å; F223-L225 HydrophobicContact CE1-CD1 4.46Å; F223-L225 HydrophobicContact CZ-CD1 4.06Å; F223-L228 HydrophobicContact CE2-CB 4.36Å; F223-L228 HydrophobicContact CE2-CD2 3.92Å; F223-L228 HydrophobicContact CZ-CD2 4.12Å
224	E	89.4	Confident	89.9	Confident	99 Å²	99	66.8 Å²	66.8	46%	0.463	34%	0.34	S	S	.	.			trans	-124.9	116.9	175.3	-74	177.5	-171.9	0	0	109	K222 G226 K227 L228	K222-E224 PolarHBondContact O-N 3.12Å; E224-G226 PolarHBondContact O-N 3.01Å; E224-K227 HydrophobicContact CB-CB 4.48Å; E224-K227 HydrophobicContact CB-CD 4.36Å; E224-K227 HydrophobicContact CB-CG 4.43Å; E224-K227 PolarHBondContact O-N 2.82Å; E224-K227 IonicContact OE1-NZ 2.69Å; E224-K227 WeakPolarHBondContact OE2-CD 3.46Å; E224-K227 WeakPolarHBondContact OE2-CE 3.38Å; E224-K227 IonicContact OE2-NZ 3.54Å; E224-K227 PolarHBondContact OE2-NZ 2.96Å; E224-L228 PolarHBondContact O-N 3.16Å
225	L	88.8	Confident	87.4	Confident	68 Å²	68	68.5 Å²	68.5	36%	0.356	36%	0.356	S	S	.	.	H	α-helix	trans	-60.7	-35.5	-176.6	-174.2	62.4	0	0	0	112.2	Y90 F223 L228 M229	Y90-L225 HydrophobicContact CD1-CD1 3.79Å; Y90-L225 HydrophobicContact CD2-CD1 3.58Å; Y90-L225 HydrophobicContact CE1-CD1 3.98Å; Y90-L225 HydrophobicContact CE2-CD1 3.79Å; Y90-L225 HydrophobicContact CE2-CD2 4.31Å; Y90-L225 HydrophobicContact CG-CD1 3.57Å; F223-L225 HydrophobicContact CE1-CB 4.39Å; F223-L225 HydrophobicContact CE1-CD1 4.46Å; F223-L225 HydrophobicContact CZ-CD1 4.06Å; L225-L228 PolarHBondContact O-N 3.17Å; L225-M229 HydrophobicContact CD1-CE 3.84Å; L225-M229 HydrophobicContact CG-CE 4.31Å; L225-M229 HydrophobicContact CG-CG 4.42Å; L225-M229 WeakPolarHBondContact O-CG 3.32Å; L225-M229 PolarHBondContact O-N 3.27Å
226	G	90.2	Very high	84.6	Confident	54 Å²	54	80.9 Å²	80.9	56%	0.557	40%	0.402	S	S	*	.	H	α-helix	trans	-59.3	-48.1	178.8	0	0	0	0	0	113	E224 L228 M229 E230	E224-G226 PolarHBondContact O-N 3.01Å; G226-L228 VanDerWaalsContact C-N 3.3Å; G226-L228 PolarHBondContact O-N 2.81Å; G226-M229 PolarHBondContact O-N 3.46Å; G226-E230 PolarHBondContact O-N 3Å
227	K	88.6	Confident	81.3	Confident	98 Å²	98	80.3 Å²	80.3	43%	0.426	42%	0.42	S	S	.	.	H	α-helix	trans	-62.1	-37.1	177.6	-74	179.6	176	142.8	0	112.3	E224 M231	E224-K227 HydrophobicContact CB-CB 4.48Å; E224-K227 HydrophobicContact CB-CD 4.36Å; E224-K227 HydrophobicContact CB-CG 4.43Å; E224-K227 PolarHBondContact O-N 2.82Å; E224-K227 IonicContact OE1-NZ 2.69Å; E224-K227 WeakPolarHBondContact OE2-CD 3.46Å; E224-K227 WeakPolarHBondContact OE2-CE 3.38Å; E224-K227 IonicContact OE2-NZ 3.54Å; E224-K227 PolarHBondContact OE2-NZ 2.96Å; K227-M231 WeakPolarHBondContact O-CG 3.34Å; K227-M231 PolarHBondContact O-N 3.25Å; K227-M231 VanDerWaalsContact O-N 3.11Å
228	L	90.2	Very high	78.1	Confident	2 Å²	2	83.4 Å²	83.4	1%	0.01	44%	0.442	C	S	.	.	H	α-helix	trans	-66.9	-43.2	176	-175.5	66.5	0	0	0	111.5	E89 Y90 L97 N99 F223 E224 L225 G226 E230 M231 H232	E89-L228 HydrophobicContact CB-CD2 4.15Å; Y90-L228 VanDerWaalsContact CB-CD2 3.4Å; Y90-L228 HydrophobicContact CG-CD2 4.49Å; L97-L228 HydrophobicContact CB-CD2 4.05Å; L97-L228 HydrophobicContact CD1-CD2 4.46Å; N99-L228 HydrophobicContact CB-CD1 4.11Å; F223-L228 HydrophobicContact CE2-CB 4.36Å; F223-L228 HydrophobicContact CE2-CD2 3.92Å; F223-L228 HydrophobicContact CZ-CD2 4.12Å; E224-L228 PolarHBondContact O-N 3.16Å; L225-L228 PolarHBondContact O-N 3.17Å; G226-L228 VanDerWaalsContact C-N 3.3Å; G226-L228 PolarHBondContact O-N 2.81Å; L228-E230 VanDerWaalsContact C-N 3.3Å; L228-E230 PolarHBondContact O-N 3.28Å; L228-M231 HydrophobicContact CD1-CE 3.91Å; L228-M231 PolarHBondContact O-N 2.81Å; L228-H232 PolarHBondContact O-CD2 2.81Å; L228-H232 VanDerWaalsContact O-CD2 3.28Å; L228-H232 PolarHBondContact O-N 2.69Å; L228-H232 VanDerWaalsContact O-N 3.14Å
229	M	91.1	Very high	74.9	Confident	36 Å²	36	90 Å²	90	18%	0.177	47%	0.468	C	S	.	.	H	α-helix	trans	-63.7	-37.3	178.1	-68.5	-62.7	176.7	0	0	112.1	Y90 L97 L225 G226 H232 G233 V234	Y90-M229 HydrophobicContact CD1-CE 3.97Å; Y90-M229 HydrophobicContact CE1-CE 3.92Å; L97-M229 HydrophobicContact CD1-CE 3.69Å; L97-M229 HydrophobicContact CD1-SD 3.78Å; L225-M229 HydrophobicContact CD1-CE 3.84Å; L225-M229 HydrophobicContact CG-CE 4.31Å; L225-M229 HydrophobicContact CG-CG 4.42Å; L225-M229 WeakPolarHBondContact O-CG 3.32Å; L225-M229 PolarHBondContact O-N 3.27Å; G226-M229 PolarHBondContact O-N 3.46Å; M229-H232 CarbonylContact O-C 3.53Å; M229-H232 PolarHBondContact O-N 3.04Å; M229-G233 PolarHBondContact O-N 3.27Å; M229-G233 VanDerWaalsContact O-N 3.16Å; M229-V234 PolarHBondContact O-N 2.78Å; M229-V234 HydrophobicContact SD-CB 4.5Å
230	E	88.9	Confident	71.7	Confident	133 Å²	133	87.5 Å²	87.5	62%	0.621	47%	0.474	S	S	*	.	H	α-helix	trans	-61.8	-43.4	172.9	-170.5	-175.8	170.4	0	0	112	G226 L228 H232 G233	G226-E230 PolarHBondContact O-N 3Å; L228-E230 VanDerWaalsContact C-N 3.3Å; L228-E230 PolarHBondContact O-N 3.28Å; E230-H232 PolarHBondContact O-N 3.37Å; E230-G233 PolarHBondContact O-N 2.75Å
231	M	89.3	Confident	68.9	Low	17 Å²	17	91.3 Å²	91.3	8%	0.084	50%	0.502	C	S	.	.	H	α-helix	trans	-65.6	-21.7	175.1	-72.9	-163.4	-62.9	0	0	113.9	S37 M38 N99 K227 L228	S37-M231 WeakPolarHBondContact CB-O 3.48Å; S37-M231 PolarHBondContact N-O 2.82Å; S37-M231 PolarHBondContact OG-O 2.87Å; S37-M231 VanDerWaalsContact OG-O 3.05Å; M38-M231 HydrophobicContact CE-SD 4.34Å; N99-M231 HydrophobicContact CB-CE 4.33Å; N99-M231 VanDerWaalsContact CG-CE 3.43Å; N99-M231 WeakPolarHBondContact OD1-CE 3.29Å; K227-M231 WeakPolarHBondContact O-CG 3.34Å; K227-M231 PolarHBondContact O-N 3.25Å; K227-M231 VanDerWaalsContact O-N 3.11Å; L228-M231 HydrophobicContact CD1-CE 3.91Å; L228-M231 PolarHBondContact O-N 2.81Å
232	H	90	Very high	66	Low	1 Å²	1	98.1 Å²	98.1	1%	0.005	53%	0.53	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	6.9	172	-74.8	-74.5	0	0	0	112.8	K34 A35 R42 L97 T98 L228 M229 E230 V234	K34-H232 PolarHBondContact O-CE1 3.14Å; A35-H232 VanDerWaalsContact C-CE1 3.48Å; A35-H232 PolarHBondContact O-CE1 3.05Å; A35-H232 PolarHBondContact O-ND1 3.11Å; A35-H232 VanDerWaalsContact O-ND1 3.08Å; R42-H232 PolarHBondContact NH1-O 3.01Å; R42-H232 PolarHBondContact NH2-ND1 2.84Å; R42-H232 PolarHBondContact NH2-O 3.07Å; L97-H232 WeakPolarHBondContact CB-NE2 3.44Å; T98-H232 PolarHBondContact N-NE2 3.27Å; T98-H232 PolarHBondContact O-CE1 3.29Å; T98-H232 VanDerWaalsContact O-CE1 3.29Å; T98-H232 PolarHBondContact O-NE2 2.61Å; L228-H232 PolarHBondContact O-CD2 2.81Å; L228-H232 VanDerWaalsContact O-CD2 3.28Å; L228-H232 PolarHBondContact O-N 2.69Å; L228-H232 VanDerWaalsContact O-N 3.14Å; M229-H232 CarbonylContact O-C 3.53Å; M229-H232 PolarHBondContact O-N 3.04Å; E230-H232 PolarHBondContact O-N 3.37Å; H232-V234 HydrophobicContact CB-CG2 4.31Å; H232-V234 PolarHBondContact O-N 3Å
233	G	80.4	Confident	63	Low	35 Å²	35	97.1 Å²	97.1	36%	0.361	53%	0.528	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.3	18.3	177.9	0	0	0	0	0	113.9	M229 E230 T235	M229-G233 PolarHBondContact O-N 3.27Å; M229-G233 VanDerWaalsContact O-N 3.16Å; E230-G233 PolarHBondContact O-N 2.75Å; G233-T235 PolarHBondContact O-N 3.13Å
234	V	60.2	Low	60.3	Low	77 Å²	77	97.3 Å²	97.3	47%	0.467	55%	0.548	S	S	.	.			trans	-84.6	68.9	174.1	-167.8	0	0	0	0	107.6	M229 H232	M229-V234 PolarHBondContact O-N 2.78Å; M229-V234 HydrophobicContact SD-CB 4.5Å; H232-V234 HydrophobicContact CB-CG2 4.31Å; H232-V234 PolarHBondContact O-N 3Å
235	T	42.3	Very low	57.5	Low	99 Å²	99	98 Å²	98	61%	0.607	56%	0.559	S	S	*	*			trans	-70.1	135.5	162.2	-44.6	0	0	0	0	106.5	G233 G237	G233-T235 PolarHBondContact O-N 3.13Å; T235-G237 PolarHBondContact O-N 2.92Å
236	R	37.8	Very low	54.9	Low	263 Å²	263	98 Å²	98	99%	0.992	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.8	18	-179.3	-99.8	179.8	173.4	169.9	-3.5	115.8
237	G	29.2	Very low	52.5	Low	71 Å²	71	104 Å²	104	73%	0.732	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-154.1	21.6	-169.6	0	0	0	0	0	117.1	T235	T235-G237 PolarHBondContact O-N 2.92Å
238	S	27.8	Very low	50.1	Low	84 Å²	84	105.3 Å²	105.3	59%	0.587	60%	0.604	S	S	*	*			trans	-117.4	102.7	171.5	14.9	0	0	0	0	111	A240	S238-A240 PolarHBondContact O-N 2.92Å; S238-A240 VanDerWaalsContact O-N 3.13Å
239	K	27.9	Very low	48	Very low	216 Å²	216	110.6 Å²	110.6	94%	0.939	64%	0.636	S	S	*	*			trans	-45.5	106.1	169.2	-70.6	172.2	169.4	179.9	0	111.5
240	A	28.5	Very low	45.5	Very low	92 Å²	92	115.7 Å²	115.7	76%	0.76	66%	0.664	S	S	*	*			trans	-171.4	49	157.1	0	0	0	0	0	111	S238	S238-A240 PolarHBondContact O-N 2.92Å; S238-A240 VanDerWaalsContact O-N 3.13Å
241	V	34.2	Very low	43.2	Very low	141 Å²	141	120 Å²	120	86%	0.855	68%	0.675	S	S	*	*	S	Bend	trans	-143.1	116.9	144.3	-178.5	0	0	0	0	103.6
242	E	30.9	Very low	40.9	Very low	185 Å²	185	124.8 Å²	124.8	86%	0.864	71%	0.707	S	S	*	*			trans	-45	140.4	172.8	-73.9	167.6	141.6	0	0	110.8	A244	E242-A244 PolarHBondContact O-N 2.95Å
243	E	28.3	Very low	38.1	Very low	170 Å²	170	132.4 Å²	132.4	79%	0.794	75%	0.748	S	S	*	*			trans	-45.6	100.3	162.1	-70.8	161.9	144.4	0	0	110.2	T245	E243-T245 HydrophobicContact CB-CG2 4.21Å; E243-T245 HydrophobicContact CG-CG2 4.31Å; E243-T245 PolarHBondContact O-N 2.92Å
244	A	33.1	Very low	35.9	Very low	103 Å²	103	135.4 Å²	135.4	85%	0.851	77%	0.77	S	S	*	*			trans	-90.8	59.8	143.9	0	0	0	0	0	107.4	E242 G246	E242-A244 PolarHBondContact O-N 2.95Å; A244-G246 PolarHBondContact O-N 3.34Å
245	T	29.3	Very low	34.6	Very low	114 Å²	114	139.1 Å²	139.1	70%	0.699	79%	0.785	S	S	*	*			trans	-68.8	113.8	156.6	43.4	0	0	0	0	107.3	E243	E243-T245 HydrophobicContact CB-CG2 4.21Å; E243-T245 HydrophobicContact CG-CG2 4.31Å; E243-T245 PolarHBondContact O-N 2.92Å
246	G	35.3	Very low	34.4	Very low	66 Å²	66	139.1 Å²	139.1	68%	0.68	80%	0.795	S	S	*	*			trans	102.4	96.7	168.1	0	0	0	0	0	113.8	A244 V248	A244-G246 PolarHBondContact O-N 3.34Å; G246-V248 PolarHBondContact O-N 2.97Å
247	E	38.5	Very low	34.3	Very low	182 Å²	182	135.1 Å²	135.1	85%	0.85	79%	0.788	S	S	*	*			trans	-70.8	113.3	151.6	-166.1	171.6	-164.6	0	0	106.4	V249	E247-V249 PolarHBondContact O-N 2.66Å
248	V	38.4	Very low	34.4	Very low	124 Å²	124	141 Å²	141	75%	0.752	80%	0.796	S	S	*	*			trans	-66.3	103.8	168.4	173	0	0	0	0	106.3	G246 D250	G246-V248 PolarHBondContact O-N 2.97Å; V248-D250 PolarHBondContact O-N 2.94Å
249	V	46.8	Very low	34.9	Very low	113 Å²	113	146.1 Å²	146.1	69%	0.685	81%	0.811	S	S	*	*			trans	-78.5	102.5	168.6	-177.5	0	0	0	0	106.6	E247 R251	E247-V249 PolarHBondContact O-N 2.66Å; V249-R251 PolarHBondContact O-N 3.25Å
250	D	37.6	Very low	35.4	Very low	143 Å²	143	140.3 Å²	140.3	77%	0.765	80%	0.798	S	S	*	*			trans	-61.5	108.6	164.5	-79	-34.9	0	0	0	107.9	V248 P252	V248-D250 PolarHBondContact O-N 2.94Å; D250-P252 WeakPolarHBondContact O-CD 3.39Å
251	R	41.4	Very low	36.3	Very low	225 Å²	225	144 Å²	144	85%	0.849	81%	0.805	S	S	*	*			trans	-80.4	115.6	165.4	-81	179.6	174.7	-179.8	-2.1	107.7	V249 D253	V249-R251 PolarHBondContact O-N 3.25Å; R251-D253 PolarHBondContact O-N 3.47Å
252	P	40.3	Very low	36.8	Very low	116 Å²	116	152 Å²	152	75%	0.753	82%	0.819	S	S	*	*			trans	-84.2	97.1	165.5	32.1	-22.7	0	0	0	106.4	D250	D250-P252 WeakPolarHBondContact O-CD 3.39Å
253	D	30.8	Very low	37.1	Very low	161 Å²	161	150.4 Å²	150.4	86%	0.861	82%	0.817	S	S	*	*			trans	-169.9	78	160.3	-86	-31.4	0	0	0	109.5	R251	R251-D253 PolarHBondContact O-N 3.47Å
254	A	35.2	Very low	37.6	Very low	99 Å²	99	149.3 Å²	149.3	82%	0.818	82%	0.818	S	S	*	*			trans	-123.4	101.9	152.3	0	0	0	0	0	106.1	A256	A254-A256 PolarHBondContact O-N 2.88Å; A254-A256 VanDerWaalsContact O-N 3.13Å
255	I	33.7	Very low	37.8	Very low	155 Å²	155	151.9 Å²	151.9	80%	0.795	82%	0.817	S	S	*	*			trans	-46.2	115.2	167.4	-69	158.6	0	0	0	107.4	Q257	I255-Q257 PolarHBondContact O-N 2.73Å
256	A	36.9	Very low	38.3	Very low	99 Å²	99	154.1 Å²	154.1	82%	0.818	82%	0.824	S	S	*	*			trans	-60.5	102.8	167.7	0	0	0	0	0	107.4	A254	A254-A256 PolarHBondContact O-N 2.88Å; A254-A256 VanDerWaalsContact O-N 3.13Å
257	Q	36.5	Very low	38.5	Very low	179 Å²	179	159.6 Å²	159.6	84%	0.836	83%	0.832	S	S	*	*			trans	-68.2	133.5	164.3	-77.6	179.8	-39	0	0	108.1	I255 E259	I255-Q257 PolarHBondContact O-N 2.73Å; Q257-E259 PolarHBondContact O-N 3.08Å
258	E	30.9	Very low	38.5	Very low	194 Å²	194	158.1 Å²	158.1	91%	0.907	83%	0.831	S	S	*	*			trans	-44.9	120.6	169.2	-65.4	162.2	138.1	0	0	110.8
259	E	38.9	Very low	38.5	Very low	192 Å²	192	160.6 Å²	160.6	90%	0.897	84%	0.837	S	S	*	*			trans	-107.7	122.5	146.1	-90.5	-170.7	160	0	0	108	Q257	Q257-E259 PolarHBondContact O-N 3.08Å
260	S	37.5	Very low	37.9	Very low	94 Å²	94	164.2 Å²	164.2	66%	0.657	85%	0.849	S	S	*	*			trans	-68.6	120.8	176.7	48.5	0	0	0	0	111.3	W262	S260-W262 PolarHBondContact O-N 2.91Å
261	D	47.1	Very low	37.9	Very low	170 Å²	170	166 Å²	166	91%	0.909	86%	0.856	S	S	*	*			trans	-78.2	113.4	155.6	-79.7	-23	0	0	0	108.6
262	W	46	Very low	37.6	Very low	308 Å²	308	160.6 Å²	160.6	100%	1.167	86%	0.856	S	S	*	*			trans	-86.1	0	149.4	-83	71.8	0	0	0	108.9	S260	S260-W262 PolarHBondContact O-N 2.91Å

Retrieved 262 of 262 residues in 546.4 ms (Link to these results)

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