A0A077ZBM0_TRITR Loading...

Zf-RING 2 domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZBM0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 452 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	36.3	Very low	42.8	Very low	136 Å²	136	102.1 Å²	102.1	67%	0.67	58%	0.584	S	S	*	*				0	130.6	0	-68.6	-148.3	75.5	0	0	107.3	G5 L10	M1-G5 WeakPolarHBondContact CE-O 3.3Å; M1-L10 HydrophobicContact CG-CD1 3.96Å
2	D	35.2	Very low	42.7	Very low	119 Å²	119	102.1 Å²	102.1	64%	0.636	58%	0.58	S	S	*	*			trans	-89.5	161.6	170.8	-149	-15.7	0	0	0	110	A4 G5	D2-A4 PolarHBondContact O-N 3.11Å; D2-G5 PolarHBondContact O-N 2.72Å
3	S	46.9	Very low	42.5	Very low	123 Å²	123	104 Å²	104	86%	0.86	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54	-14.1	-168.9	56.8	0	0	0	0	116.3
4	A	54.6	Low	42.1	Very low	88 Å²	88	103.7 Å²	103.7	73%	0.727	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.3	7.6	174.8	0	0	0	0	0	114.6	D2 N6	D2-A4 PolarHBondContact O-N 3.11Å; A4-N6 PolarHBondContact O-N 3.24Å; A4-N6 VanDerWaalsContact O-N 3.16Å
5	G	40.2	Very low	42.1	Very low	50 Å²	50	106.5 Å²	106.5	52%	0.515	58%	0.58	S	S	.	*			trans	69.2	13.5	175.2	0	0	0	0	0	114.7	M1 D2	M1-G5 WeakPolarHBondContact CE-O 3.3Å; D2-G5 PolarHBondContact O-N 2.72Å
6	N	39.6	Very low	41.6	Very low	94 Å²	94	106.1 Å²	106.1	50%	0.503	58%	0.584	S	S	.	*			trans	-88.9	125.1	-176.2	-137.9	-23.5	0	0	0	110.4	A4 W8	A4-N6 PolarHBondContact O-N 3.24Å; A4-N6 VanDerWaalsContact O-N 3.16Å; N6-W8 VanDerWaalsContact C-N 3.26Å; N6-W8 PolarHBondContact O-N 3.21Å
7	P	39	Very low	41.6	Very low	64 Å²	64	105.3 Å²	105.3	42%	0.416	59%	0.588	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.8	10.5	-169.9	32.7	-35.4	0	0	0	114.6	L9 L10 L11	P7-L9 PolarHBondContact O-N 3.46Å; P7-L9 VanDerWaalsContact O-N 3.13Å; P7-L10 WeakPolarHBondContact O-CA 3.49Å; P7-L10 WeakPolarHBondContact O-CB 3.48Å; P7-L10 PolarHBondContact O-N 2.91Å; P7-L11 PolarHBondContact O-N 2.77Å; P7-L11 VanDerWaalsContact O-N 3.16Å
8	W	46.9	Very low	41.4	Very low	174 Å²	174	106.8 Å²	106.8	66%	0.659	59%	0.594	S	S	*	*	H	α-helix	trans	-52.9	-35.8	179.7	-78.5	101.2	0	0	0	113.9	N6 L10 L11 L12	N6-W8 VanDerWaalsContact C-N 3.26Å; N6-W8 PolarHBondContact O-N 3.21Å; W8-L10 VanDerWaalsContact C-N 3.3Å; W8-L10 PolarHBondContact O-N 3.26Å; W8-L11 PolarHBondContact O-N 2.88Å; W8-L12 PolarHBondContact O-N 2.89Å; W8-L12 VanDerWaalsContact O-N 3.1Å
9	L	44.9	Very low	40.9	Very low	95 Å²	95	104.8 Å²	104.8	50%	0.497	60%	0.6	S	S	.	*	H	α-helix	trans	-68.8	-28.2	177	-138.3	86.1	0	0	0	113.2	P7 L13	P7-L9 PolarHBondContact O-N 3.46Å; P7-L9 VanDerWaalsContact O-N 3.13Å; L9-L13 WeakPolarHBondContact O-CG 2.99Å; L9-L13 PolarHBondContact O-N 3.28Å
10	L	42.8	Very low	40.2	Very low	80 Å²	80	103.8 Å²	103.8	42%	0.419	60%	0.595	S	S	.	*	H	α-helix	trans	-76.2	-35.8	175.9	-105.9	146.2	0	0	0	111.2	M1 P7 W8 L12 L13 L14	M1-L10 HydrophobicContact CG-CD1 3.96Å; P7-L10 WeakPolarHBondContact O-CA 3.49Å; P7-L10 WeakPolarHBondContact O-CB 3.48Å; P7-L10 PolarHBondContact O-N 2.91Å; W8-L10 VanDerWaalsContact C-N 3.3Å; W8-L10 PolarHBondContact O-N 3.26Å; L10-L12 VanDerWaalsContact C-N 3.34Å; L10-L13 PolarHBondContact O-N 2.9Å; L10-L14 HydrophobicContact CD2-CD1 4.24Å; L10-L14 WeakPolarHBondContact O-CB 3.44Å; L10-L14 PolarHBondContact O-N 3.44Å
11	L	43.9	Very low	39.8	Very low	100 Å²	100	107 Å²	107	52%	0.524	61%	0.605	S	S	.	*	H	α-helix	trans	-63.2	-40.2	171.7	-101.5	132.1	0	0	0	111.9	P7 W8 L13 L14 W15	P7-L11 PolarHBondContact O-N 2.77Å; P7-L11 VanDerWaalsContact O-N 3.16Å; W8-L11 PolarHBondContact O-N 2.88Å; L11-L13 VanDerWaalsContact C-N 3.28Å; L11-L13 PolarHBondContact O-N 3.06Å; L11-L14 PolarHBondContact O-N 2.89Å; L11-W15 PolarHBondContact O-N 3.45Å; L11-W15 VanDerWaalsContact O-N 3.14Å
12	L	42.5	Very low	39.7	Very low	102 Å²	102	104.6 Å²	104.6	53%	0.534	60%	0.598	S	S	.	*	H	α-helix	trans	-62.1	-35.3	173.1	-77.5	161.7	0	0	0	112.6	W8 L10 W15	W8-L12 PolarHBondContact O-N 2.89Å; W8-L12 VanDerWaalsContact O-N 3.1Å; L10-L12 VanDerWaalsContact C-N 3.34Å; L12-W15 HydrophobicContact CD2-CE3 3.81Å; L12-W15 HydrophobicContact CD2-CZ3 3.58Å; L12-W15 HydrophobicContact CG-CZ3 4.44Å
13	L	40.1	Very low	39.6	Very low	127 Å²	127	106.8 Å²	106.8	67%	0.665	61%	0.606	S	S	*	*	H	α-helix	trans	-80.9	-22.2	177.8	-74.4	167.8	0	0	0	113.9	L9 L10 L11 P16	L9-L13 WeakPolarHBondContact O-CG 2.99Å; L9-L13 PolarHBondContact O-N 3.28Å; L10-L13 PolarHBondContact O-N 2.9Å; L11-L13 VanDerWaalsContact C-N 3.28Å; L11-L13 PolarHBondContact O-N 3.06Å; L13-P16 WeakPolarHBondContact O-CD 3.42Å
14	L	37.2	Very low	39.4	Very low	100 Å²	100	103 Å²	103	52%	0.524	58%	0.576	S	S	.	*	H	α-helix	trans	-90.3	-12.4	178.6	-82.5	158	0	0	0	113.3	L10 L11 P16 S17	L10-L14 HydrophobicContact CD2-CD1 4.24Å; L10-L14 WeakPolarHBondContact O-CB 3.44Å; L10-L14 PolarHBondContact O-N 3.44Å; L11-L14 PolarHBondContact O-N 2.89Å; L14-P16 VanDerWaalsContact C-N 3.28Å; L14-S17 WeakPolarHBondContact O-CB 3.48Å; L14-S17 PolarHBondContact O-N 3.47Å; L14-S17 PolarHBondContact O-OG 3.32Å
15	W	41	Very low	39.2	Very low	146 Å²	146	104.5 Å²	104.5	55%	0.553	57%	0.568	S	S	*	*	G	3₁₀ helix	trans	-52.9	-30.8	172.5	-106.8	-36.2	0	0	0	115.9	L11 L12 S17 L18 V20	L11-W15 PolarHBondContact O-N 3.45Å; L11-W15 VanDerWaalsContact O-N 3.14Å; L12-W15 HydrophobicContact CD2-CE3 3.81Å; L12-W15 HydrophobicContact CD2-CZ3 3.58Å; L12-W15 HydrophobicContact CG-CZ3 4.44Å; W15-S17 PolarHBondContact O-N 2.87Å; W15-L18 PolarHBondContact O-N 3.24Å; W15-V20 WeakPolarHBondContact O-CG2 3.27Å
16	P	34.5	Very low	39.7	Very low	100 Å²	100	105.7 Å²	105.7	65%	0.649	56%	0.56	S	S	*	*	G	3₁₀ helix	trans	-65.5	-18.3	175	-17.6	31.1	0	0	0	114.2	L13 L14 L18	L13-P16 WeakPolarHBondContact O-CD 3.42Å; L14-P16 VanDerWaalsContact C-N 3.28Å; P16-L18 PolarHBondContact O-N 3.32Å
17	S	42.1	Very low	40.4	Very low	92 Å²	92	101.4 Å²	101.4	64%	0.643	54%	0.537	S	S	*	.	G	3₁₀ helix	trans	-76.3	-10	177.8	65.6	0	0	0	0	113.6	L14 W15	L14-S17 WeakPolarHBondContact O-CB 3.48Å; L14-S17 PolarHBondContact O-N 3.47Å; L14-S17 PolarHBondContact O-OG 3.32Å; W15-S17 PolarHBondContact O-N 2.87Å
18	L	37.9	Very low	41.4	Very low	133 Å²	133	98.6 Å²	98.6	70%	0.696	52%	0.519	S	S	*	.	G	3₁₀ helix	trans	-95.7	18.8	-176.9	-80	161	0	0	0	114.3	W15 P16 V20	W15-L18 PolarHBondContact O-N 3.24Å; P16-L18 PolarHBondContact O-N 3.32Å; L18-V20 VanDerWaalsContact C-N 3.26Å; L18-V20 PolarHBondContact O-N 2.94Å
19	G	31.4	Very low	41.9	Very low	69 Å²	69	90.3 Å²	90.3	71%	0.711	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.5	33.4	178.9	0	0	0	0	0	112.4	E21	G19-E21 PolarHBondContact O-N 3.14Å
20	V	27.9	Very low	42.6	Very low	83 Å²	83	88.9 Å²	88.9	50%	0.503	48%	0.48	S	S	.	.			trans	-60.6	113.3	178.9	173.8	0	0	0	0	108.2	W15 L18 V22	W15-V20 WeakPolarHBondContact O-CG2 3.27Å; L18-V20 VanDerWaalsContact C-N 3.26Å; L18-V20 PolarHBondContact O-N 2.94Å; V20-V22 PolarHBondContact O-N 3.22Å
21	E	30.7	Very low	43.4	Very low	173 Å²	173	85.1 Å²	85.1	81%	0.808	46%	0.46	S	S	*	.			trans	-29.4	108.2	160.7	-74.3	169.6	139.7	0	0	108.2	G19 M23	G19-E21 PolarHBondContact O-N 3.14Å; E21-M23 VanDerWaalsContact C-N 3.28Å; E21-M23 PolarHBondContact O-N 2.93Å
22	V	35.3	Very low	44.2	Very low	85 Å²	85	82.9 Å²	82.9	52%	0.515	45%	0.449	S	S	.	.			trans	-58.2	108.1	165.6	178.5	0	0	0	0	103.3	V20 L24	V20-V22 PolarHBondContact O-N 3.22Å; V22-L24 HydrophobicContact CB-CG 4.46Å; V22-L24 HydrophobicContact CG1-CD2 4.11Å; V22-L24 HydrophobicContact CG1-CG 4Å; V22-L24 PolarHBondContact O-N 3.04Å
23	M	32.4	Very low	45	Very low	164 Å²	164	78 Å²	78	81%	0.808	42%	0.424	S	S	*	.			trans	-62	76.9	168.6	-81.6	-128.9	73.2	0	0	106.6	E21 E25	E21-M23 VanDerWaalsContact C-N 3.28Å; E21-M23 PolarHBondContact O-N 2.93Å; M23-E25 VanDerWaalsContact C-N 3.34Å; M23-E25 PolarHBondContact O-N 3.22Å; M23-E25 VanDerWaalsContact O-N 3.11Å
24	L	43.3	Very low	45.8	Very low	44 Å²	44	74.1 Å²	74.1	23%	0.23	41%	0.405	C	S	.	.			trans	-64.6	107.2	159.4	-66.7	166.1	0	0	0	102.9	V22 E26 Y48 F50 F165	V22-L24 HydrophobicContact CB-CG 4.46Å; V22-L24 HydrophobicContact CG1-CD2 4.11Å; V22-L24 HydrophobicContact CG1-CG 4Å; V22-L24 PolarHBondContact O-N 3.04Å; L24-E26 PolarHBondContact O-N 3.23Å; L24-Y48 HydrophobicContact CB-CD1 3.21Å; L24-Y48 HydrophobicContact CB-CE1 3.3Å; L24-Y48 HydrophobicContact CB-CG 4.01Å; L24-Y48 HydrophobicContact CD1-CD1 3.85Å; L24-Y48 HydrophobicContact CD1-CD2 4.03Å; L24-Y48 HydrophobicContact CD1-CE1 3.92Å; L24-Y48 HydrophobicContact CD1-CE2 4.09Å; L24-Y48 HydrophobicContact CD1-CG 3.84Å; L24-Y48 HydrophobicContact CG-CD1 4.12Å; L24-Y48 HydrophobicContact CG-CE1 4.25Å; L24-F50 HydrophobicContact CD2-CE1 4.25Å; L24-F165 HydrophobicContact CD1-CD1 3.77Å; L24-F165 HydrophobicContact CD1-CE1 3.6Å
25	E	48.9	Very low	46.7	Very low	120 Å²	120	70.3 Å²	70.3	56%	0.561	39%	0.387	S	S	*	.			trans	-53.8	115.8	173.4	-82.5	169.9	147.8	0	0	107.3	M23 D27 R56	M23-E25 VanDerWaalsContact C-N 3.34Å; M23-E25 PolarHBondContact O-N 3.22Å; M23-E25 VanDerWaalsContact O-N 3.11Å; E25-D27 PolarHBondContact O-N 3.42Å; E25-R56 IonicContact OE2-CZ 2.78Å; E25-R56 IonicContact OE2-NH1 2.89Å; E25-R56 PolarHBondContact OE2-NH1 3.37Å; E25-R56 IonicContact OE2-NH2 2.84Å; E25-R56 PolarHBondContact OE2-NH2 2.85Å
26	E	50.7	Low	47.4	Very low	74 Å²	74	68.6 Å²	68.6	35%	0.346	40%	0.397	S	S	.	.			trans	-68.7	123.7	-174.3	-51.1	-172.4	168.3	0	0	108.5	L24 Y48 F180 K211	L24-E26 PolarHBondContact O-N 3.23Å; E26-Y48 HydrophobicContact CG-CE1 4.22Å; E26-F180 HydrophobicContact CB-CE2 4.47Å; E26-F180 HydrophobicContact CB-CZ 3.96Å; E26-F180 HydrophobicContact CG-CZ 3.74Å; E26-K211 HydrophobicContact CB-CB 3.84Å; E26-K211 HydrophobicContact CB-CD 3.82Å; E26-K211 HydrophobicContact CB-CG 4.36Å; E26-K211 WeakPolarHBondContact O-CB 3.39Å; E26-K211 PolarHBondContact O-N 2.65Å; E26-K211 WeakPolarHBondContact OE2-CD 3.5Å; E26-K211 WeakPolarHBondContact OE2-CE 3.45Å; E26-K211 IonicContact OE2-NZ 3.42Å; E26-K211 PolarHBondContact OE2-NZ 2.78Å
27	D	55.9	Low	48.5	Very low	4 Å²	4	68.7 Å²	68.7	2%	0.021	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	137.1	178.5	-78.1	-36.9	0	0	0	108.9	E25 G47 L49 R56 L208 A210	E25-D27 PolarHBondContact O-N 3.42Å; D27-G47 PolarHBondContact N-O 3.47Å; D27-G47 PolarHBondContact O-N 2.87Å; D27-L49 HydrophobicContact CB-CB 3.93Å; D27-R56 IonicContact OD2-NE 3.97Å; D27-R56 IonicContact OD2-NH2 3.57Å; D27-L208 HydrophobicContact CB-CD1 4.02Å; D27-A210 WeakPolarHBondContact OD1-CA 3.09Å
28	V	58.4	Low	49.1	Very low	6 Å²	6	67 Å²	67	4%	0.036	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	121.8	179.4	-177.4	0	0	0	0	108.8	L30 R44 E46 A209 K211	V28-L30 HydrophobicContact CB-CD1 4.42Å; V28-L30 HydrophobicContact CG1-CD1 3.9Å; V28-L30 HydrophobicContact CG1-CG 4.15Å; V28-R44 HydrophobicContact CG1-CG 3.56Å; V28-E46 HydrophobicContact CG1-CG 4.41Å; V28-E46 HydrophobicContact CG2-CG 4.28Å; V28-A209 PolarHBondContact N-O 3.28Å; V28-A209 PolarHBondContact O-N 3Å; V28-A209 VanDerWaalsContact O-O 3.12Å; V28-K211 HydrophobicContact CG2-CB 3.74Å; V28-K211 HydrophobicContact CG2-CD 3.79Å; V28-K211 HydrophobicContact CG2-CG 3.79Å
29	L	57.6	Low	50	Low	0 Å²	0	65.7 Å²	65.7	0%	0	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	110.8	169.9	-169.2	73.5	0	0	0	108.6	L45 F64 L147 I149 F177 C206 L208	L29-L45 HydrophobicContact CB-CB 4.31Å; L29-L45 HydrophobicContact CD2-CD1 4.2Å; L29-L45 PolarHBondContact N-O 3.03Å; L29-L45 PolarHBondContact O-N 3.18Å; L29-F64 HydrophobicContact CD1-CD2 4.41Å; L29-F64 HydrophobicContact CD1-CE2 4.26Å; L29-L147 HydrophobicContact CD1-CD2 4.14Å; L29-L147 HydrophobicContact CD2-CD2 4.15Å; L29-I149 HydrophobicContact CD2-CD1 3.86Å; L29-F177 HydrophobicContact CB-CE2 4.19Å; L29-F177 HydrophobicContact CB-CZ 4.4Å; L29-C206 HydrophobicContact CD1-CB 3.9Å; L29-C206 HydrophobicContact CD2-CB 4.2Å; L29-C206 HydrophobicContact CG-CB 3.97Å; L29-L208 HydrophobicContact CD1-CB 4.25Å; L29-L208 HydrophobicContact CD1-CD1 4.37Å
30	L	60.5	Low	51.1	Low	65 Å²	65	67.8 Å²	67.8	34%	0.34	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	111.8	174	-70.8	106.7	0	0	0	109.5	V28 C206 T207 A209	V28-L30 HydrophobicContact CB-CD1 4.42Å; V28-L30 HydrophobicContact CG1-CD1 3.9Å; V28-L30 HydrophobicContact CG1-CG 4.15Å; L30-C206 CarbonylContact O-C 3.49Å; L30-C206 VanDerWaalsContact O-CA 3.32Å; L30-C206 WeakPolarHBondContact O-CA 3.21Å; L30-T207 PolarHBondContact N-O 3.46Å; L30-T207 PolarHBondContact O-N 3.07Å; L30-T207 PolarHBondContact O-OG1 3.04Å; L30-A209 HydrophobicContact CD1-CB 3.75Å
31	C	59.7	Low	52.5	Low	0 Å²	0	69.7 Å²	69.7	0%	0	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	120.9	176.4	-64	0	0	0	0	110.4	V43 L197 V204 S205 C206	C31-V43 PolarHBondContact N-O 3.3Å; C31-V43 PolarHBondContact O-N 2.82Å; C31-V43 VanDerWaalsContact O-O 3.06Å; C31-L197 HydrophobicContact CB-CD2 4.41Å; C31-V204 HydrophobicContact CB-CG1 4.03Å; C31-S205 WeakPolarHBondContact CA-O 3.42Å; C31-C206 HydrophobicContact CB-CB 4.14Å; C31-C206 WeakPolarHBondContact CB-SG 3Å; C31-C206 WeakPolarHBondContact SG-CB 3.29Å; C31-C206 CovalentContact SG-SG 2.05Å; C31-C206 PolarHBondContact SG-SG 3.43Å
32	N	60.2	Low	53.9	Low	53 Å²	53	69.2 Å²	69.2	28%	0.283	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	118.8	169.7	-69.7	-28.8	0	0	0	108.3	K42 V204 S205	N32-K42 WeakPolarHBondContact OD1-CD 3.47Å; N32-K42 WeakPolarHBondContact OD1-CG 3.06Å; N32-V204 WeakPolarHBondContact O-CA 3.19Å; N32-S205 PolarHBondContact N-O 3.45Å; N32-S205 PolarHBondContact O-N 3.41Å; N32-S205 PolarHBondContact O-OG 3.28Å
33	A	59.3	Low	55	Low	0 Å²	0	66.2 Å²	66.2	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	133.4	176.3	0	0	0	0	0	110.2	I40 R41 L197 F201 N203 V204	A33-I40 WeakPolarHBondContact O-CA 3.32Å; A33-R41 PolarHBondContact N-O 2.87Å; A33-R41 PolarHBondContact O-N 2.98Å; A33-R41 VanDerWaalsContact O-O 3.14Å; A33-L197 HydrophobicContact CB-CD2 3.48Å; A33-L197 VanDerWaalsContact CB-CD2 3.48Å; A33-L197 HydrophobicContact CB-CG 3.69Å; A33-F201 HydrophobicContact CB-CB 3.7Å; A33-F201 HydrophobicContact CB-CD1 3.51Å; A33-F201 HydrophobicContact CB-CD2 4.42Å; A33-F201 HydrophobicContact CB-CE1 4.33Å; A33-F201 HydrophobicContact CB-CG 3.63Å; A33-N203 WeakPolarHBondContact CA-O 3.02Å; A33-V204 HydrophobicContact CB-CB 4.48Å; A33-V204 HydrophobicContact CB-CG1 4.35Å; A33-V204 HydrophobicContact CB-CG2 3.77Å
34	T	56.9	Low	56.3	Low	46 Å²	46	63.5 Å²	63.5	28%	0.282	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	121.4	171.6	60.8	0	0	0	0	109.9	I40 F201 N203	T34-I40 HydrophobicContact CG2-CG1 4.19Å; T34-I40 HydrophobicContact CG2-CG2 4.49Å; T34-F201 VanDerWaalsContact C-CD1 3.42Å; T34-N203 PolarHBondContact N-O 2.91Å; T34-N203 WeakPolarHBondContact OG1-CB 3.1Å; T34-N203 PolarHBondContact OG1-ND2 3.23Å
35	S	55.4	Low	57	Low	19 Å²	19	61.5 Å²	61.5	13%	0.133	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	156.6	176.3	169.8	0	0	0	0	109.4	T37 G38 D39	S35-T37 WeakPolarHBondContact CB-OG1 3.04Å; S35-T37 PolarHBondContact O-N 2.84Å; S35-T37 PolarHBondContact OG-N 2.8Å; S35-T37 VanDerWaalsContact OG-N 3.08Å; S35-T37 PolarHBondContact OG-OG1 2.98Å; S35-G38 PolarHBondContact O-N 2.89Å; S35-D39 WeakPolarHBondContact CB-O 3.35Å; S35-D39 PolarHBondContact N-O 3.43Å
36	S	56.5	Low	57.4	Low	111 Å²	111	58.4 Å²	58.4	78%	0.776	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-25.4	168.4	59.3	0	0	0	0	112.7	G38	S36-G38 PolarHBondContact O-N 3.33Å
37	T	57.9	Low	57.8	Low	101 Å²	101	54.9 Å²	54.9	62%	0.62	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-5.3	174.5	60	0	0	0	0	113.7	S35 D39	S35-T37 WeakPolarHBondContact CB-OG1 3.04Å; S35-T37 PolarHBondContact O-N 2.84Å; S35-T37 PolarHBondContact OG-N 2.8Å; S35-T37 VanDerWaalsContact OG-N 3.08Å; S35-T37 PolarHBondContact OG-OG1 2.98Å; T37-D39 VanDerWaalsContact C-N 3.3Å; T37-D39 PolarHBondContact OG1-OD2 2.94Å; T37-D39 VanDerWaalsContact OG1-OD2 3.08Å
38	G	54.5	Low	57.8	Low	56 Å²	56	57 Å²	57	58%	0.577	30%	0.303	S	S	*	.	S	Bend	trans	85.4	-3.7	-174.6	0	0	0	0	0	114.3	S35 S36 I40	S35-G38 PolarHBondContact O-N 2.89Å; S36-G38 PolarHBondContact O-N 3.33Å; G38-I40 PolarHBondContact O-N 3.31Å
39	D	55.7	Low	57.7	Low	107 Å²	107	57.3 Å²	57.3	57%	0.572	31%	0.305	S	S	*	.			trans	-68.7	124.7	174.3	-71.3	-46.8	0	0	0	110.6	S35 T37	S35-D39 WeakPolarHBondContact CB-O 3.35Å; S35-D39 PolarHBondContact N-O 3.43Å; T37-D39 VanDerWaalsContact C-N 3.3Å; T37-D39 PolarHBondContact OG1-OD2 2.94Å; T37-D39 VanDerWaalsContact OG1-OD2 3.08Å
40	I	55.1	Low	57.6	Low	113 Å²	113	58 Å²	58	58%	0.579	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.8	112.1	175.9	-51.9	179.5	0	0	0	107.6	A33 T34 G38 K42	A33-I40 WeakPolarHBondContact O-CA 3.32Å; T34-I40 HydrophobicContact CG2-CG1 4.19Å; T34-I40 HydrophobicContact CG2-CG2 4.49Å; G38-I40 PolarHBondContact O-N 3.31Å; I40-K42 HydrophobicContact CG2-CG 4.47Å
41	R	57.4	Low	57.2	Low	123 Å²	123	58.4 Å²	58.4	46%	0.464	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	122.9	167.5	-75	-163.3	-172.9	167.3	-1.7	109.4	A33 D196 F201	A33-R41 PolarHBondContact N-O 2.87Å; A33-R41 PolarHBondContact O-N 2.98Å; A33-R41 VanDerWaalsContact O-O 3.14Å; R41-D196 IonicContact CZ-OD2 3.91Å; R41-D196 IonicContact NH1-OD2 2.69Å; R41-D196 PolarHBondContact NH1-OD2 3.39Å; R41-F201 HydrophobicContact CB-CE1 3.75Å; R41-F201 HydrophobicContact CB-CZ 3.81Å; R41-F201 HydrophobicContact CG-CE1 3.78Å; R41-F201 HydrophobicContact CG-CZ 3.52Å
42	K	59.7	Low	56.7	Low	162 Å²	162	61.3 Å²	61.3	70%	0.704	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.1	122.2	170.4	-56	-164.1	175.9	175.7	0	108.2	N32 I40	N32-K42 WeakPolarHBondContact OD1-CD 3.47Å; N32-K42 WeakPolarHBondContact OD1-CG 3.06Å; I40-K42 HydrophobicContact CG2-CG 4.47Å
43	V	58.9	Low	56.3	Low	23 Å²	23	64.9 Å²	64.9	14%	0.139	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	130	177	162.1	0	0	0	0	110.2	C31 L45 I193 L197	C31-V43 PolarHBondContact N-O 3.3Å; C31-V43 PolarHBondContact O-N 2.82Å; C31-V43 VanDerWaalsContact O-O 3.06Å; V43-L45 HydrophobicContact CG1-CD2 4.01Å; V43-L45 HydrophobicContact CG1-CG 4.04Å; V43-I193 HydrophobicContact CB-CG2 4.2Å; V43-I193 HydrophobicContact CG1-CG2 3.51Å; V43-I193 HydrophobicContact CG2-CG2 3.63Å; V43-L197 HydrophobicContact CB-CD1 3.81Å; V43-L197 HydrophobicContact CB-CD2 3.9Å; V43-L197 HydrophobicContact CG1-CD1 4.41Å; V43-L197 HydrophobicContact CG1-CD2 4.49Å; V43-L197 HydrophobicContact CG2-CD1 3.21Å; V43-L197 HydrophobicContact CG2-CD2 4.24Å; V43-L197 HydrophobicContact CG2-CG 4.36Å
44	R	59.3	Low	55.9	Low	106 Å²	106	70.2 Å²	70.2	40%	0.4	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	114.1	179.2	-180	179.4	173.1	172.7	-1.2	107.3	V28 E46	V28-R44 HydrophobicContact CG1-CG 3.56Å; R44-E46 HydrophobicContact CG-CG 4.38Å; R44-E46 IonicContact CZ-OE1 3.67Å; R44-E46 IonicContact NE-OE1 3.68Å; R44-E46 PolarHBondContact NE-OE1 3.46Å; R44-E46 IonicContact NH2-OE1 2.75Å; R44-E46 PolarHBondContact NH2-OE1 3.35Å
45	L	57.8	Low	55.6	Low	3 Å²	3	68.1 Å²	68.1	2%	0.016	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	122.6	174.7	-59.6	160.4	0	0	0	107.4	L29 V43 F177 L194	L29-L45 HydrophobicContact CB-CB 4.31Å; L29-L45 HydrophobicContact CD2-CD1 4.2Å; L29-L45 PolarHBondContact N-O 3.03Å; L29-L45 PolarHBondContact O-N 3.18Å; V43-L45 HydrophobicContact CG1-CD2 4.01Å; V43-L45 HydrophobicContact CG1-CG 4.04Å; L45-F177 HydrophobicContact CB-CE1 4.24Å; L45-F177 HydrophobicContact CB-CZ 4.02Å; L45-L194 HydrophobicContact CD1-CD2 3.36Å; L45-L194 HydrophobicContact CD1-CG 4.46Å; L45-L194 HydrophobicContact CD2-CD1 4.07Å; L45-L194 HydrophobicContact CD2-CD2 3.45Å; L45-L194 VanDerWaalsContact CD2-CD2 3.45Å; L45-L194 HydrophobicContact CD2-CG 3.69Å; L45-L194 HydrophobicContact CG-CD2 3.99Å
46	E	58.5	Low	55.5	Low	54 Å²	54	71 Å²	71	25%	0.252	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	137.1	174.8	-55.4	-159.5	160.9	0	0	109.2	V28 R44 P179 F180 K211	V28-E46 HydrophobicContact CG1-CG 4.41Å; V28-E46 HydrophobicContact CG2-CG 4.28Å; R44-E46 HydrophobicContact CG-CG 4.38Å; R44-E46 IonicContact CZ-OE1 3.67Å; R44-E46 IonicContact NE-OE1 3.68Å; R44-E46 PolarHBondContact NE-OE1 3.46Å; R44-E46 IonicContact NH2-OE1 2.75Å; R44-E46 PolarHBondContact NH2-OE1 3.35Å; E46-P179 WeakPolarHBondContact O-CA 3.28Å; E46-F180 HydrophobicContact CB-CD2 3.56Å; E46-F180 HydrophobicContact CB-CE2 3.87Å; E46-F180 WeakPolarHBondContact O-CD2 3.12Å; E46-F180 PolarHBondContact O-N 2.84Å; E46-K211 IonicContact OE2-NZ 3.61Å; E46-K211 PolarHBondContact OE2-NZ 3.02Å
47	G	59.1	Low	55.2	Low	0 Å²	0	70.4 Å²	70.4	0%	0	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.6	-170.7	177.2	0	0	0	0	0	112.8	D27 F177 V178 F180	D27-G47 PolarHBondContact N-O 3.47Å; D27-G47 PolarHBondContact O-N 2.87Å; G47-F177 VanDerWaalsContact CA-CZ 3.46Å; G47-F177 VanDerWaalsContact N-CE2 3.33Å; G47-F177 VanDerWaalsContact N-CZ 3.29Å; G47-V178 CarbonylContact C-O 3.53Å; G47-V178 WeakPolarHBondContact CA-O 3.17Å; G47-F180 VanDerWaalsContact CA-CD2 3.5Å
48	Y	54.4	Low	54.8	Low	50 Å²	50	68.6 Å²	68.6	20%	0.196	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	124.2	173.3	-61	-67.2	0	0	0	109.2	L24 E26 F165 F177 V178 F180	L24-Y48 HydrophobicContact CB-CD1 3.21Å; L24-Y48 HydrophobicContact CB-CE1 3.3Å; L24-Y48 HydrophobicContact CB-CG 4.01Å; L24-Y48 HydrophobicContact CD1-CD1 3.85Å; L24-Y48 HydrophobicContact CD1-CD2 4.03Å; L24-Y48 HydrophobicContact CD1-CE1 3.92Å; L24-Y48 HydrophobicContact CD1-CE2 4.09Å; L24-Y48 HydrophobicContact CD1-CG 3.84Å; L24-Y48 HydrophobicContact CG-CD1 4.12Å; L24-Y48 HydrophobicContact CG-CE1 4.25Å; E26-Y48 HydrophobicContact CG-CE1 4.22Å; Y48-F165 AromaticContact CD2-CE1 3.76Å; Y48-F165 HydrophobicContact CD2-CE1 3.76Å; Y48-F165 AromaticContact CD2-CZ 3.71Å; Y48-F165 HydrophobicContact CD2-CZ 3.71Å; Y48-F165 HydrophobicContact CE2-CE1 4.31Å; Y48-F165 HydrophobicContact CE2-CZ 4.11Å; Y48-F165 HydrophobicContact CG-CE1 4.33Å; Y48-F177 WeakPolarHBondContact O-CA 3.48Å; Y48-V178 PolarHBondContact N-O 3.19Å; Y48-V178 PolarHBondContact O-N 2.88Å; Y48-F180 HydrophobicContact CD1-CE1 4.45Å; Y48-F180 HydrophobicContact CD1-CZ 4.24Å; Y48-F180 HydrophobicContact CD2-CE1 4.3Å; Y48-F180 AromaticContact CE1-CE1 3.7Å; Y48-F180 HydrophobicContact CE1-CE1 3.7Å; Y48-F180 AromaticContact CE1-CZ 3.76Å; Y48-F180 HydrophobicContact CE1-CZ 3.76Å; Y48-F180 AromaticContact CE2-CD1 3.81Å; Y48-F180 HydrophobicContact CE2-CD1 3.81Å; Y48-F180 AromaticContact CE2-CE1 3.54Å; Y48-F180 HydrophobicContact CE2-CE1 3.54Å; Y48-F180 HydrophobicContact CE2-CZ 4.2Å; Y48-F180 AromaticContact CZ-CD1 3.97Å; Y48-F180 AromaticContact CZ-CE1 3.22Å; Y48-F180 AromaticContact CZ-CZ 3.8Å; Y48-F180 VanDerWaalsContact OH-CE1 3.31Å; Y48-F180 WeakPolarHBondContact OH-CE1 3.26Å
49	L	56.9	Low	54.7	Low	12 Å²	12	66.2 Å²	66.2	6%	0.063	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	122.2	168.2	-176.7	72.4	0	0	0	109.1	D27 V55 L147 F177 L208	D27-L49 HydrophobicContact CB-CB 3.93Å; L49-V55 HydrophobicContact CD2-CG1 3.99Å; L49-L147 HydrophobicContact CD1-CD1 3.58Å; L49-F177 HydrophobicContact CD1-CB 4.42Å; L49-L208 HydrophobicContact CD2-CD1 3.89Å; L49-L208 HydrophobicContact CD2-CD2 3.23Å; L49-L208 HydrophobicContact CD2-CG 4.18Å
50	F	55.8	Low	54.5	Low	15 Å²	15	67.2 Å²	67.2	7%	0.066	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	135.4	176	-73.7	-85.9	0	0	0	111.4	L24 F165 I168 L176 V178	L24-F50 HydrophobicContact CD2-CE1 4.25Å; F50-F165 HydrophobicContact CE1-CD1 4.33Å; F50-F165 HydrophobicContact CE2-CD1 4.39Å; F50-F165 HydrophobicContact CE2-CE1 4.18Å; F50-F165 AromaticContact CZ-CD1 3.52Å; F50-F165 HydrophobicContact CZ-CD1 3.52Å; F50-F165 AromaticContact CZ-CE1 3.7Å; F50-F165 HydrophobicContact CZ-CE1 3.7Å; F50-I168 HydrophobicContact CB-CG2 4.24Å; F50-I168 HydrophobicContact CD1-CB 4.39Å; F50-I168 HydrophobicContact CD1-CG2 3.35Å; F50-I168 HydrophobicContact CD2-CD1 4.42Å; F50-I168 HydrophobicContact CD2-CG2 3.93Å; F50-I168 HydrophobicContact CE1-CB 4.03Å; F50-I168 HydrophobicContact CE1-CG2 3.46Å; F50-I168 VanDerWaalsContact CE1-CG2 3.46Å; F50-I168 HydrophobicContact CE2-CD1 3.82Å; F50-I168 HydrophobicContact CE2-CG2 4.03Å; F50-I168 HydrophobicContact CG-CG2 3.56Å; F50-I168 HydrophobicContact CZ-CB 4.08Å; F50-I168 HydrophobicContact CZ-CD1 3.94Å; F50-I168 HydrophobicContact CZ-CG2 3.78Å; F50-L176 HydrophobicContact CD2-CB 4.45Å; F50-L176 HydrophobicContact CD2-CD2 4.29Å; F50-L176 HydrophobicContact CD2-CG 4.41Å; F50-L176 PolarHBondContact N-O 3.22Å; F50-V178 HydrophobicContact CD2-CG2 4.45Å; F50-V178 HydrophobicContact CE2-CG2 3.85Å
51	P	51.7	Low	54.2	Low	72 Å²	72	66 Å²	66	47%	0.468	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-81.7	138	-151.6	29	-36	0	0	0	115.2
52	N	50.2	Low	54	Low	62 Å²	62	60.5 Å²	60.5	33%	0.332	31%	0.314	S	S	.	.			trans	-127.8	123.9	141.3	-114.9	-32.3	0	0	0	105.8	L54 V55 F173	N52-L54 PolarHBondContact O-N 3.32Å; N52-V55 HydrophobicContact CB-CG2 3.5Å; N52-V55 VanDerWaalsContact CB-CG2 3.5Å; N52-V55 VanDerWaalsContact O-CB 3.3Å; N52-V55 WeakPolarHBondContact O-CB 3.38Å; N52-V55 WeakPolarHBondContact O-CG2 3.2Å; N52-V55 PolarHBondContact O-N 2.85Å; N52-F173 PolarHBondContact ND2-O 2.9Å
53	D	51.8	Low	53.8	Low	127 Å²	127	58.7 Å²	58.7	68%	0.679	31%	0.306	S	S	*	.	H	α-helix	trans	-55.8	-29	179.8	-68.2	-43.2	0	0	0	112.4	V55 R56 S57	D53-V55 VanDerWaalsContact C-N 3.29Å; D53-V55 PolarHBondContact O-N 2.95Å; D53-R56 PolarHBondContact O-N 3.05Å; D53-S57 PolarHBondContact O-N 3.47Å; D53-S57 VanDerWaalsContact O-N 3.07Å
54	L	49.6	Very low	53.8	Low	113 Å²	113	57.7 Å²	57.7	59%	0.592	30%	0.3	S	S	*	.	H	α-helix	trans	-58	-40.5	173.1	-174.7	65.4	0	0	0	112	N52 S57 M58	N52-L54 PolarHBondContact O-N 3.32Å; L54-S57 PolarHBondContact O-N 2.8Å; L54-M58 HydrophobicContact CD1-CG 4.31Å; L54-M58 HydrophobicContact CD1-SD 3.78Å; L54-M58 HydrophobicContact CD2-SD 4.17Å; L54-M58 HydrophobicContact CG-CG 4.43Å; L54-M58 HydrophobicContact CG-SD 3.63Å; L54-M58 VanDerWaalsContact O-CB 3.3Å; L54-M58 WeakPolarHBondContact O-CB 3.42Å; L54-M58 VanDerWaalsContact O-CG 3.23Å; L54-M58 WeakPolarHBondContact O-CG 3.45Å; L54-M58 PolarHBondContact O-N 3.35Å
55	V	51.6	Low	53.6	Low	2 Å²	2	55.5 Å²	55.5	1%	0.012	30%	0.296	C	S	.	.	H	α-helix	trans	-62.2	-47.7	177.9	-174.3	0	0	0	0	110.2	L49 N52 D53 S57 M58 A59 F175 L208	L49-V55 HydrophobicContact CD2-CG1 3.99Å; N52-V55 HydrophobicContact CB-CG2 3.5Å; N52-V55 VanDerWaalsContact CB-CG2 3.5Å; N52-V55 VanDerWaalsContact O-CB 3.3Å; N52-V55 WeakPolarHBondContact O-CB 3.38Å; N52-V55 WeakPolarHBondContact O-CG2 3.2Å; N52-V55 PolarHBondContact O-N 2.85Å; D53-V55 VanDerWaalsContact C-N 3.29Å; D53-V55 PolarHBondContact O-N 2.95Å; V55-S57 VanDerWaalsContact C-N 3.28Å; V55-S57 PolarHBondContact O-N 3.34Å; V55-M58 CarbonylContact O-C 3.01Å; V55-M58 PolarHBondContact O-N 2.97Å; V55-A59 VanDerWaalsContact O-CA 3.27Å; V55-A59 WeakPolarHBondContact O-CA 3.24Å; V55-A59 WeakPolarHBondContact O-CB 3.22Å; V55-A59 PolarHBondContact O-N 3.45Å; V55-F175 HydrophobicContact CB-CD1 4.17Å; V55-F175 HydrophobicContact CB-CE1 3.63Å; V55-F175 HydrophobicContact CB-CZ 4.46Å; V55-F175 HydrophobicContact CG1-CD1 3.71Å; V55-F175 HydrophobicContact CG1-CE1 3.38Å; V55-F175 HydrophobicContact CG2-CD1 3.45Å; V55-F175 VanDerWaalsContact CG2-CD1 3.45Å; V55-F175 HydrophobicContact CG2-CE1 2.91Å; V55-F175 HydrophobicContact CG2-CE2 4.46Å; V55-F175 HydrophobicContact CG2-CG 4.45Å; V55-F175 HydrophobicContact CG2-CZ 3.47Å; V55-F175 VanDerWaalsContact CG2-CZ 3.47Å; V55-L208 HydrophobicContact CG1-CD2 3.64Å
56	R	53.1	Low	53.7	Low	80 Å²	80	58.4 Å²	58.4	30%	0.302	31%	0.309	S	S	.	.	H	α-helix	trans	-62.6	-39.3	179.3	-75.9	179.6	-172	157	-10.6	111.9	E25 D27 D53 M58	E25-R56 IonicContact OE2-CZ 2.78Å; E25-R56 IonicContact OE2-NH1 2.89Å; E25-R56 PolarHBondContact OE2-NH1 3.37Å; E25-R56 IonicContact OE2-NH2 2.84Å; E25-R56 PolarHBondContact OE2-NH2 2.85Å; D27-R56 IonicContact OD2-NE 3.97Å; D27-R56 IonicContact OD2-NH2 3.57Å; D53-R56 PolarHBondContact O-N 3.05Å; R56-M58 PolarHBondContact O-N 3.11Å
57	S	50.8	Low	53.8	Low	98 Å²	98	57.4 Å²	57.4	69%	0.685	31%	0.307	S	S	*	.	H	α-helix	trans	-63.7	-32.3	173.9	-173.5	0	0	0	0	112.3	D53 L54 V55	D53-S57 PolarHBondContact O-N 3.47Å; D53-S57 VanDerWaalsContact O-N 3.07Å; L54-S57 PolarHBondContact O-N 2.8Å; V55-S57 VanDerWaalsContact C-N 3.28Å; V55-S57 PolarHBondContact O-N 3.34Å
58	M	49.5	Very low	53.8	Low	62 Å²	62	59.6 Å²	59.6	31%	0.305	32%	0.321	S	S	.	.	H	α-helix	trans	-96.3	-16.3	-177.4	-69.4	177.3	50.6	0	0	113.7	L54 V55 R56 N60 S61 I62	L54-M58 HydrophobicContact CD1-CG 4.31Å; L54-M58 HydrophobicContact CD1-SD 3.78Å; L54-M58 HydrophobicContact CD2-SD 4.17Å; L54-M58 HydrophobicContact CG-CG 4.43Å; L54-M58 HydrophobicContact CG-SD 3.63Å; L54-M58 VanDerWaalsContact O-CB 3.3Å; L54-M58 WeakPolarHBondContact O-CB 3.42Å; L54-M58 VanDerWaalsContact O-CG 3.23Å; L54-M58 WeakPolarHBondContact O-CG 3.45Å; L54-M58 PolarHBondContact O-N 3.35Å; V55-M58 CarbonylContact O-C 3.01Å; V55-M58 PolarHBondContact O-N 2.97Å; R56-M58 PolarHBondContact O-N 3.11Å; M58-N60 PolarHBondContact O-N 3.36Å; M58-N60 VanDerWaalsContact O-N 3.15Å; M58-S61 CarbonylContact O-C 3.27Å; M58-S61 WeakPolarHBondContact O-CA 3.38Å; M58-S61 PolarHBondContact O-N 3.29Å; M58-S61 PolarHBondContact O-OG 3.21Å; M58-I62 HydrophobicContact CB-CD1 3.42Å; M58-I62 VanDerWaalsContact CB-CD1 3.42Å; M58-I62 HydrophobicContact CB-CG1 3.81Å; M58-I62 HydrophobicContact CE-CD1 3.92Å; M58-I62 HydrophobicContact CE-CG1 3.94Å; M58-I62 WeakPolarHBondContact O-CG1 3.38Å; M58-I62 PolarHBondContact O-N 3.31Å
59	A	52.2	Low	54.2	Low	6 Å²	6	58.2 Å²	58.2	5%	0.05	32%	0.319	C	S	.	.	H	α-helix	trans	-55.2	-39.6	-168.4	0	0	0	0	0	112.8	V55 S61 L208	V55-A59 VanDerWaalsContact O-CA 3.27Å; V55-A59 WeakPolarHBondContact O-CA 3.24Å; V55-A59 WeakPolarHBondContact O-CB 3.22Å; V55-A59 PolarHBondContact O-N 3.45Å; A59-S61 PolarHBondContact O-N 3.4Å; A59-L208 HydrophobicContact CB-CB 3.84Å; A59-L208 HydrophobicContact CB-CD2 3.62Å; A59-L208 HydrophobicContact CB-CG 3.93Å
60	N	50.8	Low	54.3	Low	129 Å²	129	64.4 Å²	64.4	69%	0.69	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-13.5	178.8	-65.3	-31	0	0	0	113	M58	M58-N60 PolarHBondContact O-N 3.36Å; M58-N60 VanDerWaalsContact O-N 3.15Å
61	S	50.2	Low	54.5	Low	88 Å²	88	67.8 Å²	67.8	62%	0.615	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.8	-15.3	-175.8	57.7	0	0	0	0	114.7	M58 A59 K63	M58-S61 CarbonylContact O-C 3.27Å; M58-S61 WeakPolarHBondContact O-CA 3.38Å; M58-S61 PolarHBondContact O-N 3.29Å; M58-S61 PolarHBondContact O-OG 3.21Å; A59-S61 PolarHBondContact O-N 3.4Å; S61-K63 PolarHBondContact O-N 3Å
62	I	52.7	Low	54.7	Low	6 Å²	6	66 Å²	66	3%	0.031	36%	0.359	C	S	.	.	P	Polyproline II helix	trans	-77.8	125.1	178.9	-66.1	158.9	0	0	0	108.9	M58 F64 V109	M58-I62 HydrophobicContact CB-CD1 3.42Å; M58-I62 VanDerWaalsContact CB-CD1 3.42Å; M58-I62 HydrophobicContact CB-CG1 3.81Å; M58-I62 HydrophobicContact CE-CD1 3.92Å; M58-I62 HydrophobicContact CE-CG1 3.94Å; M58-I62 WeakPolarHBondContact O-CG1 3.38Å; M58-I62 PolarHBondContact O-N 3.31Å; I62-F64 HydrophobicContact CB-CE2 4.42Å; I62-F64 HydrophobicContact CB-CZ 4.47Å; I62-F64 HydrophobicContact CG2-CD1 4.3Å; I62-F64 HydrophobicContact CG2-CD2 4.22Å; I62-F64 HydrophobicContact CG2-CE1 3.99Å; I62-F64 HydrophobicContact CG2-CE2 3.91Å; I62-F64 HydrophobicContact CG2-CG 4.41Å; I62-F64 HydrophobicContact CG2-CZ 3.79Å; I62-V109 HydrophobicContact CG1-CG2 4.48Å; I62-V109 HydrophobicContact CG2-CB 3.74Å; I62-V109 HydrophobicContact CG2-CG2 3.46Å; I62-V109 VanDerWaalsContact CG2-CG2 3.46Å
63	K	54.5	Low	55.2	Low	125 Å²	125	64.1 Å²	64.1	54%	0.543	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	133.6	161.5	-72.3	-179.4	-179.6	175.3	0	108.5	S61 H108 V109	S61-K63 PolarHBondContact O-N 3Å; K63-H108 VanDerWaalsContact O-CA 3.3Å; K63-H108 WeakPolarHBondContact O-CA 3.25Å; K63-V109 PolarHBondContact O-N 3Å
64	F	58.7	Low	55.7	Low	2 Å²	2	60.5 Å²	60.5	1%	0.009	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	127.1	169.6	-62.8	-86.4	0	0	0	109.7	L29 I62 V109 L111 L147 C206 L208	L29-F64 HydrophobicContact CD1-CD2 4.41Å; L29-F64 HydrophobicContact CD1-CE2 4.26Å; I62-F64 HydrophobicContact CB-CE2 4.42Å; I62-F64 HydrophobicContact CB-CZ 4.47Å; I62-F64 HydrophobicContact CG2-CD1 4.3Å; I62-F64 HydrophobicContact CG2-CD2 4.22Å; I62-F64 HydrophobicContact CG2-CE1 3.99Å; I62-F64 HydrophobicContact CG2-CE2 3.91Å; I62-F64 HydrophobicContact CG2-CG 4.41Å; I62-F64 HydrophobicContact CG2-CZ 3.79Å; F64-V109 WeakPolarHBondContact CA-O 3.49Å; F64-V109 HydrophobicContact CD1-CB 3.66Å; F64-V109 HydrophobicContact CD1-CG1 3.75Å; F64-V109 HydrophobicContact CE1-CB 3.67Å; F64-V109 HydrophobicContact CE1-CG1 3.56Å; F64-V109 HydrophobicContact CE1-CG2 4.48Å; F64-L111 HydrophobicContact CB-CB 4.23Å; F64-L147 HydrophobicContact CD1-CB 4.01Å; F64-L147 HydrophobicContact CD1-CD2 4.11Å; F64-L147 HydrophobicContact CE1-CB 3.68Å; F64-L147 HydrophobicContact CE1-CD2 3.75Å; F64-L147 HydrophobicContact CE1-CG 4.34Å; F64-L147 HydrophobicContact CZ-CD2 3.97Å; F64-C206 HydrophobicContact CB-CB 4.03Å; F64-C206 HydrophobicContact CD2-CB 4.02Å; F64-C206 WeakPolarHBondContact CD2-O 3.48Å; F64-C206 HydrophobicContact CG-CB 4.38Å; F64-L208 HydrophobicContact CE2-CB 4.36Å
65	D	56.6	Low	56.1	Low	59 Å²	59	60.1 Å²	60.1	32%	0.316	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	129.1	169	-73.2	-6.8	0	0	0	108.3	H108 V109 L110 L111	D65-H108 IonicContact OD1-CE1 3.9Å; D65-H108 IonicContact OD1-ND1 2.81Å; D65-H108 PolarHBondContact OD1-ND1 2.8Å; D65-H108 IonicContact OD2-CE1 2.84Å; D65-H108 IonicContact OD2-CG 3.75Å; D65-H108 IonicContact OD2-ND1 3.09Å; D65-H108 PolarHBondContact OD2-ND1 3.42Å; D65-V109 PolarHBondContact N-O 3.41Å; D65-L110 WeakPolarHBondContact O-CA 3.17Å; D65-L111 PolarHBondContact O-N 3.14Å
66	F	59.5	Low	56.5	Low	64 Å²	64	67.4 Å²	67.4	28%	0.281	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	131.7	178.2	171.1	-113.2	0	0	0	110.9	P68 L111 F113 F198	F66-P68 HydrophobicContact CE1-CG 3.89Å; F66-P68 HydrophobicContact CZ-CB 4.31Å; F66-P68 HydrophobicContact CZ-CG 4.1Å; F66-L111 WeakPolarHBondContact CD2-O 3.25Å; F66-F113 HydrophobicContact CD2-CD2 4.01Å; F66-F113 AromaticContact CD2-CE2 3.98Å; F66-F113 HydrophobicContact CD2-CE2 3.98Å; F66-F113 AromaticContact CE2-CD2 3.66Å; F66-F113 HydrophobicContact CE2-CD2 3.66Å; F66-F113 HydrophobicContact CE2-CE2 4.07Å; F66-F198 HydrophobicContact CB-CD1 4.01Å; F66-F198 HydrophobicContact CB-CE1 3.81Å; F66-F198 HydrophobicContact CD1-CB 4.45Å; F66-F198 AromaticContact CD1-CD1 3.58Å; F66-F198 HydrophobicContact CD1-CD1 3.58Å; F66-F198 HydrophobicContact CD1-CE1 4.27Å; F66-F198 HydrophobicContact CD1-CG 4.34Å; F66-F198 AromaticContact CD2-CD1 3.84Å; F66-F198 HydrophobicContact CD2-CD1 3.84Å; F66-F198 AromaticContact CD2-CE1 3.97Å; F66-F198 HydrophobicContact CD2-CE1 3.97Å; F66-F198 HydrophobicContact CD2-CG 4.43Å; F66-F198 HydrophobicContact CE1-CB 4Å; F66-F198 AromaticContact CE1-CD1 3.97Å; F66-F198 HydrophobicContact CE1-CD1 3.97Å; F66-F198 HydrophobicContact CE1-CG 4.27Å; F66-F198 HydrophobicContact CE2-CD1 4.25Å; F66-F198 HydrophobicContact CE2-CG 4.42Å; F66-F198 AromaticContact CG-CD1 3.5Å; F66-F198 HydrophobicContact CG-CD1 3.5Å; F66-F198 VanDerWaalsContact CG-CD1 3.5Å; F66-F198 AromaticContact CG-CE1 3.73Å; F66-F198 HydrophobicContact CG-CE1 3.73Å; F66-F198 HydrophobicContact CG-CG 4.4Å; F66-F198 HydrophobicContact CZ-CB 4.14Å; F66-F198 HydrophobicContact CZ-CD1 4.28Å; F66-F198 HydrophobicContact CZ-CG 4.31Å
67	V	59.3	Low	57	Low	34 Å²	34	63.8 Å²	63.8	21%	0.206	36%	0.357	C	S	.	.			trans	-127.8	122.8	169.7	178.5	0	0	0	0	108.9	L72 L110 L111 T112	V67-L72 HydrophobicContact CB-CD1 4.25Å; V67-L72 HydrophobicContact CB-CG 4.33Å; V67-L72 HydrophobicContact CG1-CD1 4.14Å; V67-L72 HydrophobicContact CG1-CD2 4.12Å; V67-L72 HydrophobicContact CG1-CG 3.7Å; V67-L110 HydrophobicContact CB-CD2 4.34Å; V67-L110 HydrophobicContact CG2-CD2 3.42Å; V67-L110 VanDerWaalsContact CG2-CD2 3.42Å; V67-L110 HydrophobicContact CG2-CG 4.47Å; V67-L111 PolarHBondContact N-O 3.12Å; V67-T112 PolarHBondContact O-OG1 3.48Å; V67-T112 VanDerWaalsContact O-OG1 3.07Å
68	P	60.9	Low	57.5	Low	45 Å²	45	64.3 Å²	64.3	29%	0.292	35%	0.352	S	S	.	.			trans	-53.2	144	175.9	-24.4	32.5	0	0	0	111.6	F66 E70 S71 L72	F66-P68 HydrophobicContact CE1-CG 3.89Å; F66-P68 HydrophobicContact CZ-CB 4.31Å; F66-P68 HydrophobicContact CZ-CG 4.1Å; P68-E70 PolarHBondContact O-N 3.08Å; P68-S71 WeakPolarHBondContact O-CB 3.21Å; P68-S71 PolarHBondContact O-N 3.46Å; P68-L72 PolarHBondContact O-N 2.89Å
69	S	61.7	Low	58.1	Low	22 Å²	22	61.3 Å²	61.3	15%	0.154	34%	0.337	C	S	.	.	H	α-helix	trans	-54.4	-41.8	176.4	51.9	0	0	0	0	111.2	S71 L72 W73 T112	S69-S71 PolarHBondContact O-N 3.02Å; S69-S71 VanDerWaalsContact O-N 3.11Å; S69-L72 PolarHBondContact O-N 3.48Å; S69-W73 WeakPolarHBondContact O-CB 3.4Å; S69-W73 PolarHBondContact O-N 3.01Å; S69-T112 PolarHBondContact N-OG1 2.94Å
70	E	59.4	Low	58.6	Low	141 Å²	141	61.1 Å²	61.1	66%	0.659	34%	0.336	S	S	*	.	H	α-helix	trans	-57.6	-24	175.7	-55.7	144.3	-145.6	0	0	114.1	P68 W73	P68-E70 PolarHBondContact O-N 3.08Å; E70-W73 CarbonylContact C-O 3.44Å
71	S	59.8	Low	59.3	Low	87 Å²	87	55.9 Å²	55.9	61%	0.608	31%	0.309	S	S	*	.	H	α-helix	trans	-89.2	-23.4	177.8	-61.7	0	0	0	0	112.5	P68 S69	P68-S71 WeakPolarHBondContact O-CB 3.21Å; P68-S71 PolarHBondContact O-N 3.46Å; S69-S71 PolarHBondContact O-N 3.02Å; S69-S71 VanDerWaalsContact O-N 3.11Å
72	L	56.3	Low	60	Low	34 Å²	34	53.9 Å²	53.9	18%	0.178	29%	0.291	C	S	.	.	H	α-helix	trans	-91.2	-33	176.9	-72.2	166.8	0	0	0	112.3	V67 P68 S69 I99 L110 T112	V67-L72 HydrophobicContact CB-CD1 4.25Å; V67-L72 HydrophobicContact CB-CG 4.33Å; V67-L72 HydrophobicContact CG1-CD1 4.14Å; V67-L72 HydrophobicContact CG1-CD2 4.12Å; V67-L72 HydrophobicContact CG1-CG 3.7Å; P68-L72 PolarHBondContact O-N 2.89Å; S69-L72 PolarHBondContact O-N 3.48Å; L72-I99 WeakPolarHBondContact O-CG2 3.48Å; L72-L110 HydrophobicContact CD2-CD1 3.98Å; L72-T112 VanDerWaalsContact CD1-CB 3.47Å; L72-T112 HydrophobicContact CD1-CG2 3.88Å
73	W	60.1	Low	60.6	Low	22 Å²	22	53.8 Å²	53.8	8%	0.083	29%	0.291	C	S	.	.	S	Bend	trans	-121.1	167.6	-172.2	-43.6	111.1	0	0	0	110.5	S69 E70 V77 V83 I99 H138 V142	S69-W73 WeakPolarHBondContact O-CB 3.4Å; S69-W73 PolarHBondContact O-N 3.01Å; E70-W73 CarbonylContact C-O 3.44Å; W73-V77 HydrophobicContact CB-CB 3.92Å; W73-V77 HydrophobicContact CB-CG1 4.05Å; W73-V77 HydrophobicContact CB-CG2 3.99Å; W73-V77 HydrophobicContact CG-CG1 4.41Å; W73-V83 HydrophobicContact CD2-CG1 4Å; W73-V83 HydrophobicContact CD2-CG2 3.88Å; W73-V83 HydrophobicContact CE3-CG1 3.9Å; W73-V83 HydrophobicContact CE3-CG2 4.44Å; W73-V83 HydrophobicContact CG-CG2 3.93Å; W73-V83 HydrophobicContact CH2-CG1 3.72Å; W73-V83 HydrophobicContact CZ2-CG1 3.78Å; W73-V83 HydrophobicContact CZ3-CG1 3.77Å; W73-I99 HydrophobicContact CE3-CD1 3.68Å; W73-I99 HydrophobicContact CE3-CG2 4.26Å; W73-I99 HydrophobicContact CZ3-CD1 3.75Å; W73-I99 HydrophobicContact CZ3-CG2 4.04Å; W73-H138 AromaticContact CH2-CE1 3.39Å; W73-H138 WeakPolarHBondContact CH2-CE1 3.41Å; W73-H138 AromaticContact CH2-NE2 3.67Å; W73-H138 AromaticContact CZ3-CE1 3.68Å; W73-V142 HydrophobicContact CH2-CG1 4.46Å; W73-V142 HydrophobicContact CH2-CG2 4.3Å; W73-V142 HydrophobicContact CZ3-CG2 4.24Å
74	S	61.8	Low	60.9	Low	52 Å²	52	47.8 Å²	47.8	36%	0.364	27%	0.265	S	S	.	.			trans	-59	146	172.1	177.6	0	0	0	0	109.8	E76 V77	S74-E76 PolarHBondContact O-N 3.27Å; S74-E76 PolarHBondContact OG-N 3.35Å; S74-V77 VanDerWaalsContact O-CB 3.27Å; S74-V77 WeakPolarHBondContact O-CB 3.35Å; S74-V77 VanDerWaalsContact O-CG2 3.28Å; S74-V77 WeakPolarHBondContact O-CG2 3.44Å; S74-V77 PolarHBondContact O-N 3.32Å
75	P	58.9	Low	61.2	Low	105 Å²	105	53.1 Å²	53.1	68%	0.682	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-9.2	174.4	25	-35.3	0	0	0	113.9
76	E	60.4	Low	61.5	Low	155 Å²	155	54.3 Å²	54.3	72%	0.724	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-8.8	172.7	-62.3	177.4	172	0	0	113.1	S74	S74-E76 PolarHBondContact O-N 3.27Å; S74-E76 PolarHBondContact OG-N 3.35Å
77	V	62.1	Low	61.4	Low	4 Å²	4	52.3 Å²	52.3	2%	0.024	29%	0.29	C	S	.	.			trans	-97.4	104.3	-173.9	-174.3	0	0	0	0	110	W73 S74 D82 V83 L86	W73-V77 HydrophobicContact CB-CB 3.92Å; W73-V77 HydrophobicContact CB-CG1 4.05Å; W73-V77 HydrophobicContact CB-CG2 3.99Å; W73-V77 HydrophobicContact CG-CG1 4.41Å; S74-V77 VanDerWaalsContact O-CB 3.27Å; S74-V77 WeakPolarHBondContact O-CB 3.35Å; S74-V77 VanDerWaalsContact O-CG2 3.28Å; S74-V77 WeakPolarHBondContact O-CG2 3.44Å; S74-V77 PolarHBondContact O-N 3.32Å; V77-D82 HydrophobicContact CB-CB 4.34Å; V77-D82 HydrophobicContact CG1-CB 3.7Å; V77-V83 HydrophobicContact CG1-CB 4.28Å; V77-V83 HydrophobicContact CG1-CG2 3.28Å; V77-L86 HydrophobicContact CB-CD1 4.41Å; V77-L86 HydrophobicContact CG2-CD1 3.06Å
78	N	61.6	Low	61.3	Low	108 Å²	108	52.5 Å²	52.5	58%	0.578	29%	0.292	S	S	*	.			trans	-102.9	-31	179.2	-64.5	-31.2	0	0	0	111.5	D82 P115	N78-D82 PolarHBondContact N-OD2 3.11Å; N78-D82 VanDerWaalsContact N-OD2 3.1Å; N78-P115 WeakPolarHBondContact O-CD 3.34Å; N78-P115 WeakPolarHBondContact O-CG 3.44Å
79	S	63.4	Low	61.2	Low	0 Å²	0	53.9 Å²	53.9	0%	0	30%	0.303	C	S	.	.	S	Bend	trans	-110.7	157	-175.6	79.7	0	0	0	0	112.8	C81 D82 V83	S79-C81 PolarHBondContact O-N 3.48Å; S79-C81 PolarHBondContact OG-N 3.27Å; S79-D82 PolarHBondContact N-OD2 2.86Å; S79-D82 WeakPolarHBondContact O-CB 3.35Å; S79-D82 PolarHBondContact O-N 3.1Å; S79-D82 VanDerWaalsContact O-N 3.16Å; S79-D82 PolarHBondContact OG-N 3.47Å; S79-D82 PolarHBondContact OG-OD1 2.95Å; S79-D82 PolarHBondContact OG-OD2 3Å; S79-D82 VanDerWaalsContact OG-OD2 3.09Å; S79-V83 PolarHBondContact O-N 3.18Å
80	F	62.4	Low	60.6	Low	2 Å²	2	62 Å²	62	1%	0.009	34%	0.335	C	S	.	.	H	α-helix	trans	-58.2	-33.3	168.1	-179.1	-104	0	0	0	112.3	D82 V83 M84 L114 P115 F116 F130 W135 V148 I150	F80-D82 VanDerWaalsContact C-N 3.33Å; F80-D82 PolarHBondContact O-N 2.92Å; F80-V83 PolarHBondContact O-N 3.09Å; F80-M84 HydrophobicContact CD1-CG 4.33Å; F80-M84 HydrophobicContact CE1-CG 4.13Å; F80-M84 HydrophobicContact CZ-CG 4.37Å; F80-M84 VanDerWaalsContact O-CG 3.29Å; F80-M84 WeakPolarHBondContact O-CG 3.13Å; F80-M84 PolarHBondContact O-N 2.86Å; F80-L114 HydrophobicContact CB-CB 3.9Å; F80-L114 HydrophobicContact CD2-CB 4.14Å; F80-L114 HydrophobicContact CD2-CD1 3.74Å; F80-P115 PolarHBondContact N-O 2.93Å; F80-F116 HydrophobicContact CB-CD2 4.36Å; F80-F116 AromaticContact CD1-CD2 3.92Å; F80-F116 HydrophobicContact CD1-CD2 3.92Å; F80-F116 HydrophobicContact CD1-CE2 4.04Å; F80-F130 AromaticContact CE1-CD2 3.58Å; F80-F130 HydrophobicContact CE1-CD2 3.58Å; F80-F130 AromaticContact CE1-CE2 3.66Å; F80-F130 HydrophobicContact CE1-CE2 3.66Å; F80-F130 HydrophobicContact CZ-CD2 4.22Å; F80-F130 AromaticContact CZ-CE2 3.83Å; F80-F130 HydrophobicContact CZ-CE2 3.83Å; F80-W135 HydrophobicContact CE1-CE3 4.5Å; F80-W135 HydrophobicContact CE1-CZ3 4.18Å; F80-W135 HydrophobicContact CE2-CE3 4.42Å; F80-W135 AromaticContact CE2-CH2 3.86Å; F80-W135 HydrophobicContact CE2-CH2 3.86Å; F80-W135 AromaticContact CE2-CZ3 3.4Å; F80-W135 HydrophobicContact CE2-CZ3 3.4Å; F80-W135 AromaticContact CZ-CE3 3.72Å; F80-W135 HydrophobicContact CZ-CE3 3.72Å; F80-W135 AromaticContact CZ-CH2 3.82Å; F80-W135 HydrophobicContact CZ-CH2 3.82Å; F80-W135 AromaticContact CZ-CZ3 3.09Å; F80-W135 HydrophobicContact CZ-CZ3 3.09Å; F80-V148 HydrophobicContact CD2-CG1 4.49Å; F80-V148 HydrophobicContact CE2-CG1 4.28Å; F80-I150 HydrophobicContact CD1-CD1 4.15Å; F80-I150 HydrophobicContact CD2-CD1 3.88Å; F80-I150 HydrophobicContact CD2-CG1 4.1Å; F80-I150 HydrophobicContact CE1-CD1 3.74Å; F80-I150 HydrophobicContact CE2-CD1 3.49Å; F80-I150 VanDerWaalsContact CE2-CD1 3.49Å; F80-I150 HydrophobicContact CE2-CG1 4.07Å; F80-I150 HydrophobicContact CG-CD1 4.17Å; F80-I150 HydrophobicContact CZ-CD1 3.36Å; F80-I150 HydrophobicContact CZ-CG1 4.41Å
81	C	65.3	Low	59.9	Low	19 Å²	19	58.5 Å²	58.5	13%	0.128	32%	0.324	C	S	.	.	H	α-helix	trans	-63.9	-38.7	176	-64.1	0	0	0	0	111.4	S79 V83 M84 E85 C129	S79-C81 PolarHBondContact O-N 3.48Å; S79-C81 PolarHBondContact OG-N 3.27Å; C81-V83 PolarHBondContact O-N 3.19Å; C81-M84 WeakPolarHBondContact O-CB 3.48Å; C81-M84 PolarHBondContact O-N 3.05Å; C81-E85 PolarHBondContact O-N 2.77Å; C81-C129 HydrophobicContact CB-CB 3.35Å; C81-C129 WeakPolarHBondContact CB-SG 3.26Å; C81-C129 WeakPolarHBondContact SG-CB 3.33Å; C81-C129 CovalentContact SG-SG 2.05Å; C81-C129 PolarHBondContact SG-SG 3.33Å
82	D	65.6	Low	59.1	Low	46 Å²	46	61.2 Å²	61.2	25%	0.246	34%	0.337	C	S	.	.	H	α-helix	trans	-63.6	-42	178	-59.2	-26.7	0	0	0	111.6	V77 N78 S79 F80 M84 E85 L86	V77-D82 HydrophobicContact CB-CB 4.34Å; V77-D82 HydrophobicContact CG1-CB 3.7Å; N78-D82 PolarHBondContact N-OD2 3.11Å; N78-D82 VanDerWaalsContact N-OD2 3.1Å; S79-D82 PolarHBondContact N-OD2 2.86Å; S79-D82 WeakPolarHBondContact O-CB 3.35Å; S79-D82 PolarHBondContact O-N 3.1Å; S79-D82 VanDerWaalsContact O-N 3.16Å; S79-D82 PolarHBondContact OG-N 3.47Å; S79-D82 PolarHBondContact OG-OD1 2.95Å; S79-D82 PolarHBondContact OG-OD2 3Å; S79-D82 VanDerWaalsContact OG-OD2 3.09Å; F80-D82 VanDerWaalsContact C-N 3.33Å; F80-D82 PolarHBondContact O-N 2.92Å; D82-M84 PolarHBondContact O-N 3Å; D82-E85 PolarHBondContact O-N 2.92Å; D82-L86 VanDerWaalsContact O-CB 3.3Å; D82-L86 WeakPolarHBondContact O-CB 3.38Å; D82-L86 WeakPolarHBondContact O-CG 3.44Å; D82-L86 PolarHBondContact O-N 3.33Å
83	V	63.7	Low	58.4	Low	3 Å²	3	63.9 Å²	63.9	2%	0.018	37%	0.372	C	S	.	.	H	α-helix	trans	-57.4	-44.1	175.4	174.2	0	0	0	0	110.5	W73 V77 S79 F80 C81 S87 L114 H138	W73-V83 HydrophobicContact CD2-CG1 4Å; W73-V83 HydrophobicContact CD2-CG2 3.88Å; W73-V83 HydrophobicContact CE3-CG1 3.9Å; W73-V83 HydrophobicContact CE3-CG2 4.44Å; W73-V83 HydrophobicContact CG-CG2 3.93Å; W73-V83 HydrophobicContact CH2-CG1 3.72Å; W73-V83 HydrophobicContact CZ2-CG1 3.78Å; W73-V83 HydrophobicContact CZ3-CG1 3.77Å; V77-V83 HydrophobicContact CG1-CB 4.28Å; V77-V83 HydrophobicContact CG1-CG2 3.28Å; S79-V83 PolarHBondContact O-N 3.18Å; F80-V83 PolarHBondContact O-N 3.09Å; C81-V83 PolarHBondContact O-N 3.19Å; V83-S87 WeakPolarHBondContact O-CB 3.21Å; V83-S87 PolarHBondContact O-N 3.48Å; V83-S87 PolarHBondContact O-OG 3.4Å; V83-L114 HydrophobicContact CB-CD1 4.46Å; V83-L114 HydrophobicContact CG2-CD1 3.75Å; V83-L114 HydrophobicContact CG2-CD2 3.89Å; V83-H138 WeakPolarHBondContact CG1-CE1 3.29Å
84	M	62	Low	57.3	Low	0 Å²	0	64.2 Å²	64.2	0%	0	38%	0.383	C	S	.	.	H	α-helix	trans	-67.3	-45.9	-178.9	-70.7	-59.3	-63.7	0	0	111.7	F80 C81 D82 S87 S88 L134 W135 H138	F80-M84 HydrophobicContact CD1-CG 4.33Å; F80-M84 HydrophobicContact CE1-CG 4.13Å; F80-M84 HydrophobicContact CZ-CG 4.37Å; F80-M84 VanDerWaalsContact O-CG 3.29Å; F80-M84 WeakPolarHBondContact O-CG 3.13Å; F80-M84 PolarHBondContact O-N 2.86Å; C81-M84 WeakPolarHBondContact O-CB 3.48Å; C81-M84 PolarHBondContact O-N 3.05Å; D82-M84 PolarHBondContact O-N 3Å; M84-S87 PolarHBondContact O-N 3.33Å; M84-S87 PolarHBondContact O-OG 3.02Å; M84-S88 WeakPolarHBondContact O-CB 3.37Å; M84-S88 PolarHBondContact O-N 2.93Å; M84-S88 VanDerWaalsContact O-N 3.09Å; M84-L134 HydrophobicContact CE-CB 3.68Å; M84-W135 HydrophobicContact CE-CB 3.76Å; M84-W135 HydrophobicContact CE-CD2 4.29Å; M84-W135 HydrophobicContact CE-CE3 3.59Å; M84-W135 HydrophobicContact CE-CG 4.39Å; M84-W135 HydrophobicContact CE-CZ3 4.43Å; M84-W135 HydrophobicContact CG-CE3 4.42Å; M84-W135 HydrophobicContact SD-CD2 4.25Å; M84-W135 HydrophobicContact SD-CE3 3.19Å; M84-W135 HydrophobicContact SD-CZ3 3.45Å; M84-W135 WeakPolarHBondContact SD-CZ3 3.34Å; M84-H138 HydrophobicContact CE-CB 4.26Å; M84-H138 HydrophobicContact SD-CB 3.9Å
85	E	65	Low	56.1	Low	114 Å²	114	67 Å²	67	53%	0.533	40%	0.4	S	S	.	.	H	α-helix	trans	-65.6	-43	177.1	-73.2	-165.8	173.3	0	0	112.5	C81 D82 S87 S88 S89	C81-E85 PolarHBondContact O-N 2.77Å; D82-E85 PolarHBondContact O-N 2.92Å; E85-S87 PolarHBondContact O-N 3Å; E85-S88 CarbonylContact O-C 3.56Å; E85-S88 WeakPolarHBondContact O-CA 3.46Å; E85-S88 WeakPolarHBondContact O-CB 3.39Å; E85-S88 PolarHBondContact O-N 3.5Å; E85-S88 PolarHBondContact O-OG 2.83Å; E85-S89 PolarHBondContact O-N 3.23Å
86	L	62.8	Low	55.2	Low	84 Å²	84	67 Å²	67	44%	0.44	40%	0.4	S	S	.	.	H	α-helix	trans	-63.2	-41.3	177.6	-81	165.9	0	0	0	112.7	V77 D82 S88 S89	V77-L86 HydrophobicContact CB-CD1 4.41Å; V77-L86 HydrophobicContact CG2-CD1 3.06Å; D82-L86 VanDerWaalsContact O-CB 3.3Å; D82-L86 WeakPolarHBondContact O-CB 3.38Å; D82-L86 WeakPolarHBondContact O-CG 3.44Å; D82-L86 PolarHBondContact O-N 3.33Å; L86-S88 PolarHBondContact O-N 3.3Å; L86-S89 WeakPolarHBondContact O-CB 3.17Å; L86-S89 PolarHBondContact O-N 3.27Å
87	S	57.8	Low	54.2	Low	22 Å²	22	64.6 Å²	64.6	15%	0.154	40%	0.395	C	S	.	.	H	α-helix	trans	-67.6	-23.5	174.3	69.1	0	0	0	0	113.1	V83 M84 E85 H138	V83-S87 WeakPolarHBondContact O-CB 3.21Å; V83-S87 PolarHBondContact O-N 3.48Å; V83-S87 PolarHBondContact O-OG 3.4Å; M84-S87 PolarHBondContact O-N 3.33Å; M84-S87 PolarHBondContact O-OG 3.02Å; E85-S87 PolarHBondContact O-N 3Å; S87-H138 WeakPolarHBondContact CB-ND1 3.35Å; S87-H138 VanDerWaalsContact OG-CB 3.31Å; S87-H138 WeakPolarHBondContact OG-CB 3.42Å; S87-H138 PolarHBondContact OG-ND1 3.45Å
88	S	57	Low	53.1	Low	37 Å²	37	67.5 Å²	67.5	26%	0.259	42%	0.416	S	S	.	.	H	α-helix	trans	-82.9	-22.2	174.3	91.7	0	0	0	0	113.4	M84 E85 L86 K90	M84-S88 WeakPolarHBondContact O-CB 3.37Å; M84-S88 PolarHBondContact O-N 2.93Å; M84-S88 VanDerWaalsContact O-N 3.09Å; E85-S88 CarbonylContact O-C 3.56Å; E85-S88 WeakPolarHBondContact O-CA 3.46Å; E85-S88 WeakPolarHBondContact O-CB 3.39Å; E85-S88 PolarHBondContact O-N 3.5Å; E85-S88 PolarHBondContact O-OG 2.83Å; L86-S88 PolarHBondContact O-N 3.3Å; S88-K90 VanDerWaalsContact C-N 3.28Å; S88-K90 PolarHBondContact O-N 3.5Å
89	S	57.6	Low	52.1	Low	74 Å²	74	64.6 Å²	64.6	52%	0.517	40%	0.4	S	S	.	.			trans	-63.2	92.8	179.9	-175.2	0	0	0	0	109	E85 L86 V91	E85-S89 PolarHBondContact O-N 3.23Å; L86-S89 WeakPolarHBondContact O-CB 3.17Å; L86-S89 PolarHBondContact O-N 3.27Å; S89-V91 VanDerWaalsContact C-N 3.29Å; S89-V91 PolarHBondContact O-N 2.74Å
90	K	49.1	Very low	50.7	Low	192 Å²	192	71.6 Å²	71.6	84%	0.835	43%	0.432	S	S	*	.			trans	-70.3	90.9	174	-155.5	180	-166.5	-179.9	0	105.6	S88 T92	S88-K90 VanDerWaalsContact C-N 3.28Å; S88-K90 PolarHBondContact O-N 3.5Å; K90-T92 PolarHBondContact O-N 2.98Å
91	V	45.5	Very low	49.6	Very low	69 Å²	69	73.9 Å²	73.9	42%	0.418	45%	0.447	S	S	.	.			trans	-52.6	108.8	175.9	-178.1	0	0	0	0	107.1	S89 G93 G94 V97	S89-V91 VanDerWaalsContact C-N 3.29Å; S89-V91 PolarHBondContact O-N 2.74Å; V91-G93 PolarHBondContact O-N 2.93Å; V91-G94 PolarHBondContact O-N 3.28Å; V91-G94 VanDerWaalsContact O-N 3.14Å; V91-V97 HydrophobicContact CG2-CG2 4.2Å
92	T	42.8	Very low	48.3	Very low	143 Å²	143	79.3 Å²	79.3	88%	0.877	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	97.8	-178.7	46.6	0	0	0	0	107.9	K90	K90-T92 PolarHBondContact O-N 2.98Å
93	G	42.4	Very low	47	Very low	90 Å²	90	78.2 Å²	78.2	93%	0.928	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.3	4.5	179.6	0	0	0	0	0	116	V91	V91-G93 PolarHBondContact O-N 2.93Å
94	G	36.3	Very low	45.7	Very low	29 Å²	29	84.7 Å²	84.7	30%	0.299	50%	0.502	S	S	.	.	S	Bend	trans	-100.5	152	168.9	0	0	0	0	0	111	V91	V91-G94 PolarHBondContact O-N 3.28Å; V91-G94 VanDerWaalsContact O-N 3.14Å
95	P	37.3	Very low	44.5	Very low	112 Å²	112	90.1 Å²	90.1	73%	0.727	53%	0.53	S	S	*	.	P	Polyproline II helix	trans	-54.2	143.8	164.2	25	-30.8	0	0	0	108.2	V97	P95-V97 PolarHBondContact O-N 3.4Å
96	P	38.7	Very low	43.7	Very low	105 Å²	105	89.3 Å²	89.3	68%	0.682	54%	0.537	S	S	*	.	P	Polyproline II helix	trans	-49.5	132	172.9	22.2	-31.7	0	0	0	107.2	S98	P96-S98 PolarHBondContact O-N 2.93Å
97	V	39.4	Very low	43	Very low	103 Å²	103	90.8 Å²	90.8	62%	0.624	55%	0.546	S	S	*	.			trans	-64.8	88.1	169.1	-176.9	0	0	0	0	104.7	V91 P95 I99	V91-V97 HydrophobicContact CG2-CG2 4.2Å; P95-V97 PolarHBondContact O-N 3.4Å; V97-I99 HydrophobicContact CG1-CG1 3.92Å; V97-I99 PolarHBondContact O-N 3.17Å
98	S	38.3	Very low	42.5	Very low	65 Å²	65	91.8 Å²	91.8	46%	0.455	55%	0.548	S	S	.	.			trans	-66.8	89.9	167.4	165.8	0	0	0	0	103.8	P96 Q100	P96-S98 PolarHBondContact O-N 2.93Å; S98-Q100 PolarHBondContact O-N 3.47Å; S98-Q100 WeakPolarHBondContact OG-CG 3.42Å
99	I	40.7	Very low	42.4	Very low	47 Å²	47	90.5 Å²	90.5	24%	0.241	54%	0.539	C	S	.	.			trans	-65.2	87.6	161	-55.9	176.8	0	0	0	103.3	L72 W73 V97 P101	L72-I99 WeakPolarHBondContact O-CG2 3.48Å; W73-I99 HydrophobicContact CE3-CD1 3.68Å; W73-I99 HydrophobicContact CE3-CG2 4.26Å; W73-I99 HydrophobicContact CZ3-CD1 3.75Å; W73-I99 HydrophobicContact CZ3-CG2 4.04Å; V97-I99 HydrophobicContact CG1-CG1 3.92Å; V97-I99 PolarHBondContact O-N 3.17Å; I99-P101 VanDerWaalsContact O-CD 3.25Å; I99-P101 WeakPolarHBondContact O-CD 3.32Å
100	Q	35.8	Very low	42.4	Very low	147 Å²	147	87.7 Å²	87.7	69%	0.687	52%	0.518	S	S	*	.			trans	-65.1	120.7	175.6	-74.2	-162.2	-31.6	0	0	106	S98 V102	S98-Q100 PolarHBondContact O-N 3.47Å; S98-Q100 WeakPolarHBondContact OG-CG 3.42Å; Q100-V102 PolarHBondContact O-N 2.86Å
101	P	38.8	Very low	42.8	Very low	50 Å²	50	78.6 Å²	78.6	33%	0.325	48%	0.478	S	S	.	.			trans	-63.9	115.2	173.1	24.5	-31.2	0	0	0	106.5	I99 A103 V142	I99-P101 VanDerWaalsContact O-CD 3.25Å; I99-P101 WeakPolarHBondContact O-CD 3.32Å; P101-A103 PolarHBondContact O-N 3.41Å; P101-A103 VanDerWaalsContact O-N 3.15Å; P101-V142 HydrophobicContact CB-CG1 4.38Å; P101-V142 WeakPolarHBondContact CD-O 3.39Å; P101-V142 HydrophobicContact CG-CG1 4.3Å; P101-V142 WeakPolarHBondContact CG-O 3.31Å
102	V	36.6	Very low	43.5	Very low	134 Å²	134	75.6 Å²	75.6	81%	0.812	46%	0.46	S	S	*	.			trans	-69.4	-10.2	-169.9	172.1	0	0	0	0	112.9	Q100	Q100-V102 PolarHBondContact O-N 2.86Å
103	A	38.9	Very low	44.2	Very low	23 Å²	23	69.7 Å²	69.7	19%	0.19	42%	0.422	C	S	.	.			trans	-135.2	96.5	-176	0	0	0	0	0	114.7	P101 L110	P101-A103 PolarHBondContact O-N 3.41Å; P101-A103 VanDerWaalsContact O-N 3.15Å; A103-L110 HydrophobicContact CB-CD1 3.56Å; A103-L110 HydrophobicContact CB-CD2 3.44Å; A103-L110 VanDerWaalsContact CB-CD2 3.44Å; A103-L110 HydrophobicContact CB-CG 3.54Å
104	Y	36	Very low	45.1	Very low	139 Å²	139	65.5 Å²	65.5	55%	0.545	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)		-92.6	93.7	119.1	-100.8	-91.3	0	0	0	107	S106 Q144	Y104-S106 PolarHBondContact O-N 3.33Å; Y104-Q144 PolarHBondContact OH-OE1 2.88Å
105	L	38.6	Very low	46.2	Very low	113 Å²	113	65.1 Å²	65.1	59%	0.592	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.7	78.4	162.2	-153	92.5	0	0	0	106.3	D107 H108	L105-D107 PolarHBondContact O-N 3.06Å; L105-H108 HydrophobicContact CB-CB 4.3Å; L105-H108 PolarHBondContact O-CD2 3.37Å; L105-H108 VanDerWaalsContact O-CD2 3.31Å; L105-H108 PolarHBondContact O-N 3.02Å
106	S	47.1	Very low	47.1	Very low	97 Å²	97	60.4 Å²	60.4	68%	0.678	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	38.3	-40.1	-177.1	60	0	0	0	0	120.9	Y104	Y104-S106 PolarHBondContact O-N 3.33Å
107	D	47.7	Very low	47.9	Very low	116 Å²	116	59.3 Å²	59.3	62%	0.62	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-134.6	-0.8	-178.6	-59.2	-51.9	0	0	0	113.6	L105	L105-D107 PolarHBondContact O-N 3.06Å
108	H	48.6	Very low	48.4	Very low	42 Å²	42	58.1 Å²	58.1	19%	0.194	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	130.4	-175.2	-63.4	-100.9	0	0	0	112.1	K63 D65 L105	K63-H108 VanDerWaalsContact O-CA 3.3Å; K63-H108 WeakPolarHBondContact O-CA 3.25Å; D65-H108 IonicContact OD1-CE1 3.9Å; D65-H108 IonicContact OD1-ND1 2.81Å; D65-H108 PolarHBondContact OD1-ND1 2.8Å; D65-H108 IonicContact OD2-CE1 2.84Å; D65-H108 IonicContact OD2-CG 3.75Å; D65-H108 IonicContact OD2-ND1 3.09Å; D65-H108 PolarHBondContact OD2-ND1 3.42Å; L105-H108 HydrophobicContact CB-CB 4.3Å; L105-H108 PolarHBondContact O-CD2 3.37Å; L105-H108 VanDerWaalsContact O-CD2 3.31Å; L105-H108 PolarHBondContact O-N 3.02Å
109	V	54.9	Low	48.6	Very low	11 Å²	11	57.9 Å²	57.9	7%	0.067	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	135.5	171.6	176.5	0	0	0	0	109.1	I62 K63 F64 D65	I62-V109 HydrophobicContact CG1-CG2 4.48Å; I62-V109 HydrophobicContact CG2-CB 3.74Å; I62-V109 HydrophobicContact CG2-CG2 3.46Å; I62-V109 VanDerWaalsContact CG2-CG2 3.46Å; K63-V109 PolarHBondContact O-N 3Å; F64-V109 WeakPolarHBondContact CA-O 3.49Å; F64-V109 HydrophobicContact CD1-CB 3.66Å; F64-V109 HydrophobicContact CD1-CG1 3.75Å; F64-V109 HydrophobicContact CE1-CB 3.67Å; F64-V109 HydrophobicContact CE1-CG1 3.56Å; F64-V109 HydrophobicContact CE1-CG2 4.48Å; D65-V109 PolarHBondContact N-O 3.41Å
110	L	56.5	Low	48.5	Very low	14 Å²	14	65.6 Å²	65.6	7%	0.073	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	134.4	179.2	-63.9	179.9	0	0	0	111.5	D65 V67 L72 A103 G146 L147	D65-L110 WeakPolarHBondContact O-CA 3.17Å; V67-L110 HydrophobicContact CB-CD2 4.34Å; V67-L110 HydrophobicContact CG2-CD2 3.42Å; V67-L110 VanDerWaalsContact CG2-CD2 3.42Å; V67-L110 HydrophobicContact CG2-CG 4.47Å; L72-L110 HydrophobicContact CD2-CD1 3.98Å; A103-L110 HydrophobicContact CB-CD1 3.56Å; A103-L110 HydrophobicContact CB-CD2 3.44Å; A103-L110 VanDerWaalsContact CB-CD2 3.44Å; A103-L110 HydrophobicContact CB-CG 3.54Å; L110-G146 CarbonylContact O-C 3.6Å; L110-G146 VanDerWaalsContact O-C 3.3Å; L110-G146 WeakPolarHBondContact O-CA 3.46Å; L110-L147 PolarHBondContact O-N 3.47Å
111	L	57.8	Low	48.5	Very low	1 Å²	1	60.1 Å²	60.1	1%	0.005	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	126	170.7	-172.7	64.5	0	0	0	109.4	F64 D65 F66 V67 F113 L147 I149 F198 C206	F64-L111 HydrophobicContact CB-CB 4.23Å; D65-L111 PolarHBondContact O-N 3.14Å; F66-L111 WeakPolarHBondContact CD2-O 3.25Å; V67-L111 PolarHBondContact N-O 3.12Å; L111-F113 HydrophobicContact CD2-CE2 3.94Å; L111-F113 HydrophobicContact CD2-CZ 4Å; L111-F113 HydrophobicContact CG-CE2 4.04Å; L111-F113 HydrophobicContact CG-CZ 4.32Å; L111-L147 WeakPolarHBondContact CA-O 3.14Å; L111-L147 HydrophobicContact CD1-CB 3.79Å; L111-L147 HydrophobicContact CD1-CD2 3.53Å; L111-L147 HydrophobicContact CD1-CG 3.56Å; L111-L147 WeakPolarHBondContact CD1-O 3.34Å; L111-I149 HydrophobicContact CD1-CD1 3.4Å; L111-I149 VanDerWaalsContact CD1-CD1 3.4Å; L111-I149 HydrophobicContact CD1-CG1 3.76Å; L111-I149 HydrophobicContact CD2-CD1 4.01Å; L111-I149 HydrophobicContact CG-CD1 4Å; L111-F198 HydrophobicContact CD2-CZ 4.33Å; L111-C206 VanDerWaalsContact CD2-SG 3.6Å
112	T	59.4	Low	48.3	Very low	6 Å²	6	61.6 Å²	61.6	4%	0.037	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	148.5	173.1	-157.1	0	0	0	0	111.7	V67 S69 L72 L147 V148 I149	V67-T112 PolarHBondContact O-OG1 3.48Å; V67-T112 VanDerWaalsContact O-OG1 3.07Å; S69-T112 PolarHBondContact N-OG1 2.94Å; L72-T112 VanDerWaalsContact CD1-CB 3.47Å; L72-T112 HydrophobicContact CD1-CG2 3.88Å; T112-L147 PolarHBondContact N-O 2.96Å; T112-L147 VanDerWaalsContact N-O 3.11Å; T112-V148 HydrophobicContact CG2-CG1 4.34Å; T112-V148 HydrophobicContact CG2-CG2 4.19Å; T112-I149 PolarHBondContact O-N 3.23Å
113	F	59.3	Low	48.4	Very low	20 Å²	20	65.2 Å²	65.2	9%	0.088	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	131.1	179.6	-66.1	-93.7	0	0	0	108.7	F66 L111 I149 Y151 L194 F198	F66-F113 HydrophobicContact CD2-CD2 4.01Å; F66-F113 AromaticContact CD2-CE2 3.98Å; F66-F113 HydrophobicContact CD2-CE2 3.98Å; F66-F113 AromaticContact CE2-CD2 3.66Å; F66-F113 HydrophobicContact CE2-CD2 3.66Å; F66-F113 HydrophobicContact CE2-CE2 4.07Å; L111-F113 HydrophobicContact CD2-CE2 3.94Å; L111-F113 HydrophobicContact CD2-CZ 4Å; L111-F113 HydrophobicContact CG-CE2 4.04Å; L111-F113 HydrophobicContact CG-CZ 4.32Å; F113-I149 WeakPolarHBondContact CA-O 3.29Å; F113-I149 HydrophobicContact CD1-CB 3.48Å; F113-I149 VanDerWaalsContact CD1-CB 3.48Å; F113-I149 HydrophobicContact CD1-CD1 4.08Å; F113-I149 HydrophobicContact CD1-CG1 4.33Å; F113-I149 HydrophobicContact CD1-CG2 3.5Å; F113-I149 HydrophobicContact CE1-CB 3.51Å; F113-I149 HydrophobicContact CE1-CD1 3.2Å; F113-I149 HydrophobicContact CE1-CG1 3.9Å; F113-I149 HydrophobicContact CE1-CG2 3.47Å; F113-I149 VanDerWaalsContact CE1-CG2 3.47Å; F113-I149 HydrophobicContact CE2-CD1 4.22Å; F113-I149 HydrophobicContact CG-CB 4.27Å; F113-I149 HydrophobicContact CZ-CB 4.33Å; F113-I149 HydrophobicContact CZ-CD1 3.29Å; F113-I149 HydrophobicContact CZ-CG1 4.32Å; F113-Y151 HydrophobicContact CB-CE1 4.04Å; F113-L194 HydrophobicContact CD1-CD1 4.22Å; F113-L194 HydrophobicContact CD1-CD2 4.39Å; F113-L194 HydrophobicContact CE1-CB 4.35Å; F113-L194 HydrophobicContact CE1-CD1 3.78Å; F113-L194 HydrophobicContact CE1-CD2 3.36Å; F113-L194 HydrophobicContact CE1-CG 4.03Å; F113-L194 HydrophobicContact CZ-CD2 3.58Å; F113-F198 HydrophobicContact CD2-CD2 4.19Å; F113-F198 HydrophobicContact CD2-CE2 4.21Å; F113-F198 HydrophobicContact CE1-CE2 4.18Å; F113-F198 HydrophobicContact CE2-CD1 4.44Å; F113-F198 AromaticContact CE2-CD2 3.6Å; F113-F198 HydrophobicContact CE2-CD2 3.6Å; F113-F198 HydrophobicContact CE2-CE1 4.02Å; F113-F198 AromaticContact CE2-CE2 3.21Å; F113-F198 HydrophobicContact CE2-CE2 3.21Å; F113-F198 HydrophobicContact CE2-CG 4.27Å; F113-F198 AromaticContact CE2-CZ 3.44Å; F113-F198 HydrophobicContact CE2-CZ 3.44Å; F113-F198 VanDerWaalsContact CE2-CZ 3.44Å; F113-F198 AromaticContact CZ-CD2 3.92Å; F113-F198 HydrophobicContact CZ-CD2 3.92Å; F113-F198 AromaticContact CZ-CE2 3.19Å; F113-F198 HydrophobicContact CZ-CE2 3.19Å; F113-F198 AromaticContact CZ-CZ 3.58Å; F113-F198 HydrophobicContact CZ-CZ 3.58Å
114	L	60.4	Low	48.5	Very low	2 Å²	2	68 Å²	68	1%	0.01	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	125.1	173.9	-72.8	161.3	0	0	0	108.6	F80 V83 V148 I149	F80-L114 HydrophobicContact CB-CB 3.9Å; F80-L114 HydrophobicContact CD2-CB 4.14Å; F80-L114 HydrophobicContact CD2-CD1 3.74Å; V83-L114 HydrophobicContact CB-CD1 4.46Å; V83-L114 HydrophobicContact CG2-CD1 3.75Å; V83-L114 HydrophobicContact CG2-CD2 3.89Å; L114-V148 HydrophobicContact CD1-CG1 4.15Å; L114-I149 PolarHBondContact N-O 3.45Å; L114-I149 VanDerWaalsContact N-O 3.11Å
115	P	59.1	Low	48.6	Very low	21 Å²	21	66.9 Å²	66.9	14%	0.136	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	140.2	170.5	29.3	-33.2	0	0	0	108.7	N78 F80 Y151 E153	N78-P115 WeakPolarHBondContact O-CD 3.34Å; N78-P115 WeakPolarHBondContact O-CG 3.44Å; F80-P115 PolarHBondContact N-O 2.93Å; P115-Y151 HydrophobicContact CB-CE1 4.38Å; P115-Y151 HydrophobicContact CB-CE2 4.16Å; P115-E153 HydrophobicContact CB-CB 4.28Å
116	F	56.7	Low	49	Very low	13 Å²	13	68.9 Å²	68.9	6%	0.057	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	103.1	170.5	-165.9	-93.4	0	0	0	108.5	F80 M118 L127 I150 Y151 E153	F80-F116 HydrophobicContact CB-CD2 4.36Å; F80-F116 AromaticContact CD1-CD2 3.92Å; F80-F116 HydrophobicContact CD1-CD2 3.92Å; F80-F116 HydrophobicContact CD1-CE2 4.04Å; F116-M118 HydrophobicContact CD1-CG 4.44Å; F116-M118 HydrophobicContact CD1-SD 3.88Å; F116-M118 HydrophobicContact CE1-SD 3.92Å; F116-M118 PolarHBondContact O-N 3.19Å; F116-M118 VanDerWaalsContact O-N 3.13Å; F116-L127 HydrophobicContact CE1-CD2 3.47Å; F116-L127 VanDerWaalsContact CE1-CD2 3.47Å; F116-L127 HydrophobicContact CZ-CD2 3.58Å; F116-I150 HydrophobicContact CB-CG2 3.67Å; F116-I150 HydrophobicContact CD2-CG2 4.06Å; F116-I150 HydrophobicContact CG-CG2 4.18Å; F116-Y151 WeakPolarHBondContact CB-O 3.36Å; F116-Y151 PolarHBondContact N-O 3.45Å; F116-E153 PolarHBondContact O-N 3.27Å; F116-E153 VanDerWaalsContact O-N 3.14Å
117	E	54.6	Low	49.1	Very low	81 Å²	81	66.4 Å²	66.4	38%	0.379	38%	0.379	S	S	.	.			trans	-64	110.7	171.6	-88.6	-176.8	-160.5	0	0	109	G119 E153	E117-G119 PolarHBondContact O-N 3.25Å; E117-E153 WeakPolarHBondContact CG-OE2 3.34Å
118	M	50	Low	49.1	Very low	79 Å²	79	69.9 Å²	69.9	39%	0.389	38%	0.383	S	S	.	.			trans	-75.1	75.5	166.7	-67.1	-69.2	-65.4	0	0	107.2	F116 H120 V159	F116-M118 HydrophobicContact CD1-CG 4.44Å; F116-M118 HydrophobicContact CD1-SD 3.88Å; F116-M118 HydrophobicContact CE1-SD 3.92Å; F116-M118 PolarHBondContact O-N 3.19Å; F116-M118 VanDerWaalsContact O-N 3.13Å; M118-H120 PolarHBondContact O-N 3.48Å; M118-V159 HydrophobicContact CE-CB 4.23Å; M118-V159 HydrophobicContact CE-CG1 3.48Å; M118-V159 VanDerWaalsContact CE-CG1 3.48Å; M118-V159 HydrophobicContact CE-CG2 4.01Å; M118-V159 HydrophobicContact CG-CG2 4.2Å; M118-V159 HydrophobicContact SD-CB 4.48Å; M118-V159 HydrophobicContact SD-CG1 3.5Å; M118-V159 VanDerWaalsContact SD-CG1 3.5Å; M118-V159 HydrophobicContact SD-CG2 4.17Å
119	G	43.8	Very low	49.4	Very low	59 Å²	59	68.6 Å²	68.6	61%	0.608	38%	0.378	S	S	*	.			trans	-49.2	141.6	179.5	0	0	0	0	0	111	E117 G121	E117-G119 PolarHBondContact O-N 3.25Å; G119-G121 PolarHBondContact O-N 3.05Å
120	H	38	Very low	49.2	Very low	209 Å²	209	68.6 Å²	68.6	97%	0.968	38%	0.378	S	S	*	.			trans	-52.9	34.6	-177.4	-82.4	-78.1	0	0	0	117	M118 A122	M118-H120 PolarHBondContact O-N 3.48Å; H120-A122 PolarHBondContact O-N 3.36Å
121	G	35.8	Very low	49.3	Very low	33 Å²	33	70 Å²	70	34%	0.34	39%	0.389	S	S	.	.			trans	-73.7	115.1	171.9	0	0	0	0	0	109	G119 E125	G119-G121 PolarHBondContact O-N 3.05Å; G121-E125 WeakPolarHBondContact CA-OE2 3.18Å
122	A	34.4	Very low	49.3	Very low	80 Å²	80	74.3 Å²	74.3	66%	0.661	41%	0.409	S	S	*	.			trans	-44.8	148.3	167.8	0	0	0	0	0	111	H120 G124 E125	H120-A122 PolarHBondContact O-N 3.36Å; A122-G124 PolarHBondContact O-N 3.43Å; A122-E125 PolarHBondContact O-N 3.47Å; A122-E125 VanDerWaalsContact O-N 3.14Å
123	E	39.6	Very low	49.5	Very low	211 Å²	211	77.8 Å²	77.8	99%	0.986	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-21.8	105.4	177.6	-66.7	-178	151	0	0	113.6
124	G	39.5	Very low	49.5	Very low	80 Å²	80	78.1 Å²	78.1	83%	0.825	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	98.8	6.1	171.5	0	0	0	0	0	117.1	A122 E126	A122-G124 PolarHBondContact O-N 3.43Å; G124-E126 PolarHBondContact O-N 3.01Å
125	E	39.7	Very low	49.5	Very low	117 Å²	117	78.3 Å²	78.3	55%	0.547	43%	0.428	S	S	.	.			trans	-68.4	127.5	165.7	-73.6	-151.6	128.8	0	0	111.5	G121 A122 R128	G121-E125 WeakPolarHBondContact CA-OE2 3.18Å; A122-E125 PolarHBondContact O-N 3.47Å; A122-E125 VanDerWaalsContact O-N 3.14Å; E125-R128 IonicContact OE1-NH2 3.8Å; E125-R128 PolarHBondContact OE1-NH2 2.85Å
126	E	45.8	Very low	49.6	Very low	155 Å²	155	82.2 Å²	82.2	72%	0.724	44%	0.44	S	S	*	.			trans	-53.7	142.2	173.9	-69.5	174.1	150.7	0	0	110.8	G124 R128	G124-E126 PolarHBondContact O-N 3.01Å; E126-R128 WeakPolarHBondContact O-CG 3.44Å; E126-R128 PolarHBondContact O-N 2.9Å
127	L	48.4	Very low	49.9	Very low	45 Å²	45	86.9 Å²	86.9	24%	0.236	46%	0.457	C	S	.	.			trans	-63.9	78.4	172.3	-63.8	159.6	0	0	0	109.5	F116 C129 F130 N163 L164	F116-L127 HydrophobicContact CE1-CD2 3.47Å; F116-L127 VanDerWaalsContact CE1-CD2 3.47Å; F116-L127 HydrophobicContact CZ-CD2 3.58Å; L127-C129 PolarHBondContact O-N 3.29Å; L127-C129 VanDerWaalsContact O-N 3.16Å; L127-F130 PolarHBondContact O-N 3.29Å; L127-F130 VanDerWaalsContact O-N 3.09Å; L127-N163 HydrophobicContact CD1-CB 3.94Å; L127-L164 HydrophobicContact CD1-CB 4.36Å
128	R	49.5	Very low	50.2	Low	189 Å²	189	83.1 Å²	83.1	71%	0.713	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-28.8	-169.4	-69.6	-168.6	-177.6	172.2	9.8	113.6	E125 E126 F130	E125-R128 IonicContact OE1-NH2 3.8Å; E125-R128 PolarHBondContact OE1-NH2 2.85Å; E126-R128 WeakPolarHBondContact O-CG 3.44Å; E126-R128 PolarHBondContact O-N 2.9Å; R128-F130 PolarHBondContact O-N 3.27Å
129	C	54.1	Low	50.5	Low	14 Å²	14	81 Å²	81	10%	0.095	43%	0.431	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-12	-178.8	81.2	0	0	0	0	113.3	C81 L127	C81-C129 HydrophobicContact CB-CB 3.35Å; C81-C129 WeakPolarHBondContact CB-SG 3.26Å; C81-C129 WeakPolarHBondContact SG-CB 3.33Å; C81-C129 CovalentContact SG-SG 2.05Å; C81-C129 PolarHBondContact SG-SG 3.33Å; L127-C129 PolarHBondContact O-N 3.29Å; L127-C129 VanDerWaalsContact O-N 3.16Å
130	F	50.4	Low	51.2	Low	12 Å²	12	85.2 Å²	85.2	5%	0.053	43%	0.434	C	S	.	.			trans	-114.5	85.5	-179.3	-156.9	-105.3	0	0	0	111.1	F80 L127 R128 W135 L164 T167 I168	F80-F130 AromaticContact CE1-CD2 3.58Å; F80-F130 HydrophobicContact CE1-CD2 3.58Å; F80-F130 AromaticContact CE1-CE2 3.66Å; F80-F130 HydrophobicContact CE1-CE2 3.66Å; F80-F130 HydrophobicContact CZ-CD2 4.22Å; F80-F130 AromaticContact CZ-CE2 3.83Å; F80-F130 HydrophobicContact CZ-CE2 3.83Å; L127-F130 PolarHBondContact O-N 3.29Å; L127-F130 VanDerWaalsContact O-N 3.09Å; R128-F130 PolarHBondContact O-N 3.27Å; F130-W135 HydrophobicContact CE2-CD2 4.2Å; F130-W135 AromaticContact CE2-CE3 3.72Å; F130-W135 HydrophobicContact CE2-CE3 3.72Å; F130-W135 HydrophobicContact CE2-CZ3 4.42Å; F130-W135 HydrophobicContact CZ-CE3 4.47Å; F130-L164 HydrophobicContact CD1-CD1 4.26Å; F130-L164 HydrophobicContact CE1-CD1 4.31Å; F130-T167 HydrophobicContact CD1-CG2 3.35Å; F130-T167 HydrophobicContact CE1-CG2 3.61Å; F130-T167 HydrophobicContact CG-CG2 4.48Å; F130-I168 HydrophobicContact CE1-CG1 3.63Å; F130-I168 HydrophobicContact CZ-CG1 3.76Å
131	S	58.2	Low	52	Low	44 Å²	44	76.9 Å²	76.9	31%	0.308	40%	0.4	S	S	.	.			trans	-107	147.4	166.6	74.5	0	0	0	0	110.7	E133 L134 W135	S131-E133 PolarHBondContact O-N 3.44Å; S131-E133 VanDerWaalsContact O-N 3.12Å; S131-L134 PolarHBondContact O-N 3.27Å; S131-L134 VanDerWaalsContact O-N 3.13Å; S131-L134 VanDerWaalsContact OG-CB 3.29Å; S131-L134 WeakPolarHBondContact OG-CB 3.26Å; S131-L134 WeakPolarHBondContact OG-CD1 3.46Å; S131-L134 WeakPolarHBondContact OG-CG 3.46Å; S131-L134 PolarHBondContact OG-N 3.35Å; S131-W135 PolarHBondContact O-N 3.08Å
132	E	58.1	Low	52.7	Low	91 Å²	91	75.7 Å²	75.7	43%	0.425	39%	0.386	S	S	.	.	H	α-helix	trans	-51.5	-36.7	173.5	-171.5	-170.5	166.5	0	0	111.2	R136 V171	E132-R136 VanDerWaalsContact O-CB 3.24Å; E132-R136 WeakPolarHBondContact O-CB 3.4Å; E132-R136 PolarHBondContact O-N 2.98Å; E132-R136 IonicContact OE1-CZ 3.67Å; E132-R136 IonicContact OE1-NH2 2.72Å; E132-R136 PolarHBondContact OE1-NH2 2.72Å; E132-V171 HydrophobicContact CG-CG2 4.11Å
133	E	63.5	Low	53.5	Low	79 Å²	79	73.4 Å²	73.4	37%	0.369	37%	0.37	S	S	.	.	H	α-helix	trans	-71.7	-43.7	-179.8	-178.5	60.4	-163.6	0	0	112.9	S131 W135 R136 R137	S131-E133 PolarHBondContact O-N 3.44Å; S131-E133 VanDerWaalsContact O-N 3.12Å; E133-W135 VanDerWaalsContact C-N 3.31Å; E133-W135 PolarHBondContact O-N 3.48Å; E133-R136 PolarHBondContact O-N 3.35Å; E133-R136 IonicContact OE2-NH1 3.63Å; E133-R136 PolarHBondContact OE2-NH1 2.75Å; E133-R137 VanDerWaalsContact O-CG 3.31Å; E133-R137 WeakPolarHBondContact O-CG 3.35Å; E133-R137 PolarHBondContact O-N 3.42Å; E133-R137 IonicContact OE1-CZ 2.99Å; E133-R137 IonicContact OE1-NE 3.48Å; E133-R137 PolarHBondContact OE1-NE 3.31Å; E133-R137 IonicContact OE1-NH2 3.01Å; E133-R137 PolarHBondContact OE1-NH2 3.33Å
134	L	60.3	Low	54	Low	27 Å²	27	69.5 Å²	69.5	14%	0.141	35%	0.352	C	S	.	.	H	α-helix	trans	-57.7	-45.9	173.5	-89.2	157.1	0	0	0	110.4	M84 S131 R137 H138	M84-L134 HydrophobicContact CE-CB 3.68Å; S131-L134 PolarHBondContact O-N 3.27Å; S131-L134 VanDerWaalsContact O-N 3.13Å; S131-L134 VanDerWaalsContact OG-CB 3.29Å; S131-L134 WeakPolarHBondContact OG-CB 3.26Å; S131-L134 WeakPolarHBondContact OG-CD1 3.46Å; S131-L134 WeakPolarHBondContact OG-CG 3.46Å; S131-L134 PolarHBondContact OG-N 3.35Å; L134-R137 WeakPolarHBondContact O-CB 3.22Å; L134-R137 PolarHBondContact O-N 3.5Å; L134-H138 PolarHBondContact O-N 3.47Å
135	W	60.2	Low	54.4	Low	6 Å²	6	66.1 Å²	66.1	2%	0.023	32%	0.315	C	S	.	.	H	α-helix	trans	-71.9	-39.2	-178.3	-169.7	-83.8	0	0	0	112.8	F80 M84 F130 S131 E133 R137 H138 V139 L145 F173	F80-W135 HydrophobicContact CE1-CE3 4.5Å; F80-W135 HydrophobicContact CE1-CZ3 4.18Å; F80-W135 HydrophobicContact CE2-CE3 4.42Å; F80-W135 AromaticContact CE2-CH2 3.86Å; F80-W135 HydrophobicContact CE2-CH2 3.86Å; F80-W135 AromaticContact CE2-CZ3 3.4Å; F80-W135 HydrophobicContact CE2-CZ3 3.4Å; F80-W135 AromaticContact CZ-CE3 3.72Å; F80-W135 HydrophobicContact CZ-CE3 3.72Å; F80-W135 AromaticContact CZ-CH2 3.82Å; F80-W135 HydrophobicContact CZ-CH2 3.82Å; F80-W135 AromaticContact CZ-CZ3 3.09Å; F80-W135 HydrophobicContact CZ-CZ3 3.09Å; M84-W135 HydrophobicContact CE-CB 3.76Å; M84-W135 HydrophobicContact CE-CD2 4.29Å; M84-W135 HydrophobicContact CE-CE3 3.59Å; M84-W135 HydrophobicContact CE-CG 4.39Å; M84-W135 HydrophobicContact CE-CZ3 4.43Å; M84-W135 HydrophobicContact CG-CE3 4.42Å; M84-W135 HydrophobicContact SD-CD2 4.25Å; M84-W135 HydrophobicContact SD-CE3 3.19Å; M84-W135 HydrophobicContact SD-CZ3 3.45Å; M84-W135 WeakPolarHBondContact SD-CZ3 3.34Å; F130-W135 HydrophobicContact CE2-CD2 4.2Å; F130-W135 AromaticContact CE2-CE3 3.72Å; F130-W135 HydrophobicContact CE2-CE3 3.72Å; F130-W135 HydrophobicContact CE2-CZ3 4.42Å; F130-W135 HydrophobicContact CZ-CE3 4.47Å; S131-W135 PolarHBondContact O-N 3.08Å; E133-W135 VanDerWaalsContact C-N 3.31Å; E133-W135 PolarHBondContact O-N 3.48Å; W135-R137 PolarHBondContact O-N 3.02Å; W135-H138 WeakPolarHBondContact O-CB 3.46Å; W135-H138 PolarHBondContact O-N 3.02Å; W135-H138 VanDerWaalsContact O-N 3.16Å; W135-V139 HydrophobicContact CG-CG2 4.44Å; W135-V139 VanDerWaalsContact NE1-CG2 3.29Å; W135-V139 WeakPolarHBondContact O-CG2 3.31Å; W135-V139 PolarHBondContact O-N 2.75Å; W135-L145 HydrophobicContact CH2-CD1 4.17Å; W135-L145 HydrophobicContact CZ2-CD1 3.75Å; W135-F173 HydrophobicContact CB-CZ 4.41Å; W135-F173 AromaticContact CD1-CD1 3.55Å; W135-F173 AromaticContact CD1-CE1 2.93Å; W135-F173 AromaticContact CD1-CE2 3.96Å; W135-F173 AromaticContact CD1-CZ 3.12Å; W135-F173 HydrophobicContact CG-CE1 4.02Å; W135-F173 AromaticContact CG-CZ 3.82Å; W135-F173 HydrophobicContact CG-CZ 3.82Å; W135-F173 AromaticContact NE1-CD1 3.28Å; W135-F173 VanDerWaalsContact NE1-CD1 3.28Å; W135-F173 AromaticContact NE1-CE1 3.22Å; W135-F173 AromaticContact NE1-CE2 3.93Å; W135-F173 AromaticContact NE1-CG 3.7Å; W135-F173 AromaticContact NE1-CZ 3.5Å
136	R	61.6	Low	55.2	Low	103 Å²	103	61.4 Å²	61.4	39%	0.389	30%	0.298	S	S	.	.	H	α-helix	trans	-59.6	-39.5	174.2	-167.1	-174.8	-68	152.1	-9.4	110.9	E132 E133 Q140	E132-R136 VanDerWaalsContact O-CB 3.24Å; E132-R136 WeakPolarHBondContact O-CB 3.4Å; E132-R136 PolarHBondContact O-N 2.98Å; E132-R136 IonicContact OE1-CZ 3.67Å; E132-R136 IonicContact OE1-NH2 2.72Å; E132-R136 PolarHBondContact OE1-NH2 2.72Å; E133-R136 PolarHBondContact O-N 3.35Å; E133-R136 IonicContact OE2-NH1 3.63Å; E133-R136 PolarHBondContact OE2-NH1 2.75Å; R136-Q140 VanDerWaalsContact O-CB 3.32Å; R136-Q140 WeakPolarHBondContact O-CB 3.15Å; R136-Q140 WeakPolarHBondContact O-CG 2.88Å; R136-Q140 PolarHBondContact O-N 3.41Å
137	R	62.4	Low	55.7	Low	111 Å²	111	54.1 Å²	54.1	42%	0.419	26%	0.264	S	S	.	.	H	α-helix	trans	-65.6	-44.7	173.7	-71.1	175	-164.5	160.4	4.8	111.8	E133 L134 W135 Q140 S141	E133-R137 VanDerWaalsContact O-CG 3.31Å; E133-R137 WeakPolarHBondContact O-CG 3.35Å; E133-R137 PolarHBondContact O-N 3.42Å; E133-R137 IonicContact OE1-CZ 2.99Å; E133-R137 IonicContact OE1-NE 3.48Å; E133-R137 PolarHBondContact OE1-NE 3.31Å; E133-R137 IonicContact OE1-NH2 3.01Å; E133-R137 PolarHBondContact OE1-NH2 3.33Å; L134-R137 WeakPolarHBondContact O-CB 3.22Å; L134-R137 PolarHBondContact O-N 3.5Å; W135-R137 PolarHBondContact O-N 3.02Å; R137-Q140 PolarHBondContact O-N 2.95Å; R137-S141 WeakPolarHBondContact O-CB 3.34Å; R137-S141 PolarHBondContact O-N 3.38Å; R137-S141 PolarHBondContact O-OG 3.33Å; R137-S141 VanDerWaalsContact O-OG 3.13Å
138	H	61.4	Low	56.2	Low	2 Å²	2	52.2 Å²	52.2	1%	0.009	25%	0.254	C	S	.	.	H	α-helix	trans	-56.6	-52.7	175.8	-175.9	78.9	0	0	0	112.1	W73 V83 M84 S87 L134 W135 Q140 S141 V142 L145	W73-H138 AromaticContact CH2-CE1 3.39Å; W73-H138 WeakPolarHBondContact CH2-CE1 3.41Å; W73-H138 AromaticContact CH2-NE2 3.67Å; W73-H138 AromaticContact CZ3-CE1 3.68Å; V83-H138 WeakPolarHBondContact CG1-CE1 3.29Å; M84-H138 HydrophobicContact CE-CB 4.26Å; M84-H138 HydrophobicContact SD-CB 3.9Å; S87-H138 WeakPolarHBondContact CB-ND1 3.35Å; S87-H138 VanDerWaalsContact OG-CB 3.31Å; S87-H138 WeakPolarHBondContact OG-CB 3.42Å; S87-H138 PolarHBondContact OG-ND1 3.45Å; L134-H138 PolarHBondContact O-N 3.47Å; W135-H138 WeakPolarHBondContact O-CB 3.46Å; W135-H138 PolarHBondContact O-N 3.02Å; W135-H138 VanDerWaalsContact O-N 3.16Å; H138-Q140 VanDerWaalsContact C-N 3.3Å; H138-Q140 PolarHBondContact O-N 3.42Å; H138-S141 WeakPolarHBondContact CA-OG 3.46Å; H138-S141 PolarHBondContact O-N 2.9Å; H138-S141 VanDerWaalsContact O-N 3.09Å; H138-S141 PolarHBondContact O-OG 2.98Å; H138-V142 WeakPolarHBondContact O-CB 3.41Å; H138-V142 WeakPolarHBondContact O-CG2 3.26Å; H138-V142 PolarHBondContact O-N 3.36Å; H138-L145 WeakPolarHBondContact NE2-CD2 3.4Å
139	V	57.1	Low	56.7	Low	34 Å²	34	43.2 Å²	43.2	21%	0.206	22%	0.22	C	C	.	.	H	α-helix	trans	-61.6	-37.9	178	175.9	0	0	0	0	111.5	W135 G143 L145	W135-V139 HydrophobicContact CG-CG2 4.44Å; W135-V139 VanDerWaalsContact NE1-CG2 3.29Å; W135-V139 WeakPolarHBondContact O-CG2 3.31Å; W135-V139 PolarHBondContact O-N 2.75Å; V139-G143 VanDerWaalsContact O-CA 3.26Å; V139-G143 WeakPolarHBondContact O-CA 3.31Å; V139-G143 PolarHBondContact O-N 3.18Å; V139-L145 HydrophobicContact CG2-CD1 3.76Å
140	Q	58.3	Low	56.9	Low	147 Å²	147	42.8 Å²	42.8	69%	0.687	22%	0.217	S	C	*	.	H	α-helix	trans	-68	-34.8	175.1	-76.4	174.4	1.7	0	0	112.5	R136 R137 H138	R136-Q140 VanDerWaalsContact O-CB 3.32Å; R136-Q140 WeakPolarHBondContact O-CB 3.15Å; R136-Q140 WeakPolarHBondContact O-CG 2.88Å; R136-Q140 PolarHBondContact O-N 3.41Å; R137-Q140 PolarHBondContact O-N 2.95Å; H138-Q140 VanDerWaalsContact C-N 3.3Å; H138-Q140 PolarHBondContact O-N 3.42Å
141	S	54.6	Low	57.3	Low	34 Å²	34	43.7 Å²	43.7	24%	0.238	22%	0.22	C	C	.	.	H	α-helix	trans	-79.3	-38.9	179.8	60.2	0	0	0	0	113.5	R137 H138	R137-S141 WeakPolarHBondContact O-CB 3.34Å; R137-S141 PolarHBondContact O-N 3.38Å; R137-S141 PolarHBondContact O-OG 3.33Å; R137-S141 VanDerWaalsContact O-OG 3.13Å; H138-S141 WeakPolarHBondContact CA-OG 3.46Å; H138-S141 PolarHBondContact O-N 2.9Å; H138-S141 VanDerWaalsContact O-N 3.09Å; H138-S141 PolarHBondContact O-OG 2.98Å
142	V	50.6	Low	57.1	Low	8 Å²	8	42.7 Å²	42.7	5%	0.048	21%	0.212	C	C	.	.	H	α-helix	trans	-92.2	-23.9	-176	-174.8	0	0	0	0	110.8	W73 P101 H138 L145	W73-V142 HydrophobicContact CH2-CG1 4.46Å; W73-V142 HydrophobicContact CH2-CG2 4.3Å; W73-V142 HydrophobicContact CZ3-CG2 4.24Å; P101-V142 HydrophobicContact CB-CG1 4.38Å; P101-V142 WeakPolarHBondContact CD-O 3.39Å; P101-V142 HydrophobicContact CG-CG1 4.3Å; P101-V142 WeakPolarHBondContact CG-O 3.31Å; H138-V142 WeakPolarHBondContact O-CB 3.41Å; H138-V142 WeakPolarHBondContact O-CG2 3.26Å; H138-V142 PolarHBondContact O-N 3.36Å; V142-L145 HydrophobicContact CB-CD2 4.18Å; V142-L145 HydrophobicContact CG1-CD2 3.72Å; V142-L145 HydrophobicContact CG1-CG 4.46Å
143	G	51.3	Low	57	Low	32 Å²	32	42.8 Å²	42.8	33%	0.33	21%	0.213	S	C	.	.			trans	78.8	-155.1	-173.3	0	0	0	0	0	111.9	V139 L145	V139-G143 VanDerWaalsContact O-CA 3.26Å; V139-G143 WeakPolarHBondContact O-CA 3.31Å; V139-G143 PolarHBondContact O-N 3.18Å; G143-L145 PolarHBondContact O-N 3.41Å
144	Q	49.9	Very low	56.4	Low	129 Å²	129	50.1 Å²	50.1	60%	0.603	24%	0.237	S	C	*	.	S	Bend	trans	-62.3	104.9	-178.3	-70	-179.9	-1.5	0	0	109.7	Y104	Y104-Q144 PolarHBondContact OH-OE1 2.88Å
145	L	48.1	Very low	55.8	Low	10 Å²	10	51.4 Å²	51.4	5%	0.052	25%	0.248	C	C	.	.			trans	-66.5	144.2	178.7	-74.7	154.3	0	0	0	110.4	W135 H138 V139 V142 G143 F175	W135-L145 HydrophobicContact CH2-CD1 4.17Å; W135-L145 HydrophobicContact CZ2-CD1 3.75Å; H138-L145 WeakPolarHBondContact NE2-CD2 3.4Å; V139-L145 HydrophobicContact CG2-CD1 3.76Å; V142-L145 HydrophobicContact CB-CD2 4.18Å; V142-L145 HydrophobicContact CG1-CD2 3.72Å; V142-L145 HydrophobicContact CG1-CG 4.46Å; G143-L145 PolarHBondContact O-N 3.41Å; L145-F175 VanDerWaalsContact O-CD2 3.29Å; L145-F175 WeakPolarHBondContact O-CD2 3.27Å
146	G	54.9	Low	55.2	Low	18 Å²	18	59.2 Å²	59.2	19%	0.186	29%	0.291	C	S	.	.			trans	-59.6	172.8	157.4	0	0	0	0	0	111.6	L110 V148	L110-G146 CarbonylContact O-C 3.6Å; L110-G146 VanDerWaalsContact O-C 3.3Å; L110-G146 WeakPolarHBondContact O-CA 3.46Å; G146-V148 PolarHBondContact O-N 2.92Å
147	L	56.8	Low	54.6	Low	1 Å²	1	61.6 Å²	61.6	1%	0.005	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	114	173.1	178.4	65.7	0	0	0	109.1	L29 L49 F64 L110 L111 T112 F175 F177	L29-L147 HydrophobicContact CD1-CD2 4.14Å; L29-L147 HydrophobicContact CD2-CD2 4.15Å; L49-L147 HydrophobicContact CD1-CD1 3.58Å; F64-L147 HydrophobicContact CD1-CB 4.01Å; F64-L147 HydrophobicContact CD1-CD2 4.11Å; F64-L147 HydrophobicContact CE1-CB 3.68Å; F64-L147 HydrophobicContact CE1-CD2 3.75Å; F64-L147 HydrophobicContact CE1-CG 4.34Å; F64-L147 HydrophobicContact CZ-CD2 3.97Å; L110-L147 PolarHBondContact O-N 3.47Å; L111-L147 WeakPolarHBondContact CA-O 3.14Å; L111-L147 HydrophobicContact CD1-CB 3.79Å; L111-L147 HydrophobicContact CD1-CD2 3.53Å; L111-L147 HydrophobicContact CD1-CG 3.56Å; L111-L147 WeakPolarHBondContact CD1-O 3.34Å; T112-L147 PolarHBondContact N-O 2.96Å; T112-L147 VanDerWaalsContact N-O 3.11Å; L147-F175 HydrophobicContact CB-CB 4.09Å; L147-F175 HydrophobicContact CD1-CB 3.77Å; L147-F177 HydrophobicContact CD1-CB 3.98Å
148	V	59.3	Low	53.7	Low	5 Å²	5	60.3 Å²	60.3	3%	0.03	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	130.6	173.1	-174.8	0	0	0	0	108.3	F80 T112 L114 G146 I150 F175 L176 F177	F80-V148 HydrophobicContact CD2-CG1 4.49Å; F80-V148 HydrophobicContact CE2-CG1 4.28Å; T112-V148 HydrophobicContact CG2-CG1 4.34Å; T112-V148 HydrophobicContact CG2-CG2 4.19Å; L114-V148 HydrophobicContact CD1-CG1 4.15Å; G146-V148 PolarHBondContact O-N 2.92Å; V148-I150 HydrophobicContact CG1-CG1 4.13Å; V148-F175 PolarHBondContact N-O 3.28Å; V148-L176 HydrophobicContact CB-CD1 4.25Å; V148-L176 WeakPolarHBondContact O-CD1 3.45Å; V148-F177 PolarHBondContact O-N 3.45Å
149	I	59	Low	53.2	Low	0 Å²	0	61.2 Å²	61.2	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	120.2	171.4	-64.4	171.7	0	0	0	108.2	L29 L111 T112 F113 L114 F177	L29-I149 HydrophobicContact CD2-CD1 3.86Å; L111-I149 HydrophobicContact CD1-CD1 3.4Å; L111-I149 VanDerWaalsContact CD1-CD1 3.4Å; L111-I149 HydrophobicContact CD1-CG1 3.76Å; L111-I149 HydrophobicContact CD2-CD1 4.01Å; L111-I149 HydrophobicContact CG-CD1 4Å; T112-I149 PolarHBondContact O-N 3.23Å; F113-I149 WeakPolarHBondContact CA-O 3.29Å; F113-I149 HydrophobicContact CD1-CB 3.48Å; F113-I149 VanDerWaalsContact CD1-CB 3.48Å; F113-I149 HydrophobicContact CD1-CD1 4.08Å; F113-I149 HydrophobicContact CD1-CG1 4.33Å; F113-I149 HydrophobicContact CD1-CG2 3.5Å; F113-I149 HydrophobicContact CE1-CB 3.51Å; F113-I149 HydrophobicContact CE1-CD1 3.2Å; F113-I149 HydrophobicContact CE1-CG1 3.9Å; F113-I149 HydrophobicContact CE1-CG2 3.47Å; F113-I149 VanDerWaalsContact CE1-CG2 3.47Å; F113-I149 HydrophobicContact CE2-CD1 4.22Å; F113-I149 HydrophobicContact CG-CB 4.27Å; F113-I149 HydrophobicContact CZ-CB 4.33Å; F113-I149 HydrophobicContact CZ-CD1 3.29Å; F113-I149 HydrophobicContact CZ-CG1 4.32Å; L114-I149 PolarHBondContact N-O 3.45Å; L114-I149 VanDerWaalsContact N-O 3.11Å; I149-F177 HydrophobicContact CD1-CD1 4.34Å; I149-F177 HydrophobicContact CG1-CB 4.08Å; I149-F177 HydrophobicContact CG1-CD1 3.96Å; I149-F177 HydrophobicContact CG1-CG 4.42Å; I149-F177 HydrophobicContact CG2-CD1 4.03Å
150	I	58.6	Low	52.8	Low	5 Å²	5	64.6 Å²	64.6	3%	0.026	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	129.6	178	-60	177.5	0	0	0	108.6	F80 F116 V148 L176 F177 P179	F80-I150 HydrophobicContact CD1-CD1 4.15Å; F80-I150 HydrophobicContact CD2-CD1 3.88Å; F80-I150 HydrophobicContact CD2-CG1 4.1Å; F80-I150 HydrophobicContact CE1-CD1 3.74Å; F80-I150 HydrophobicContact CE2-CD1 3.49Å; F80-I150 VanDerWaalsContact CE2-CD1 3.49Å; F80-I150 HydrophobicContact CE2-CG1 4.07Å; F80-I150 HydrophobicContact CG-CD1 4.17Å; F80-I150 HydrophobicContact CZ-CD1 3.36Å; F80-I150 HydrophobicContact CZ-CG1 4.41Å; F116-I150 HydrophobicContact CB-CG2 3.67Å; F116-I150 HydrophobicContact CD2-CG2 4.06Å; F116-I150 HydrophobicContact CG-CG2 4.18Å; V148-I150 HydrophobicContact CG1-CG1 4.13Å; I150-L176 HydrophobicContact CB-CD1 4.45Å; I150-L176 HydrophobicContact CD1-CD1 3.37Å; I150-L176 HydrophobicContact CD1-CD2 4.25Å; I150-L176 HydrophobicContact CD1-CG 4.42Å; I150-L176 HydrophobicContact CG1-CD1 3.6Å; I150-F177 PolarHBondContact N-O 2.95Å; I150-P179 WeakPolarHBondContact O-CD 3.37Å
151	Y	59.2	Low	52.4	Low	31 Å²	31	58.7 Å²	58.7	12%	0.122	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	154	176.7	66.2	-82.9	0	0	0	109.9	F113 P115 F116 A191 E195	F113-Y151 HydrophobicContact CB-CE1 4.04Å; P115-Y151 HydrophobicContact CB-CE1 4.38Å; P115-Y151 HydrophobicContact CB-CE2 4.16Å; F116-Y151 WeakPolarHBondContact CB-O 3.36Å; F116-Y151 PolarHBondContact N-O 3.45Å; Y151-A191 HydrophobicContact CD2-CB 4.02Å; Y151-A191 HydrophobicContact CE2-CB 4.48Å; Y151-E195 PolarHBondContact OH-OE1 3.39Å
152	P	54.2	Low	52.3	Low	23 Å²	23	60.9 Å²	60.9	15%	0.149	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	134.3	-178.9	32.9	-27.8	0	0	0	108.5	R154 V159 M181	P152-R154 PolarHBondContact O-N 3.32Å; P152-V159 HydrophobicContact CB-CG2 4.24Å; P152-M181 HydrophobicContact CB-CE 3.63Å; P152-M181 HydrophobicContact CB-SD 4.43Å; P152-M181 HydrophobicContact CG-CE 3.35Å; P152-M181 HydrophobicContact CG-SD 3.54Å; P152-M181 VanDerWaalsContact CG-SD 3.54Å
153	E	54.9	Low	52.4	Low	93 Å²	93	64 Å²	64	44%	0.435	34%	0.337	S	S	.	.			trans	-67.7	128.5	166	-163	171.3	-171.9	0	0	109	P115 F116 E117 S155	P115-E153 HydrophobicContact CB-CB 4.28Å; F116-E153 PolarHBondContact O-N 3.27Å; F116-E153 VanDerWaalsContact O-N 3.14Å; E117-E153 WeakPolarHBondContact CG-OE2 3.34Å; E153-S155 PolarHBondContact O-N 2.86Å
154	R	52	Low	52.4	Low	234 Å²	234	63 Å²	63	88%	0.883	32%	0.324	S	S	*	.	S	Bend	trans	-16.9	92.2	178.7	-163.5	179.1	-167.7	168.9	1.7	115.4	P152	P152-R154 PolarHBondContact O-N 3.32Å
155	S	47.5	Very low	52.6	Low	54 Å²	54	58.9 Å²	58.9	38%	0.378	30%	0.304	S	S	.	.			trans	-122.5	133.4	161.4	67.2	0	0	0	0	110	E153 E157	E153-S155 PolarHBondContact O-N 2.86Å; S155-E157 PolarHBondContact O-N 3.19Å; S155-E157 VanDerWaalsContact O-N 3.17Å; S155-E157 PolarHBondContact OG-O 3.31Å
156	D	48.6	Very low	52.8	Low	170 Å²	170	63 Å²	63	91%	0.909	33%	0.326	S	S	*	.	S	Bend	trans	-66.8	-5.9	168.4	-76.9	-34.8	0	0	0	112
157	E	48	Very low	52.6	Low	153 Å²	153	64.4 Å²	64.4	72%	0.715	33%	0.331	S	S	*	.	S	Bend	trans	-95.3	142.7	179.6	-63.7	-164.7	165.8	0	0	112.9	S155 V159	S155-E157 PolarHBondContact O-N 3.19Å; S155-E157 VanDerWaalsContact O-N 3.17Å; S155-E157 PolarHBondContact OG-O 3.31Å; E157-V159 PolarHBondContact O-N 3.49Å
158	P	43.9	Very low	52.3	Low	83 Å²	83	64.5 Å²	64.5	54%	0.539	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-65.3	127.2	174.7	26.8	-32.9	0	0	0	111.1	W183	P158-W183 HydrophobicContact CB-CD2 4Å; P158-W183 HydrophobicContact CB-CE3 3.75Å; P158-W183 HydrophobicContact CB-CH2 3.48Å; P158-W183 VanDerWaalsContact CB-CH2 3.48Å; P158-W183 HydrophobicContact CB-CZ2 3.73Å; P158-W183 HydrophobicContact CB-CZ3 3.48Å; P158-W183 VanDerWaalsContact CB-CZ3 3.48Å; P158-W183 HydrophobicContact CG-CE3 4.29Å; P158-W183 HydrophobicContact CG-CH2 3.82Å; P158-W183 HydrophobicContact CG-CZ3 3.68Å
159	V	49.7	Very low	51.8	Low	22 Å²	22	70.7 Å²	70.7	13%	0.133	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-87.6	125.4	-179.5	176	0	0	0	0	110.9	M118 P152 E157 V161	M118-V159 HydrophobicContact CE-CB 4.23Å; M118-V159 HydrophobicContact CE-CG1 3.48Å; M118-V159 VanDerWaalsContact CE-CG1 3.48Å; M118-V159 HydrophobicContact CE-CG2 4.01Å; M118-V159 HydrophobicContact CG-CG2 4.2Å; M118-V159 HydrophobicContact SD-CB 4.48Å; M118-V159 HydrophobicContact SD-CG1 3.5Å; M118-V159 VanDerWaalsContact SD-CG1 3.5Å; M118-V159 HydrophobicContact SD-CG2 4.17Å; P152-V159 HydrophobicContact CB-CG2 4.24Å; E157-V159 PolarHBondContact O-N 3.49Å; V159-V161 HydrophobicContact CG1-CG1 3.83Å; V159-V161 PolarHBondContact O-N 3.42Å
160	N	50.3	Low	51.2	Low	104 Å²	104	74.5 Å²	74.5	56%	0.556	40%	0.397	S	S	*	.			trans	-76.8	87.1	169.7	-172.2	-7.1	0	0	0	110.7	T162	N160-T162 PolarHBondContact O-N 3.45Å; N160-T162 WeakPolarHBondContact OD1-CB 3.37Å; N160-T162 PolarHBondContact OD1-N 2.8Å; N160-T162 PolarHBondContact OD1-OG1 3.34Å
161	V	49.1	Very low	50.7	Low	24 Å²	24	75.9 Å²	75.9	15%	0.145	41%	0.406	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-3.4	174.1	-70.7	0	0	0	0	113.3	V159 N163 L164 F165 M181	V159-V161 HydrophobicContact CG1-CG1 3.83Å; V159-V161 PolarHBondContact O-N 3.42Å; V161-N163 PolarHBondContact O-N 3.08Å; V161-L164 HydrophobicContact CB-CB 4.47Å; V161-L164 HydrophobicContact CG1-CD2 4.41Å; V161-L164 WeakPolarHBondContact O-CA 3.46Å; V161-L164 VanDerWaalsContact O-CB 3.28Å; V161-L164 WeakPolarHBondContact O-CB 3.2Å; V161-L164 PolarHBondContact O-N 2.83Å; V161-F165 HydrophobicContact CB-CD2 3.98Å; V161-F165 HydrophobicContact CB-CE2 3.88Å; V161-F165 HydrophobicContact CG2-CD2 3.89Å; V161-F165 HydrophobicContact CG2-CE2 3.56Å; V161-F165 WeakPolarHBondContact O-CD2 3.34Å; V161-F165 PolarHBondContact O-N 2.87Å; V161-M181 HydrophobicContact CG1-CE 3.9Å; V161-M181 HydrophobicContact CG1-CG 4.25Å
162	T	52.6	Low	50.2	Low	80 Å²	80	85.6 Å²	85.6	49%	0.491	44%	0.442	S	S	.	.	H	α-helix	trans	-55.8	-39.7	-178	-56.3	0	0	0	0	111.7	N160 F165 L166	N160-T162 PolarHBondContact O-N 3.45Å; N160-T162 WeakPolarHBondContact OD1-CB 3.37Å; N160-T162 PolarHBondContact OD1-N 2.8Å; N160-T162 PolarHBondContact OD1-OG1 3.34Å; T162-F165 PolarHBondContact O-N 2.84Å; T162-L166 HydrophobicContact CG2-CD1 4.01Å; T162-L166 HydrophobicContact CG2-CG 4.3Å; T162-L166 WeakPolarHBondContact O-CB 3.31Å; T162-L166 VanDerWaalsContact O-CG 3.24Å; T162-L166 WeakPolarHBondContact O-CG 3.4Å; T162-L166 PolarHBondContact O-N 3.27Å
163	N	51.7	Low	50.1	Low	74 Å²	74	85 Å²	85	40%	0.396	44%	0.437	S	S	.	.	H	α-helix	trans	-67.1	-39.9	176.3	-71.6	-9.1	0	0	0	112.1	L127 V161 F165 L166 T167	L127-N163 HydrophobicContact CD1-CB 3.94Å; V161-N163 PolarHBondContact O-N 3.08Å; N163-F165 PolarHBondContact O-N 3.36Å; N163-L166 PolarHBondContact O-N 3.18Å; N163-T167 PolarHBondContact O-N 3.45Å; N163-T167 PolarHBondContact O-OG1 3.47Å
164	L	52.4	Low	49.8	Very low	9 Å²	9	81.3 Å²	81.3	5%	0.047	42%	0.422	C	S	.	.	H	α-helix	trans	-56.9	-50.2	172.4	179.5	68.8	0	0	0	110.4	L127 F130 V161 L166 T167 I168	L127-L164 HydrophobicContact CD1-CB 4.36Å; F130-L164 HydrophobicContact CD1-CD1 4.26Å; F130-L164 HydrophobicContact CE1-CD1 4.31Å; V161-L164 HydrophobicContact CB-CB 4.47Å; V161-L164 HydrophobicContact CG1-CD2 4.41Å; V161-L164 WeakPolarHBondContact O-CA 3.46Å; V161-L164 VanDerWaalsContact O-CB 3.28Å; V161-L164 WeakPolarHBondContact O-CB 3.2Å; V161-L164 PolarHBondContact O-N 2.83Å; L164-L166 PolarHBondContact O-N 2.84Å; L164-T167 PolarHBondContact O-N 3.23Å; L164-I168 HydrophobicContact CD1-CD1 3.87Å; L164-I168 HydrophobicContact CD1-CG1 4.48Å; L164-I168 HydrophobicContact CG-CD1 3.76Å; L164-I168 WeakPolarHBondContact O-CD1 3.31Å; L164-I168 WeakPolarHBondContact O-CG1 3.46Å; L164-I168 PolarHBondContact O-N 3.31Å
165	F	53.6	Low	49.9	Very low	43 Å²	43	71.3 Å²	71.3	19%	0.189	38%	0.384	C	S	.	.	H	α-helix	trans	-59.6	-43	176.3	-79.2	-80.2	0	0	0	112.3	L24 Y48 F50 V161 T162 N163 I168 K169 V178	L24-F165 HydrophobicContact CD1-CD1 3.77Å; L24-F165 HydrophobicContact CD1-CE1 3.6Å; Y48-F165 AromaticContact CD2-CE1 3.76Å; Y48-F165 HydrophobicContact CD2-CE1 3.76Å; Y48-F165 AromaticContact CD2-CZ 3.71Å; Y48-F165 HydrophobicContact CD2-CZ 3.71Å; Y48-F165 HydrophobicContact CE2-CE1 4.31Å; Y48-F165 HydrophobicContact CE2-CZ 4.11Å; Y48-F165 HydrophobicContact CG-CE1 4.33Å; F50-F165 HydrophobicContact CE1-CD1 4.33Å; F50-F165 HydrophobicContact CE2-CD1 4.39Å; F50-F165 HydrophobicContact CE2-CE1 4.18Å; F50-F165 AromaticContact CZ-CD1 3.52Å; F50-F165 HydrophobicContact CZ-CD1 3.52Å; F50-F165 AromaticContact CZ-CE1 3.7Å; F50-F165 HydrophobicContact CZ-CE1 3.7Å; V161-F165 HydrophobicContact CB-CD2 3.98Å; V161-F165 HydrophobicContact CB-CE2 3.88Å; V161-F165 HydrophobicContact CG2-CD2 3.89Å; V161-F165 HydrophobicContact CG2-CE2 3.56Å; V161-F165 WeakPolarHBondContact O-CD2 3.34Å; V161-F165 PolarHBondContact O-N 2.87Å; T162-F165 PolarHBondContact O-N 2.84Å; N163-F165 PolarHBondContact O-N 3.36Å; F165-I168 PolarHBondContact O-N 3.42Å; F165-K169 WeakPolarHBondContact O-CB 3.37Å; F165-K169 PolarHBondContact O-N 3.43Å; F165-V178 HydrophobicContact CZ-CG1 4.15Å
166	L	52.8	Low	50.4	Low	97 Å²	97	68.8 Å²	68.8	51%	0.508	37%	0.367	S	S	.	.	H	α-helix	trans	-66.5	-39.4	179.1	-74	172.9	0	0	0	112.5	T162 N163 L164 K169	T162-L166 HydrophobicContact CG2-CD1 4.01Å; T162-L166 HydrophobicContact CG2-CG 4.3Å; T162-L166 WeakPolarHBondContact O-CB 3.31Å; T162-L166 VanDerWaalsContact O-CG 3.24Å; T162-L166 WeakPolarHBondContact O-CG 3.4Å; T162-L166 PolarHBondContact O-N 3.27Å; N163-L166 PolarHBondContact O-N 3.18Å; L164-L166 PolarHBondContact O-N 2.84Å; L166-K169 HydrophobicContact CD2-CD 4.47Å; L166-K169 WeakPolarHBondContact O-CB 3.34Å; L166-K169 PolarHBondContact O-N 2.91Å
167	T	50.7	Low	50.9	Low	48 Å²	48	60.8 Å²	60.8	29%	0.294	32%	0.324	S	S	.	.	H	α-helix	trans	-71.9	-32.7	178.2	-52.5	0	0	0	0	111.9	F130 N163 L164	F130-T167 HydrophobicContact CD1-CG2 3.35Å; F130-T167 HydrophobicContact CE1-CG2 3.61Å; F130-T167 HydrophobicContact CG-CG2 4.48Å; N163-T167 PolarHBondContact O-N 3.45Å; N163-T167 PolarHBondContact O-OG1 3.47Å; L164-T167 PolarHBondContact O-N 3.23Å
168	I	49.9	Very low	51.4	Low	2 Å²	2	53.6 Å²	53.6	1%	0.01	29%	0.29	C	S	.	.	H	α-helix	trans	-74.2	-31.9	173.6	-60.3	160.8	0	0	0	110.8	F50 F130 L164 F165 G170 V171 F173 L176	F50-I168 HydrophobicContact CB-CG2 4.24Å; F50-I168 HydrophobicContact CD1-CB 4.39Å; F50-I168 HydrophobicContact CD1-CG2 3.35Å; F50-I168 HydrophobicContact CD2-CD1 4.42Å; F50-I168 HydrophobicContact CD2-CG2 3.93Å; F50-I168 HydrophobicContact CE1-CB 4.03Å; F50-I168 HydrophobicContact CE1-CG2 3.46Å; F50-I168 VanDerWaalsContact CE1-CG2 3.46Å; F50-I168 HydrophobicContact CE2-CD1 3.82Å; F50-I168 HydrophobicContact CE2-CG2 4.03Å; F50-I168 HydrophobicContact CG-CG2 3.56Å; F50-I168 HydrophobicContact CZ-CB 4.08Å; F50-I168 HydrophobicContact CZ-CD1 3.94Å; F50-I168 HydrophobicContact CZ-CG2 3.78Å; F130-I168 HydrophobicContact CE1-CG1 3.63Å; F130-I168 HydrophobicContact CZ-CG1 3.76Å; L164-I168 HydrophobicContact CD1-CD1 3.87Å; L164-I168 HydrophobicContact CD1-CG1 4.48Å; L164-I168 HydrophobicContact CG-CD1 3.76Å; L164-I168 WeakPolarHBondContact O-CD1 3.31Å; L164-I168 WeakPolarHBondContact O-CG1 3.46Å; L164-I168 PolarHBondContact O-N 3.31Å; F165-I168 PolarHBondContact O-N 3.42Å; I168-G170 PolarHBondContact O-N 2.84Å; I168-V171 PolarHBondContact O-N 3.17Å; I168-F173 HydrophobicContact CG2-CD2 4.12Å; I168-F173 HydrophobicContact CG2-CE2 4.23Å; I168-L176 HydrophobicContact CD1-CD2 3.56Å; I168-L176 HydrophobicContact CG1-CD2 4.19Å
169	K	48.1	Very low	51.9	Low	135 Å²	135	49.9 Å²	49.9	59%	0.587	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	110.3	-179.5	-175	-179.1	-179.3	179.3	0	110.6	F165 L166	F165-K169 WeakPolarHBondContact O-CB 3.37Å; F165-K169 PolarHBondContact O-N 3.43Å; L166-K169 HydrophobicContact CD2-CD 4.47Å; L166-K169 WeakPolarHBondContact O-CB 3.34Å; L166-K169 PolarHBondContact O-N 2.91Å
170	G	47.5	Very low	52	Low	80 Å²	80	50.7 Å²	50.7	83%	0.825	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	120.4	-10.7	174.1	0	0	0	0	0	113.8	I168	I168-G170 PolarHBondContact O-N 2.84Å
171	V	48.1	Very low	51.8	Low	35 Å²	35	47.8 Å²	47.8	21%	0.212	25%	0.252	C	S	.	.			trans	-106.5	129.2	-178.4	-145.4	0	0	0	0	110.9	E132 I168 F173	E132-V171 HydrophobicContact CG-CG2 4.11Å; I168-V171 PolarHBondContact O-N 3.17Å; V171-F173 HydrophobicContact CB-CD1 3.94Å; V171-F173 HydrophobicContact CB-CD2 3.8Å; V171-F173 HydrophobicContact CB-CE1 3.35Å; V171-F173 HydrophobicContact CB-CE2 3.27Å; V171-F173 HydrophobicContact CB-CG 4.15Å; V171-F173 HydrophobicContact CB-CZ 3.05Å; V171-F173 HydrophobicContact CG1-CD1 3.71Å; V171-F173 HydrophobicContact CG1-CD2 4.47Å; V171-F173 HydrophobicContact CG1-CE1 2.96Å; V171-F173 HydrophobicContact CG1-CE2 3.94Å; V171-F173 HydrophobicContact CG1-CG 4.42Å; V171-F173 HydrophobicContact CG1-CZ 3.17Å; V171-F173 HydrophobicContact CG2-CE1 4.13Å; V171-F173 HydrophobicContact CG2-CE2 3.58Å; V171-F173 HydrophobicContact CG2-CZ 3.37Å; V171-F173 PolarHBondContact O-N 3.27Å; V171-F173 VanDerWaalsContact O-N 3.14Å
172	R	48.8	Very low	51.3	Low	234 Å²	234	55 Å²	55	88%	0.883	28%	0.276	S	S	*	.			trans	-80.6	89.8	179.7	-64	-178.7	-174.5	-179.1	0.3	108.7
173	F	51.3	Low	50.5	Low	11 Å²	11	61.2 Å²	61.2	5%	0.048	29%	0.291	C	S	.	.			trans	-102.9	152.5	-173.9	-63.6	-45.8	0	0	0	113	N52 W135 I168 V171	N52-F173 PolarHBondContact ND2-O 2.9Å; W135-F173 HydrophobicContact CB-CZ 4.41Å; W135-F173 AromaticContact CD1-CD1 3.55Å; W135-F173 AromaticContact CD1-CE1 2.93Å; W135-F173 AromaticContact CD1-CE2 3.96Å; W135-F173 AromaticContact CD1-CZ 3.12Å; W135-F173 HydrophobicContact CG-CE1 4.02Å; W135-F173 AromaticContact CG-CZ 3.82Å; W135-F173 HydrophobicContact CG-CZ 3.82Å; W135-F173 AromaticContact NE1-CD1 3.28Å; W135-F173 VanDerWaalsContact NE1-CD1 3.28Å; W135-F173 AromaticContact NE1-CE1 3.22Å; W135-F173 AromaticContact NE1-CE2 3.93Å; W135-F173 AromaticContact NE1-CG 3.7Å; W135-F173 AromaticContact NE1-CZ 3.5Å; I168-F173 HydrophobicContact CG2-CD2 4.12Å; I168-F173 HydrophobicContact CG2-CE2 4.23Å; V171-F173 HydrophobicContact CB-CD1 3.94Å; V171-F173 HydrophobicContact CB-CD2 3.8Å; V171-F173 HydrophobicContact CB-CE1 3.35Å; V171-F173 HydrophobicContact CB-CE2 3.27Å; V171-F173 HydrophobicContact CB-CG 4.15Å; V171-F173 HydrophobicContact CB-CZ 3.05Å; V171-F173 HydrophobicContact CG1-CD1 3.71Å; V171-F173 HydrophobicContact CG1-CD2 4.47Å; V171-F173 HydrophobicContact CG1-CE1 2.96Å; V171-F173 HydrophobicContact CG1-CE2 3.94Å; V171-F173 HydrophobicContact CG1-CG 4.42Å; V171-F173 HydrophobicContact CG1-CZ 3.17Å; V171-F173 HydrophobicContact CG2-CE1 4.13Å; V171-F173 HydrophobicContact CG2-CE2 3.58Å; V171-F173 HydrophobicContact CG2-CZ 3.37Å; V171-F173 PolarHBondContact O-N 3.27Å; V171-F173 VanDerWaalsContact O-N 3.14Å
174	P	49.8	Very low	49.6	Very low	16 Å²	16	60.1 Å²	60.1	10%	0.104	29%	0.289	C	S	.	.	S	Bend	trans	-62.6	-56.3	-178.2	-23.6	34.8	0	0	0	113.4
175	F	54.3	Low	48.8	Very low	23 Å²	23	65.7 Å²	65.7	10%	0.101	32%	0.324	C	S	.	.			trans	-163	113.5	-172.1	-55.2	-91.4	0	0	0	111	V55 L145 L147 V148	V55-F175 HydrophobicContact CB-CD1 4.17Å; V55-F175 HydrophobicContact CB-CE1 3.63Å; V55-F175 HydrophobicContact CB-CZ 4.46Å; V55-F175 HydrophobicContact CG1-CD1 3.71Å; V55-F175 HydrophobicContact CG1-CE1 3.38Å; V55-F175 HydrophobicContact CG2-CD1 3.45Å; V55-F175 VanDerWaalsContact CG2-CD1 3.45Å; V55-F175 HydrophobicContact CG2-CE1 2.91Å; V55-F175 HydrophobicContact CG2-CE2 4.46Å; V55-F175 HydrophobicContact CG2-CG 4.45Å; V55-F175 HydrophobicContact CG2-CZ 3.47Å; V55-F175 VanDerWaalsContact CG2-CZ 3.47Å; L145-F175 VanDerWaalsContact O-CD2 3.29Å; L145-F175 WeakPolarHBondContact O-CD2 3.27Å; L147-F175 HydrophobicContact CB-CB 4.09Å; L147-F175 HydrophobicContact CD1-CB 3.77Å; V148-F175 PolarHBondContact N-O 3.28Å
176	L	57.8	Low	48.1	Very low	2 Å²	2	70 Å²	70	1%	0.01	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	122.9	171.1	176.1	66.9	0	0	0	108.8	F50 V148 I150 I168 V178	F50-L176 HydrophobicContact CD2-CB 4.45Å; F50-L176 HydrophobicContact CD2-CD2 4.29Å; F50-L176 HydrophobicContact CD2-CG 4.41Å; F50-L176 PolarHBondContact N-O 3.22Å; V148-L176 HydrophobicContact CB-CD1 4.25Å; V148-L176 WeakPolarHBondContact O-CD1 3.45Å; I150-L176 HydrophobicContact CB-CD1 4.45Å; I150-L176 HydrophobicContact CD1-CD1 3.37Å; I150-L176 HydrophobicContact CD1-CD2 4.25Å; I150-L176 HydrophobicContact CD1-CG 4.42Å; I150-L176 HydrophobicContact CG1-CD1 3.6Å; I168-L176 HydrophobicContact CD1-CD2 3.56Å; I168-L176 HydrophobicContact CG1-CD2 4.19Å; L176-V178 HydrophobicContact CD2-CG2 4.39Å; L176-V178 HydrophobicContact CG-CG2 4.29Å
177	F	59	Low	47.4	Very low	1 Å²	1	66.8 Å²	66.8	0%	0.004	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	123.7	175	175.4	-90.7	0	0	0	110.1	L29 L45 G47 Y48 L49 L147 V148 I149 I150 P179	L29-F177 HydrophobicContact CB-CE2 4.19Å; L29-F177 HydrophobicContact CB-CZ 4.4Å; L45-F177 HydrophobicContact CB-CE1 4.24Å; L45-F177 HydrophobicContact CB-CZ 4.02Å; G47-F177 VanDerWaalsContact CA-CZ 3.46Å; G47-F177 VanDerWaalsContact N-CE2 3.33Å; G47-F177 VanDerWaalsContact N-CZ 3.29Å; Y48-F177 WeakPolarHBondContact O-CA 3.48Å; L49-F177 HydrophobicContact CD1-CB 4.42Å; L147-F177 HydrophobicContact CD1-CB 3.98Å; V148-F177 PolarHBondContact O-N 3.45Å; I149-F177 HydrophobicContact CD1-CD1 4.34Å; I149-F177 HydrophobicContact CG1-CB 4.08Å; I149-F177 HydrophobicContact CG1-CD1 3.96Å; I149-F177 HydrophobicContact CG1-CG 4.42Å; I149-F177 HydrophobicContact CG2-CD1 4.03Å; I150-F177 PolarHBondContact N-O 2.95Å; F177-P179 HydrophobicContact CE1-CB 4.03Å
178	V	57.6	Low	47	Very low	2 Å²	2	68.9 Å²	68.9	1%	0.012	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	112.4	174.3	-177.6	0	0	0	0	107.5	G47 Y48 F50 F165 L176	G47-V178 CarbonylContact C-O 3.53Å; G47-V178 WeakPolarHBondContact CA-O 3.17Å; Y48-V178 PolarHBondContact N-O 3.19Å; Y48-V178 PolarHBondContact O-N 2.88Å; F50-V178 HydrophobicContact CD2-CG2 4.45Å; F50-V178 HydrophobicContact CE2-CG2 3.85Å; F165-V178 HydrophobicContact CZ-CG1 4.15Å; L176-V178 HydrophobicContact CD2-CG2 4.39Å; L176-V178 HydrophobicContact CG-CG2 4.29Å
179	P	54.6	Low	46.9	Very low	5 Å²	5	73 Å²	73	3%	0.032	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.8	150.4	177.3	25.1	-30	0	0	0	110.4	E46 I150 F177 M181	E46-P179 WeakPolarHBondContact O-CA 3.28Å; I150-P179 WeakPolarHBondContact O-CD 3.37Å; F177-P179 HydrophobicContact CE1-CB 4.03Å; P179-M181 PolarHBondContact O-N 3Å
180	F	51.3	Low	46.9	Very low	39 Å²	39	68.3 Å²	68.3	17%	0.171	34%	0.342	C	S	.	.			trans	-60.6	107.9	173.2	-76.5	-84	0	0	0	109.6	E26 E46 G47 Y48 R182	E26-F180 HydrophobicContact CB-CE2 4.47Å; E26-F180 HydrophobicContact CB-CZ 3.96Å; E26-F180 HydrophobicContact CG-CZ 3.74Å; E46-F180 HydrophobicContact CB-CD2 3.56Å; E46-F180 HydrophobicContact CB-CE2 3.87Å; E46-F180 WeakPolarHBondContact O-CD2 3.12Å; E46-F180 PolarHBondContact O-N 2.84Å; G47-F180 VanDerWaalsContact CA-CD2 3.5Å; Y48-F180 HydrophobicContact CD1-CE1 4.45Å; Y48-F180 HydrophobicContact CD1-CZ 4.24Å; Y48-F180 HydrophobicContact CD2-CE1 4.3Å; Y48-F180 AromaticContact CE1-CE1 3.7Å; Y48-F180 HydrophobicContact CE1-CE1 3.7Å; Y48-F180 AromaticContact CE1-CZ 3.76Å; Y48-F180 HydrophobicContact CE1-CZ 3.76Å; Y48-F180 AromaticContact CE2-CD1 3.81Å; Y48-F180 HydrophobicContact CE2-CD1 3.81Å; Y48-F180 AromaticContact CE2-CE1 3.54Å; Y48-F180 HydrophobicContact CE2-CE1 3.54Å; Y48-F180 HydrophobicContact CE2-CZ 4.2Å; Y48-F180 AromaticContact CZ-CD1 3.97Å; Y48-F180 AromaticContact CZ-CE1 3.22Å; Y48-F180 AromaticContact CZ-CZ 3.8Å; Y48-F180 VanDerWaalsContact OH-CE1 3.31Å; Y48-F180 WeakPolarHBondContact OH-CE1 3.26Å; F180-R182 PolarHBondContact O-N 3.36Å
181	M	46.2	Very low	47.1	Very low	44 Å²	44	65.4 Å²	65.4	22%	0.217	31%	0.31	C	S	.	.			trans	-74	64.6	163.8	-53.7	-74.7	-141.9	0	0	108	P152 V161 P179 W183 V187	P152-M181 HydrophobicContact CB-CE 3.63Å; P152-M181 HydrophobicContact CB-SD 4.43Å; P152-M181 HydrophobicContact CG-CE 3.35Å; P152-M181 HydrophobicContact CG-SD 3.54Å; P152-M181 VanDerWaalsContact CG-SD 3.54Å; V161-M181 HydrophobicContact CG1-CE 3.9Å; V161-M181 HydrophobicContact CG1-CG 4.25Å; P179-M181 PolarHBondContact O-N 3Å; M181-W183 PolarHBondContact O-N 3.43Å; M181-V187 HydrophobicContact SD-CG1 4.08Å
182	R	38.4	Very low	47.4	Very low	175 Å²	175	69 Å²	69	66%	0.66	32%	0.323	S	S	*	.			trans	-69.4	127.4	173	-123.6	-178.5	-176.4	173.4	2.9	106.5	F180 S184 V187	F180-R182 PolarHBondContact O-N 3.36Å; R182-S184 PolarHBondContact O-N 3.48Å; R182-V187 WeakPolarHBondContact O-CG2 3.45Å
183	W	36.6	Very low	47.8	Very low	210 Å²	210	61 Å²	61	80%	0.795	30%	0.297	S	S	*	.	S	Bend	trans	-64.5	6.2	-178.5	-69.9	44	0	0	0	113.7	P158 M181	P158-W183 HydrophobicContact CB-CD2 4Å; P158-W183 HydrophobicContact CB-CE3 3.75Å; P158-W183 HydrophobicContact CB-CH2 3.48Å; P158-W183 VanDerWaalsContact CB-CH2 3.48Å; P158-W183 HydrophobicContact CB-CZ2 3.73Å; P158-W183 HydrophobicContact CB-CZ3 3.48Å; P158-W183 VanDerWaalsContact CB-CZ3 3.48Å; P158-W183 HydrophobicContact CG-CE3 4.29Å; P158-W183 HydrophobicContact CG-CH2 3.82Å; P158-W183 HydrophobicContact CG-CZ3 3.68Å; M181-W183 PolarHBondContact O-N 3.43Å
184	S	33.9	Very low	48.1	Very low	51 Å²	51	60.7 Å²	60.7	36%	0.357	30%	0.296	S	S	.	.	S	Bend	trans	-82.4	139.1	167.8	54.8	0	0	0	0	109.6	R182 E186 V187	R182-S184 PolarHBondContact O-N 3.48Å; S184-E186 PolarHBondContact O-N 2.94Å; S184-V187 PolarHBondContact O-N 3.28Å
185	T	33.8	Very low	48.5	Very low	126 Å²	126	64.4 Å²	64.4	77%	0.773	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-43.3	-3.6	179.6	47.2	0	0	0	0	118.1
186	E	39	Very low	48.9	Very low	133 Å²	133	66.1 Å²	66.1	62%	0.621	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-17.2	178.2	-63.4	-179.9	173.3	0	0	113.9	S184 I188 D189 T190	S184-E186 PolarHBondContact O-N 2.94Å; E186-I188 VanDerWaalsContact C-N 3.29Å; E186-I188 PolarHBondContact O-N 3.22Å; E186-D189 WeakPolarHBondContact O-CB 3.47Å; E186-D189 PolarHBondContact O-N 3.42Å; E186-T190 PolarHBondContact O-N 2.92Å
187	V	39.2	Very low	48.9	Very low	30 Å²	30	66.1 Å²	66.1	18%	0.182	32%	0.322	C	S	.	.	H	α-helix	trans	-63.7	-36.5	-179.9	176.2	0	0	0	0	112	M181 R182 S184 D189 T190 A191	M181-V187 HydrophobicContact SD-CG1 4.08Å; R182-V187 WeakPolarHBondContact O-CG2 3.45Å; S184-V187 PolarHBondContact O-N 3.28Å; V187-D189 PolarHBondContact O-N 2.85Å; V187-T190 PolarHBondContact O-N 3.19Å; V187-T190 PolarHBondContact O-OG1 3.06Å; V187-A191 PolarHBondContact O-N 3.27Å
188	I	42.9	Very low	48.8	Very low	93 Å²	93	67.1 Å²	67.1	48%	0.477	33%	0.326	S	S	.	.	H	α-helix	trans	-58.4	-31.7	176.5	-56.7	168.9	0	0	0	110.2	E186 K192	E186-I188 VanDerWaalsContact C-N 3.29Å; E186-I188 PolarHBondContact O-N 3.22Å; I188-K192 HydrophobicContact CG2-CD 4.48Å; I188-K192 WeakPolarHBondContact O-CG 3.4Å; I188-K192 PolarHBondContact O-N 3.16Å
189	D	46.6	Very low	48.9	Very low	87 Å²	87	73.2 Å²	73.2	47%	0.465	36%	0.359	S	S	.	.	H	α-helix	trans	-78.4	-35.1	177	-73.2	-18.4	0	0	0	111.6	E186 V187 A191 K192 I193	E186-D189 WeakPolarHBondContact O-CB 3.47Å; E186-D189 PolarHBondContact O-N 3.42Å; V187-D189 PolarHBondContact O-N 2.85Å; D189-A191 PolarHBondContact O-N 2.85Å; D189-K192 CarbonylContact O-C 3.35Å; D189-K192 PolarHBondContact O-N 2.98Å; D189-I193 HydrophobicContact CB-CD1 3.94Å; D189-I193 HydrophobicContact CB-CG1 4.46Å; D189-I193 WeakPolarHBondContact O-CA 3.3Å; D189-I193 WeakPolarHBondContact O-CB 3.25Å; D189-I193 VanDerWaalsContact O-CD1 3.3Å; D189-I193 WeakPolarHBondContact O-CD1 3.4Å; D189-I193 WeakPolarHBondContact O-CG1 3.46Å; D189-I193 PolarHBondContact O-N 3.04Å
190	T	49.1	Very low	49.1	Very low	38 Å²	38	77.4 Å²	77.4	23%	0.233	38%	0.381	C	S	.	.	H	α-helix	trans	-60.2	-45.4	177	52	0	0	0	0	113	E186 V187 I193 L194	E186-T190 PolarHBondContact O-N 2.92Å; V187-T190 PolarHBondContact O-N 3.19Å; V187-T190 PolarHBondContact O-OG1 3.06Å; T190-I193 PolarHBondContact O-N 3.12Å; T190-L194 VanDerWaalsContact O-CB 3.31Å; T190-L194 WeakPolarHBondContact O-CB 3.33Å; T190-L194 WeakPolarHBondContact O-CD1 3.47Å; T190-L194 WeakPolarHBondContact O-CG 3.3Å; T190-L194 PolarHBondContact O-N 2.92Å
191	A	51.2	Low	49.5	Very low	19 Å²	19	76.4 Å²	76.4	16%	0.157	38%	0.377	C	S	.	.	H	α-helix	trans	-63.5	-44.7	177	0	0	0	0	0	111.7	Y151 V187 D189 L194 E195	Y151-A191 HydrophobicContact CD2-CB 4.02Å; Y151-A191 HydrophobicContact CE2-CB 4.48Å; V187-A191 PolarHBondContact O-N 3.27Å; D189-A191 PolarHBondContact O-N 2.85Å; A191-L194 WeakPolarHBondContact O-CB 3.22Å; A191-L194 PolarHBondContact O-N 3.39Å; A191-E195 PolarHBondContact O-N 3.04Å
192	K	54.3	Low	50	Low	110 Å²	110	78.4 Å²	78.4	48%	0.478	40%	0.395	S	S	.	.	H	α-helix	trans	-65.8	-38.6	175.2	-79.8	179.6	-178.8	169	0	113.2	I188 D189 L194 E195 D196	I188-K192 HydrophobicContact CG2-CD 4.48Å; I188-K192 WeakPolarHBondContact O-CG 3.4Å; I188-K192 PolarHBondContact O-N 3.16Å; D189-K192 CarbonylContact O-C 3.35Å; D189-K192 PolarHBondContact O-N 2.98Å; K192-L194 VanDerWaalsContact C-N 3.3Å; K192-E195 PolarHBondContact O-N 3.38Å; K192-D196 WeakPolarHBondContact O-CA 3.42Å; K192-D196 WeakPolarHBondContact O-CB 3.28Å; K192-D196 PolarHBondContact O-N 3.48Å
193	I	57.2	Low	50.9	Low	66 Å²	66	75 Å²	75	34%	0.338	39%	0.39	S	S	.	.	H	α-helix	trans	-65.7	-41.3	178.3	-73.7	163.5	0	0	0	108.4	V43 D189 T190 L197	V43-I193 HydrophobicContact CB-CG2 4.2Å; V43-I193 HydrophobicContact CG1-CG2 3.51Å; V43-I193 HydrophobicContact CG2-CG2 3.63Å; D189-I193 HydrophobicContact CB-CD1 3.94Å; D189-I193 HydrophobicContact CB-CG1 4.46Å; D189-I193 WeakPolarHBondContact O-CA 3.3Å; D189-I193 WeakPolarHBondContact O-CB 3.25Å; D189-I193 VanDerWaalsContact O-CD1 3.3Å; D189-I193 WeakPolarHBondContact O-CD1 3.4Å; D189-I193 WeakPolarHBondContact O-CG1 3.46Å; D189-I193 PolarHBondContact O-N 3.04Å; T190-I193 PolarHBondContact O-N 3.12Å; I193-L197 HydrophobicContact CG2-CD1 4.21Å; I193-L197 VanDerWaalsContact O-CB 3.25Å; I193-L197 WeakPolarHBondContact O-CB 3.36Å; I193-L197 PolarHBondContact O-N 2.95Å
194	L	56.6	Low	51.9	Low	5 Å²	5	65.7 Å²	65.7	3%	0.026	36%	0.356	C	S	.	.	H	α-helix	trans	-60.6	-59.2	173.1	-74.5	169.6	0	0	0	110	L45 F113 T190 A191 K192 D196 L197 F198	L45-L194 HydrophobicContact CD1-CD2 3.36Å; L45-L194 HydrophobicContact CD1-CG 4.46Å; L45-L194 HydrophobicContact CD2-CD1 4.07Å; L45-L194 HydrophobicContact CD2-CD2 3.45Å; L45-L194 VanDerWaalsContact CD2-CD2 3.45Å; L45-L194 HydrophobicContact CD2-CG 3.69Å; L45-L194 HydrophobicContact CG-CD2 3.99Å; F113-L194 HydrophobicContact CD1-CD1 4.22Å; F113-L194 HydrophobicContact CD1-CD2 4.39Å; F113-L194 HydrophobicContact CE1-CB 4.35Å; F113-L194 HydrophobicContact CE1-CD1 3.78Å; F113-L194 HydrophobicContact CE1-CD2 3.36Å; F113-L194 HydrophobicContact CE1-CG 4.03Å; F113-L194 HydrophobicContact CZ-CD2 3.58Å; T190-L194 VanDerWaalsContact O-CB 3.31Å; T190-L194 WeakPolarHBondContact O-CB 3.33Å; T190-L194 WeakPolarHBondContact O-CD1 3.47Å; T190-L194 WeakPolarHBondContact O-CG 3.3Å; T190-L194 PolarHBondContact O-N 2.92Å; A191-L194 WeakPolarHBondContact O-CB 3.22Å; A191-L194 PolarHBondContact O-N 3.39Å; K192-L194 VanDerWaalsContact C-N 3.3Å; L194-D196 VanDerWaalsContact C-N 3.3Å; L194-D196 PolarHBondContact O-N 3.46Å; L194-L197 WeakPolarHBondContact O-CB 3.44Å; L194-L197 PolarHBondContact O-N 2.99Å; L194-L197 VanDerWaalsContact O-N 3.1Å; L194-F198 HydrophobicContact CD2-CD2 4.49Å; L194-F198 HydrophobicContact CD2-CE2 3.76Å; L194-F198 WeakPolarHBondContact O-CD2 3.49Å; L194-F198 PolarHBondContact O-N 3.32Å
195	E	59.5	Low	53.1	Low	93 Å²	93	65.7 Å²	65.7	44%	0.435	36%	0.357	S	S	.	.	H	α-helix	trans	-55.6	-42.8	178.7	-75.5	-179.9	179.8	0	0	112.7	Y151 A191 K192 F198 N199	Y151-E195 PolarHBondContact OH-OE1 3.39Å; A191-E195 PolarHBondContact O-N 3.04Å; K192-E195 PolarHBondContact O-N 3.38Å; E195-F198 PolarHBondContact O-N 3.35Å; E195-N199 VanDerWaalsContact O-CB 3.23Å; E195-N199 WeakPolarHBondContact O-CB 3.23Å; E195-N199 VanDerWaalsContact O-CG 3.27Å; E195-N199 PolarHBondContact O-N 3.32Å; E195-N199 PolarHBondContact O-ND2 2.91Å
196	D	62	Low	54.3	Low	60 Å²	60	59.8 Å²	59.8	32%	0.321	32%	0.32	S	S	.	.	H	α-helix	trans	-66.7	-41	177	-173.3	49.5	0	0	0	111.8	R41 K192 L194 F198 N200	R41-D196 IonicContact CZ-OD2 3.91Å; R41-D196 IonicContact NH1-OD2 2.69Å; R41-D196 PolarHBondContact NH1-OD2 3.39Å; K192-D196 WeakPolarHBondContact O-CA 3.42Å; K192-D196 WeakPolarHBondContact O-CB 3.28Å; K192-D196 PolarHBondContact O-N 3.48Å; L194-D196 VanDerWaalsContact C-N 3.3Å; L194-D196 PolarHBondContact O-N 3.46Å; D196-F198 VanDerWaalsContact C-N 3.3Å; D196-F198 PolarHBondContact O-N 3.15Å; D196-N200 VanDerWaalsContact O-CB 3.3Å; D196-N200 WeakPolarHBondContact O-CB 3.04Å; D196-N200 PolarHBondContact O-N 3.01Å; D196-N200 PolarHBondContact OD1-ND2 2.97Å
197	L	58.7	Low	55.2	Low	2 Å²	2	56.4 Å²	56.4	1%	0.01	31%	0.309	C	S	.	.	H	α-helix	trans	-60.9	-41.2	174.9	-123.9	83.7	0	0	0	111.5	C31 A33 V43 I193 L194 F201 V204	C31-L197 HydrophobicContact CB-CD2 4.41Å; A33-L197 HydrophobicContact CB-CD2 3.48Å; A33-L197 VanDerWaalsContact CB-CD2 3.48Å; A33-L197 HydrophobicContact CB-CG 3.69Å; V43-L197 HydrophobicContact CB-CD1 3.81Å; V43-L197 HydrophobicContact CB-CD2 3.9Å; V43-L197 HydrophobicContact CG1-CD1 4.41Å; V43-L197 HydrophobicContact CG1-CD2 4.49Å; V43-L197 HydrophobicContact CG2-CD1 3.21Å; V43-L197 HydrophobicContact CG2-CD2 4.24Å; V43-L197 HydrophobicContact CG2-CG 4.36Å; I193-L197 HydrophobicContact CG2-CD1 4.21Å; I193-L197 VanDerWaalsContact O-CB 3.25Å; I193-L197 WeakPolarHBondContact O-CB 3.36Å; I193-L197 PolarHBondContact O-N 2.95Å; L194-L197 WeakPolarHBondContact O-CB 3.44Å; L194-L197 PolarHBondContact O-N 2.99Å; L194-L197 VanDerWaalsContact O-N 3.1Å; L197-F201 HydrophobicContact CG-CD2 4.42Å; L197-F201 WeakPolarHBondContact O-CB 3.18Å; L197-F201 WeakPolarHBondContact O-CD2 3.24Å; L197-F201 WeakPolarHBondContact O-CG 3.48Å; L197-F201 PolarHBondContact O-N 3.48Å; L197-V204 HydrophobicContact CD2-CG1 4.38Å
198	F	56.5	Low	56	Low	21 Å²	21	55.3 Å²	55.3	9%	0.092	30%	0.302	C	S	.	.	H	α-helix	trans	-89.9	-31.7	-169.8	-69.2	-70.4	0	0	0	112.6	F66 L111 F113 L194 E195 D196 N200 V204	F66-F198 HydrophobicContact CB-CD1 4.01Å; F66-F198 HydrophobicContact CB-CE1 3.81Å; F66-F198 HydrophobicContact CD1-CB 4.45Å; F66-F198 AromaticContact CD1-CD1 3.58Å; F66-F198 HydrophobicContact CD1-CD1 3.58Å; F66-F198 HydrophobicContact CD1-CE1 4.27Å; F66-F198 HydrophobicContact CD1-CG 4.34Å; F66-F198 AromaticContact CD2-CD1 3.84Å; F66-F198 HydrophobicContact CD2-CD1 3.84Å; F66-F198 AromaticContact CD2-CE1 3.97Å; F66-F198 HydrophobicContact CD2-CE1 3.97Å; F66-F198 HydrophobicContact CD2-CG 4.43Å; F66-F198 HydrophobicContact CE1-CB 4Å; F66-F198 AromaticContact CE1-CD1 3.97Å; F66-F198 HydrophobicContact CE1-CD1 3.97Å; F66-F198 HydrophobicContact CE1-CG 4.27Å; F66-F198 HydrophobicContact CE2-CD1 4.25Å; F66-F198 HydrophobicContact CE2-CG 4.42Å; F66-F198 AromaticContact CG-CD1 3.5Å; F66-F198 HydrophobicContact CG-CD1 3.5Å; F66-F198 VanDerWaalsContact CG-CD1 3.5Å; F66-F198 AromaticContact CG-CE1 3.73Å; F66-F198 HydrophobicContact CG-CE1 3.73Å; F66-F198 HydrophobicContact CG-CG 4.4Å; F66-F198 HydrophobicContact CZ-CB 4.14Å; F66-F198 HydrophobicContact CZ-CD1 4.28Å; F66-F198 HydrophobicContact CZ-CG 4.31Å; L111-F198 HydrophobicContact CD2-CZ 4.33Å; F113-F198 HydrophobicContact CD2-CD2 4.19Å; F113-F198 HydrophobicContact CD2-CE2 4.21Å; F113-F198 HydrophobicContact CE1-CE2 4.18Å; F113-F198 HydrophobicContact CE2-CD1 4.44Å; F113-F198 AromaticContact CE2-CD2 3.6Å; F113-F198 HydrophobicContact CE2-CD2 3.6Å; F113-F198 HydrophobicContact CE2-CE1 4.02Å; F113-F198 AromaticContact CE2-CE2 3.21Å; F113-F198 HydrophobicContact CE2-CE2 3.21Å; F113-F198 HydrophobicContact CE2-CG 4.27Å; F113-F198 AromaticContact CE2-CZ 3.44Å; F113-F198 HydrophobicContact CE2-CZ 3.44Å; F113-F198 VanDerWaalsContact CE2-CZ 3.44Å; F113-F198 AromaticContact CZ-CD2 3.92Å; F113-F198 HydrophobicContact CZ-CD2 3.92Å; F113-F198 AromaticContact CZ-CE2 3.19Å; F113-F198 HydrophobicContact CZ-CE2 3.19Å; F113-F198 AromaticContact CZ-CZ 3.58Å; F113-F198 HydrophobicContact CZ-CZ 3.58Å; L194-F198 HydrophobicContact CD2-CD2 4.49Å; L194-F198 HydrophobicContact CD2-CE2 3.76Å; L194-F198 WeakPolarHBondContact O-CD2 3.49Å; L194-F198 PolarHBondContact O-N 3.32Å; E195-F198 PolarHBondContact O-N 3.35Å; D196-F198 VanDerWaalsContact C-N 3.3Å; D196-F198 PolarHBondContact O-N 3.15Å; F198-N200 VanDerWaalsContact C-N 3.34Å; F198-V204 HydrophobicContact CD1-CB 4.12Å; F198-V204 HydrophobicContact CD1-CG1 4.41Å; F198-V204 HydrophobicContact CD1-CG2 3.64Å; F198-V204 HydrophobicContact CE1-CB 3.51Å; F198-V204 HydrophobicContact CE1-CG1 3.44Å; F198-V204 VanDerWaalsContact CE1-CG1 3.44Å; F198-V204 HydrophobicContact CE1-CG2 3.51Å; F198-V204 HydrophobicContact CZ-CB 4.33Å; F198-V204 HydrophobicContact CZ-CG1 3.75Å; F198-V204 HydrophobicContact CZ-CG2 4.42Å
199	N	59.3	Low	56.6	Low	130 Å²	130	52.3 Å²	52.3	70%	0.695	29%	0.291	S	S	*	.	H	α-helix	trans	-72.6	-28	174.4	-71.3	-30.1	0	0	0	112.6	E195	E195-N199 VanDerWaalsContact O-CB 3.23Å; E195-N199 WeakPolarHBondContact O-CB 3.23Å; E195-N199 VanDerWaalsContact O-CG 3.27Å; E195-N199 PolarHBondContact O-N 3.32Å; E195-N199 PolarHBondContact O-ND2 2.91Å
200	N	59.7	Low	57	Low	94 Å²	94	52 Å²	52	50%	0.503	30%	0.301	S	S	.	.	H	α-helix	trans	-105.6	-10.8	-175.3	-68.7	-34.4	0	0	0	115.3	D196 F198	D196-N200 VanDerWaalsContact O-CB 3.3Å; D196-N200 WeakPolarHBondContact O-CB 3.04Å; D196-N200 PolarHBondContact O-N 3.01Å; D196-N200 PolarHBondContact OD1-ND2 2.97Å; F198-N200 VanDerWaalsContact C-N 3.34Å
201	F	58.1	Low	57	Low	17 Å²	17	53.5 Å²	53.5	8%	0.075	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	132.1	-174.3	-57.9	-112.2	0	0	0	111.6	A33 T34 R41 L197 V204	A33-F201 HydrophobicContact CB-CB 3.7Å; A33-F201 HydrophobicContact CB-CD1 3.51Å; A33-F201 HydrophobicContact CB-CD2 4.42Å; A33-F201 HydrophobicContact CB-CE1 4.33Å; A33-F201 HydrophobicContact CB-CG 3.63Å; T34-F201 VanDerWaalsContact C-CD1 3.42Å; R41-F201 HydrophobicContact CB-CE1 3.75Å; R41-F201 HydrophobicContact CB-CZ 3.81Å; R41-F201 HydrophobicContact CG-CE1 3.78Å; R41-F201 HydrophobicContact CG-CZ 3.52Å; L197-F201 HydrophobicContact CG-CD2 4.42Å; L197-F201 WeakPolarHBondContact O-CB 3.18Å; L197-F201 WeakPolarHBondContact O-CD2 3.24Å; L197-F201 WeakPolarHBondContact O-CG 3.48Å; L197-F201 PolarHBondContact O-N 3.48Å; F201-V204 HydrophobicContact CB-CG2 4.27Å
202	S	56.8	Low	56.7	Low	87 Å²	87	54.9 Å²	54.9	61%	0.608	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88	-26.1	-173.5	63.6	0	0	0	0	114
203	N	57.7	Low	55.9	Low	104 Å²	104	58.3 Å²	58.3	56%	0.556	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.7	102.4	177.4	-46	-47.9	0	0	0	109.1	A33 T34	A33-N203 WeakPolarHBondContact CA-O 3.02Å; T34-N203 PolarHBondContact N-O 2.91Å; T34-N203 WeakPolarHBondContact OG1-CB 3.1Å; T34-N203 PolarHBondContact OG1-ND2 3.23Å
204	V	57.6	Low	54.8	Low	13 Å²	13	57.3 Å²	57.3	8%	0.079	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	120.5	171.1	-172.1	0	0	0	0	108.2	C31 N32 A33 L197 F198 F201	C31-V204 HydrophobicContact CB-CG1 4.03Å; N32-V204 WeakPolarHBondContact O-CA 3.19Å; A33-V204 HydrophobicContact CB-CB 4.48Å; A33-V204 HydrophobicContact CB-CG1 4.35Å; A33-V204 HydrophobicContact CB-CG2 3.77Å; L197-V204 HydrophobicContact CD2-CG1 4.38Å; F198-V204 HydrophobicContact CD1-CB 4.12Å; F198-V204 HydrophobicContact CD1-CG1 4.41Å; F198-V204 HydrophobicContact CD1-CG2 3.64Å; F198-V204 HydrophobicContact CE1-CB 3.51Å; F198-V204 HydrophobicContact CE1-CG1 3.44Å; F198-V204 VanDerWaalsContact CE1-CG1 3.44Å; F198-V204 HydrophobicContact CE1-CG2 3.51Å; F198-V204 HydrophobicContact CZ-CB 4.33Å; F198-V204 HydrophobicContact CZ-CG1 3.75Å; F198-V204 HydrophobicContact CZ-CG2 4.42Å; F201-V204 HydrophobicContact CB-CG2 4.27Å
205	S	59.4	Low	53.9	Low	52 Å²	52	63.7 Å²	63.7	36%	0.364	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	119.7	172	59.3	0	0	0	0	108.2	C31 N32	C31-S205 WeakPolarHBondContact CA-O 3.42Å; N32-S205 PolarHBondContact N-O 3.45Å; N32-S205 PolarHBondContact O-N 3.41Å; N32-S205 PolarHBondContact O-OG 3.28Å
206	C	58.1	Low	52.8	Low	1 Å²	1	62.5 Å²	62.5	1%	0.007	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	149.8	173.1	-54.1	0	0	0	0	110.8	L29 L30 C31 F64 L111	L29-C206 HydrophobicContact CD1-CB 3.9Å; L29-C206 HydrophobicContact CD2-CB 4.2Å; L29-C206 HydrophobicContact CG-CB 3.97Å; L30-C206 CarbonylContact O-C 3.49Å; L30-C206 VanDerWaalsContact O-CA 3.32Å; L30-C206 WeakPolarHBondContact O-CA 3.21Å; C31-C206 HydrophobicContact CB-CB 4.14Å; C31-C206 WeakPolarHBondContact CB-SG 3Å; C31-C206 WeakPolarHBondContact SG-CB 3.29Å; C31-C206 CovalentContact SG-SG 2.05Å; C31-C206 PolarHBondContact SG-SG 3.43Å; F64-C206 HydrophobicContact CB-CB 4.03Å; F64-C206 HydrophobicContact CD2-CB 4.02Å; F64-C206 WeakPolarHBondContact CD2-O 3.48Å; F64-C206 HydrophobicContact CG-CB 4.38Å; L111-C206 VanDerWaalsContact CD2-SG 3.6Å
207	T	57.9	Low	51.4	Low	62 Å²	62	67.6 Å²	67.6	38%	0.38	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	135	174.1	44.4	0	0	0	0	108	L30	L30-T207 PolarHBondContact N-O 3.46Å; L30-T207 PolarHBondContact O-N 3.07Å; L30-T207 PolarHBondContact O-OG1 3.04Å
208	L	57	Low	50.4	Low	7 Å²	7	69.3 Å²	69.3	4%	0.037	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	128.6	-179.4	176.9	72.4	0	0	0	109.2	D27 L29 L49 V55 A59 F64	D27-L208 HydrophobicContact CB-CD1 4.02Å; L29-L208 HydrophobicContact CD1-CB 4.25Å; L29-L208 HydrophobicContact CD1-CD1 4.37Å; L49-L208 HydrophobicContact CD2-CD1 3.89Å; L49-L208 HydrophobicContact CD2-CD2 3.23Å; L49-L208 HydrophobicContact CD2-CG 4.18Å; V55-L208 HydrophobicContact CG1-CD2 3.64Å; A59-L208 HydrophobicContact CB-CB 3.84Å; A59-L208 HydrophobicContact CB-CD2 3.62Å; A59-L208 HydrophobicContact CB-CG 3.93Å; F64-L208 HydrophobicContact CE2-CB 4.36Å
209	A	56.3	Low	49.5	Very low	30 Å²	30	74.3 Å²	74.3	25%	0.248	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	139.2	178.4	0	0	0	0	0	110.4	V28 L30	V28-A209 PolarHBondContact N-O 3.28Å; V28-A209 PolarHBondContact O-N 3Å; V28-A209 VanDerWaalsContact O-O 3.12Å; L30-A209 HydrophobicContact CD1-CB 3.75Å
210	A	54.7	Low	48.5	Very low	81 Å²	81	73.5 Å²	73.5	67%	0.669	45%	0.452	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.5	135.5	169.9	0	0	0	0	0	109.7	D27 G212	D27-A210 WeakPolarHBondContact OD1-CA 3.09Å; A210-G212 VanDerWaalsContact C-N 3.26Å; A210-G212 PolarHBondContact O-N 3.13Å
211	K	48.6	Very low	47.4	Very low	70 Å²	70	71.6 Å²	71.6	30%	0.304	45%	0.446	S	S	.	.			trans	-70.9	85.4	174.7	-164.3	160.8	160.1	-170	0	109.3	E26 V28 E46	E26-K211 HydrophobicContact CB-CB 3.84Å; E26-K211 HydrophobicContact CB-CD 3.82Å; E26-K211 HydrophobicContact CB-CG 4.36Å; E26-K211 WeakPolarHBondContact O-CB 3.39Å; E26-K211 PolarHBondContact O-N 2.65Å; E26-K211 WeakPolarHBondContact OE2-CD 3.5Å; E26-K211 WeakPolarHBondContact OE2-CE 3.45Å; E26-K211 IonicContact OE2-NZ 3.42Å; E26-K211 PolarHBondContact OE2-NZ 2.78Å; V28-K211 HydrophobicContact CG2-CB 3.74Å; V28-K211 HydrophobicContact CG2-CD 3.79Å; V28-K211 HydrophobicContact CG2-CG 3.79Å; E46-K211 IonicContact OE2-NZ 3.61Å; E46-K211 PolarHBondContact OE2-NZ 3.02Å
212	G	44.1	Very low	46.6	Very low	47 Å²	47	74.9 Å²	74.9	49%	0.485	46%	0.464	S	S	.	.			trans	-68.5	137.2	161.5	0	0	0	0	0	109.5	A210 G214	A210-G212 VanDerWaalsContact C-N 3.26Å; A210-G212 PolarHBondContact O-N 3.13Å; G212-G214 PolarHBondContact O-N 3.13Å
213	D	38.9	Very low	46.1	Very low	182 Å²	182	76.1 Å²	76.1	97%	0.973	46%	0.464	S	S	*	.	S	Bend	trans	-56.7	95.9	175.1	-168.5	30.4	0	0	0	110.3
214	G	33.4	Very low	45.5	Very low	45 Å²	45	74.4 Å²	74.4	46%	0.464	45%	0.454	S	S	.	.	S	Bend	trans	149.8	110.7	177	0	0	0	0	0	115.8	G212 G216	G212-G214 PolarHBondContact O-N 3.13Å; G214-G216 PolarHBondContact O-N 3.16Å
215	D	37.4	Very low	44.9	Very low	140 Å²	140	75.7 Å²	75.7	75%	0.749	46%	0.464	S	S	*	.	S	Bend	trans	-28.8	110.2	166.8	-69.4	-35.1	0	0	0	115.2	K217	D215-K217 PolarHBondContact O-N 2.88Å
216	G	35.8	Very low	44.5	Very low	67 Å²	67	79.5 Å²	79.5	69%	0.691	47%	0.474	S	S	*	.	S	Bend	trans	59.4	-18	146.7	0	0	0	0	0	119.9	G214 A218	G214-G216 PolarHBondContact O-N 3.16Å; G216-A218 VanDerWaalsContact C-N 3.26Å
217	K	32.6	Very low	44.5	Very low	167 Å²	167	81.7 Å²	81.7	73%	0.726	49%	0.489	S	S	*	.			trans	-88.1	-0.5	175.7	-67.9	178.5	179.3	171.4	0	111.1	D215 L219 D220 S221	D215-K217 PolarHBondContact O-N 2.88Å; K217-L219 PolarHBondContact O-N 3.45Å; K217-D220 PolarHBondContact O-N 3.32Å; K217-S221 VanDerWaalsContact O-CB 3.3Å; K217-S221 WeakPolarHBondContact O-CB 3.25Å; K217-S221 PolarHBondContact O-N 3.46Å
218	A	38.3	Very low	44.6	Very low	38 Å²	38	85.8 Å²	85.8	31%	0.314	50%	0.498	S	S	.	.	H	α-helix	trans	-60.9	-41.5	-177.2	0	0	0	0	0	112.2	G216 D220 S221 L222	G216-A218 VanDerWaalsContact C-N 3.26Å; A218-D220 PolarHBondContact O-N 2.99Å; A218-S221 VanDerWaalsContact CA-OG 3.25Å; A218-S221 WeakPolarHBondContact CA-OG 3.06Å; A218-S221 CarbonylContact O-C 3.5Å; A218-S221 WeakPolarHBondContact O-CA 3.39Å; A218-S221 PolarHBondContact O-N 3.29Å; A218-S221 PolarHBondContact O-OG 3.22Å; A218-L222 WeakPolarHBondContact O-CB 3.43Å; A218-L222 WeakPolarHBondContact O-CG 3.37Å; A218-L222 PolarHBondContact O-N 3.26Å
219	L	38.9	Very low	44.9	Very low	126 Å²	126	89.4 Å²	89.4	66%	0.66	52%	0.52	S	S	*	.	H	α-helix	trans	-61.6	-47.7	179.1	-173.9	66.9	0	0	0	111.9	K217 S221 L222 L223	K217-L219 PolarHBondContact O-N 3.45Å; L219-S221 PolarHBondContact O-N 3.04Å; L219-L222 PolarHBondContact O-N 3.4Å; L219-L223 PolarHBondContact O-N 3.1Å
220	D	36.8	Very low	45.8	Very low	114 Å²	114	90.9 Å²	90.9	61%	0.61	53%	0.529	S	S	*	.	H	α-helix	trans	-63.4	-33.4	173.8	-79.2	-15.9	0	0	0	111.5	K217 A218 N224	K217-D220 PolarHBondContact O-N 3.32Å; A218-D220 PolarHBondContact O-N 2.99Å; D220-N224 WeakPolarHBondContact O-CB 3.33Å; D220-N224 VanDerWaalsContact O-CG 3.24Å; D220-N224 PolarHBondContact O-N 3.31Å; D220-N224 PolarHBondContact O-ND2 3.01Å; D220-N224 VanDerWaalsContact O-ND2 3.14Å
221	S	37.2	Very low	47.1	Very low	54 Å²	54	91.6 Å²	91.6	38%	0.378	53%	0.525	S	S	.	.	H	α-helix	trans	-77	-29.4	178.7	84.1	0	0	0	0	113.6	K217 A218 L219 N224 S225	K217-S221 VanDerWaalsContact O-CB 3.3Å; K217-S221 WeakPolarHBondContact O-CB 3.25Å; K217-S221 PolarHBondContact O-N 3.46Å; A218-S221 VanDerWaalsContact CA-OG 3.25Å; A218-S221 WeakPolarHBondContact CA-OG 3.06Å; A218-S221 CarbonylContact O-C 3.5Å; A218-S221 WeakPolarHBondContact O-CA 3.39Å; A218-S221 PolarHBondContact O-N 3.29Å; A218-S221 PolarHBondContact O-OG 3.22Å; L219-S221 PolarHBondContact O-N 3.04Å; S221-N224 CarbonylContact O-C 3.57Å; S221-N224 PolarHBondContact O-N 2.86Å; S221-S225 WeakPolarHBondContact O-CA 3.11Å; S221-S225 VanDerWaalsContact O-CB 3.25Å; S221-S225 WeakPolarHBondContact O-CB 3.01Å; S221-S225 PolarHBondContact O-N 3.29Å
222	L	40.9	Very low	48.8	Very low	85 Å²	85	93.2 Å²	93.2	45%	0.445	54%	0.536	S	S	.	.	H	α-helix	trans	-79.4	-44	178.3	-75.2	-179.5	0	0	0	110.3	A218 L219 N224 S225 F226	A218-L222 WeakPolarHBondContact O-CB 3.43Å; A218-L222 WeakPolarHBondContact O-CG 3.37Å; A218-L222 PolarHBondContact O-N 3.26Å; L219-L222 PolarHBondContact O-N 3.4Å; L222-N224 PolarHBondContact O-N 3.21Å; L222-S225 WeakPolarHBondContact CA-OG 3.37Å; L222-S225 PolarHBondContact O-N 3.34Å; L222-S225 PolarHBondContact O-OG 2.92Å; L222-F226 WeakPolarHBondContact O-CD2 3.41Å; L222-F226 PolarHBondContact O-N 3.42Å
223	L	46.5	Very low	50.7	Low	114 Å²	114	98.5 Å²	98.5	60%	0.597	55%	0.546	S	S	*	.	H	α-helix	trans	-58.6	-39.3	167.5	-72.2	175	0	0	0	110.6	L219 S227	L219-L223 PolarHBondContact O-N 3.1Å; L223-S227 WeakPolarHBondContact O-CB 3.25Å; L223-S227 PolarHBondContact O-N 3.49Å; L223-S227 PolarHBondContact O-OG 3.14Å
224	N	44.2	Very low	53.1	Low	68 Å²	68	94.5 Å²	94.5	36%	0.364	53%	0.528	S	S	.	.	H	α-helix	trans	-71.8	-23.9	170.9	-82.2	-32.8	0	0	0	114.2	D220 S221 L222 S227 R228	D220-N224 WeakPolarHBondContact O-CB 3.33Å; D220-N224 VanDerWaalsContact O-CG 3.24Å; D220-N224 PolarHBondContact O-N 3.31Å; D220-N224 PolarHBondContact O-ND2 3.01Å; D220-N224 VanDerWaalsContact O-ND2 3.14Å; S221-N224 CarbonylContact O-C 3.57Å; S221-N224 PolarHBondContact O-N 2.86Å; L222-N224 PolarHBondContact O-N 3.21Å; N224-S227 WeakPolarHBondContact CA-OG 3.43Å; N224-S227 PolarHBondContact O-OG 3.3Å; N224-R228 WeakPolarHBondContact O-CA 3.2Å; N224-R228 WeakPolarHBondContact O-CB 3.33Å; N224-R228 VanDerWaalsContact O-CD 3.29Å; N224-R228 WeakPolarHBondContact O-CD 3.3Å; N224-R228 WeakPolarHBondContact O-CG 3.23Å; N224-R228 PolarHBondContact O-N 2.78Å
225	S	45.8	Very low	55.7	Low	40 Å²	40	94.6 Å²	94.6	28%	0.28	52%	0.521	S	S	.	.	H	α-helix	trans	-77.9	-40.8	178.6	76.6	0	0	0	0	108.9	S221 L222 R228 T229	S221-S225 WeakPolarHBondContact O-CA 3.11Å; S221-S225 VanDerWaalsContact O-CB 3.25Å; S221-S225 WeakPolarHBondContact O-CB 3.01Å; S221-S225 PolarHBondContact O-N 3.29Å; L222-S225 WeakPolarHBondContact CA-OG 3.37Å; L222-S225 PolarHBondContact O-N 3.34Å; L222-S225 PolarHBondContact O-OG 2.92Å; S225-R228 PolarHBondContact O-N 3.22Å; S225-T229 VanDerWaalsContact O-CB 3.24Å; S225-T229 WeakPolarHBondContact O-CB 3.24Å; S225-T229 WeakPolarHBondContact O-CG2 3.19Å; S225-T229 PolarHBondContact O-N 3.48Å; S225-T229 PolarHBondContact O-OG1 2.78Å
226	F	51.4	Low	58.3	Low	131 Å²	131	91.5 Å²	91.5	58%	0.575	51%	0.508	S	S	*	.	H	α-helix	trans	-63.3	-43.1	170.4	-67.6	-61.9	0	0	0	111.3	L222 T229 S230	L222-F226 WeakPolarHBondContact O-CD2 3.41Å; L222-F226 PolarHBondContact O-N 3.42Å; F226-T229 WeakPolarHBondContact CA-OG1 3.27Å; F226-T229 PolarHBondContact O-OG1 3.46Å; F226-S230 WeakPolarHBondContact O-CB 3.39Å; F226-S230 PolarHBondContact O-N 3.22Å; F226-S230 PolarHBondContact O-OG 2.88Å
227	S	57.8	Low	60.9	Low	47 Å²	47	90.9 Å²	90.9	33%	0.329	49%	0.493	S	S	.	.	H	α-helix	trans	-67.9	-42.4	176.4	80.1	0	0	0	0	112.1	L223 N224 S230 V231	L223-S227 WeakPolarHBondContact O-CB 3.25Å; L223-S227 PolarHBondContact O-N 3.49Å; L223-S227 PolarHBondContact O-OG 3.14Å; N224-S227 WeakPolarHBondContact CA-OG 3.43Å; N224-S227 PolarHBondContact O-OG 3.3Å; S227-S230 WeakPolarHBondContact CA-OG 3.31Å; S227-S230 PolarHBondContact O-OG 3.5Å; S227-V231 WeakPolarHBondContact O-CB 3.3Å; S227-V231 WeakPolarHBondContact O-CG2 3.46Å; S227-V231 PolarHBondContact O-N 2.89Å
228	R	60.2	Low	64	Low	149 Å²	149	89.8 Å²	89.8	56%	0.562	49%	0.488	S	S	*	.	H	α-helix	trans	-68.6	-44.7	177.7	-72	167.1	-166.8	167.1	5.2	112	N224 S225 V231 L232	N224-R228 WeakPolarHBondContact O-CA 3.2Å; N224-R228 WeakPolarHBondContact O-CB 3.33Å; N224-R228 VanDerWaalsContact O-CD 3.29Å; N224-R228 WeakPolarHBondContact O-CD 3.3Å; N224-R228 WeakPolarHBondContact O-CG 3.23Å; N224-R228 PolarHBondContact O-N 2.78Å; S225-R228 PolarHBondContact O-N 3.22Å; R228-V231 PolarHBondContact O-N 3.43Å; R228-L232 VanDerWaalsContact O-CB 3.22Å; R228-L232 WeakPolarHBondContact O-CB 3.49Å; R228-L232 WeakPolarHBondContact O-CG 3.3Å; R228-L232 PolarHBondContact O-N 3.44Å
229	T	63.6	Low	66.8	Low	83 Å²	83	92.9 Å²	92.9	51%	0.509	50%	0.498	S	S	.	.	H	α-helix	trans	-65.1	-41.3	178.4	53	0	0	0	0	111.4	S225 F226 L232 F233	S225-T229 VanDerWaalsContact O-CB 3.24Å; S225-T229 WeakPolarHBondContact O-CB 3.24Å; S225-T229 WeakPolarHBondContact O-CG2 3.19Å; S225-T229 PolarHBondContact O-N 3.48Å; S225-T229 PolarHBondContact O-OG1 2.78Å; F226-T229 WeakPolarHBondContact CA-OG1 3.27Å; F226-T229 PolarHBondContact O-OG1 3.46Å; T229-L232 PolarHBondContact O-N 2.91Å; T229-F233 WeakPolarHBondContact O-CB 3.15Å; T229-F233 PolarHBondContact O-N 2.97Å
230	S	75.2	Confident	69.6	Low	61 Å²	61	91.2 Å²	91.2	43%	0.427	49%	0.489	S	S	.	.	H	α-helix	trans	-65.9	-44.6	173.6	59	0	0	0	0	112.1	F226 S227 L232 F233 V234	F226-S230 WeakPolarHBondContact O-CB 3.39Å; F226-S230 PolarHBondContact O-N 3.22Å; F226-S230 PolarHBondContact O-OG 2.88Å; S227-S230 WeakPolarHBondContact CA-OG 3.31Å; S227-S230 PolarHBondContact O-OG 3.5Å; S230-L232 PolarHBondContact O-N 2.95Å; S230-F233 PolarHBondContact O-N 3.21Å; S230-V234 WeakPolarHBondContact O-CB 3.03Å; S230-V234 VanDerWaalsContact O-CG2 3.23Å; S230-V234 WeakPolarHBondContact O-CG2 3.41Å; S230-V234 PolarHBondContact O-N 3.38Å
231	V	81.6	Confident	72.5	Confident	95 Å²	95	90.9 Å²	90.9	58%	0.576	49%	0.487	S	S	*	.	H	α-helix	trans	-61.6	-42.8	175.7	169.7	0	0	0	0	111.3	S227 R228 V234 S235	S227-V231 WeakPolarHBondContact O-CB 3.3Å; S227-V231 WeakPolarHBondContact O-CG2 3.46Å; S227-V231 PolarHBondContact O-N 2.89Å; R228-V231 PolarHBondContact O-N 3.43Å; V231-V234 PolarHBondContact O-N 2.84Å; V231-S235 VanDerWaalsContact O-CB 3.3Å; V231-S235 WeakPolarHBondContact O-CB 3.32Å; V231-S235 PolarHBondContact O-N 2.95Å; V231-S235 PolarHBondContact O-OG 2.66Å
232	L	83.6	Confident	75.4	Confident	105 Å²	105	93.1 Å²	93.1	55%	0.55	49%	0.493	S	S	.	.	H	α-helix	trans	-62.2	-48.1	176.1	-74.4	170.8	0	0	0	110.5	R228 T229 S230 V234 S235 V236	R228-L232 VanDerWaalsContact O-CB 3.22Å; R228-L232 WeakPolarHBondContact O-CB 3.49Å; R228-L232 WeakPolarHBondContact O-CG 3.3Å; R228-L232 PolarHBondContact O-N 3.44Å; T229-L232 PolarHBondContact O-N 2.91Å; S230-L232 PolarHBondContact O-N 2.95Å; L232-V234 PolarHBondContact O-N 2.67Å; L232-S235 WeakPolarHBondContact CA-OG 3.01Å; L232-S235 PolarHBondContact O-N 3Å; L232-S235 PolarHBondContact O-OG 3.25Å; L232-V236 WeakPolarHBondContact O-CB 3.37Å; L232-V236 VanDerWaalsContact O-CG2 3.25Å; L232-V236 WeakPolarHBondContact O-CG2 3.1Å; L232-V236 PolarHBondContact O-N 3.1Å
233	F	84.8	Confident	78.1	Confident	157 Å²	157	93.5 Å²	93.5	69%	0.689	50%	0.498	S	S	*	.	H	α-helix	trans	-59.2	-45.7	177.9	-178.9	-98	0	0	0	112.4	T229 S230 S235 V236 S237	T229-F233 WeakPolarHBondContact O-CB 3.15Å; T229-F233 PolarHBondContact O-N 2.97Å; S230-F233 PolarHBondContact O-N 3.21Å; F233-S235 PolarHBondContact O-N 2.65Å; F233-V236 PolarHBondContact O-N 2.78Å; F233-S237 VanDerWaalsContact O-CB 3.3Å; F233-S237 WeakPolarHBondContact O-CB 3.2Å; F233-S237 PolarHBondContact O-N 2.87Å
234	V	89	Confident	80.5	Confident	98 Å²	98	93 Å²	93	59%	0.594	50%	0.495	S	S	*	.	H	α-helix	trans	-62.6	-43.6	177	173.3	0	0	0	0	110.8	S230 V231 L232 F238	S230-V234 WeakPolarHBondContact O-CB 3.03Å; S230-V234 VanDerWaalsContact O-CG2 3.23Å; S230-V234 WeakPolarHBondContact O-CG2 3.41Å; S230-V234 PolarHBondContact O-N 3.38Å; V231-V234 PolarHBondContact O-N 2.84Å; L232-V234 PolarHBondContact O-N 2.67Å; V234-F238 PolarHBondContact O-N 3.39Å
235	S	88.5	Confident	83.1	Confident	47 Å²	47	93 Å²	93	33%	0.329	50%	0.5	S	S	.	.	H	α-helix	trans	-67.3	-42.8	179.7	71.8	0	0	0	0	113.1	V231 L232 F233 F238 I239	V231-S235 VanDerWaalsContact O-CB 3.3Å; V231-S235 WeakPolarHBondContact O-CB 3.32Å; V231-S235 PolarHBondContact O-N 2.95Å; V231-S235 PolarHBondContact O-OG 2.66Å; L232-S235 WeakPolarHBondContact CA-OG 3.01Å; L232-S235 PolarHBondContact O-N 3Å; L232-S235 PolarHBondContact O-OG 3.25Å; F233-S235 PolarHBondContact O-N 2.65Å; S235-F238 PolarHBondContact O-N 3.2Å; S235-I239 VanDerWaalsContact O-CG1 3.28Å; S235-I239 WeakPolarHBondContact O-CG1 3.17Å; S235-I239 PolarHBondContact O-N 2.9Å
236	V	91.5	Very high	85.6	Confident	76 Å²	76	96.1 Å²	96.1	46%	0.461	51%	0.513	S	S	.	.	H	α-helix	trans	-64.2	-43.2	177.4	170.6	0	0	0	0	110.3	L232 F233 F238 I239 I240	L232-V236 WeakPolarHBondContact O-CB 3.37Å; L232-V236 VanDerWaalsContact O-CG2 3.25Å; L232-V236 WeakPolarHBondContact O-CG2 3.1Å; L232-V236 PolarHBondContact O-N 3.1Å; F233-V236 PolarHBondContact O-N 2.78Å; V236-F238 PolarHBondContact O-N 3.18Å; V236-I239 PolarHBondContact O-N 2.95Å; V236-I240 HydrophobicContact CG1-CD1 3.8Å; V236-I240 VanDerWaalsContact O-CG1 3.28Å; V236-I240 WeakPolarHBondContact O-CG1 3.43Å; V236-I240 PolarHBondContact O-N 3.45Å
237	S	91.1	Very high	87.8	Confident	54 Å²	54	92.7 Å²	92.7	38%	0.378	51%	0.509	S	S	.	.	H	α-helix	trans	-58.5	-45.6	174.5	-176.5	0	0	0	0	112	F233 I239 I240 L241	F233-S237 VanDerWaalsContact O-CB 3.3Å; F233-S237 WeakPolarHBondContact O-CB 3.2Å; F233-S237 PolarHBondContact O-N 2.87Å; S237-I239 PolarHBondContact O-N 3.18Å; S237-I240 PolarHBondContact O-N 3.4Å; S237-L241 WeakPolarHBondContact O-CG 3.28Å; S237-L241 PolarHBondContact O-N 2.87Å; S237-L241 VanDerWaalsContact O-N 3.07Å
238	F	97.8	Very high	89.7	Confident	143 Å²	143	100.1 Å²	100.1	63%	0.627	53%	0.53	S	S	*	.	H	α-helix	trans	-62.4	-42.1	177.7	-171.4	-95.4	0	0	0	112.8	V234 S235 V236 L241 M242	V234-F238 PolarHBondContact O-N 3.39Å; S235-F238 PolarHBondContact O-N 3.2Å; V236-F238 PolarHBondContact O-N 3.18Å; F238-L241 PolarHBondContact O-N 3.49Å; F238-M242 HydrophobicContact CD1-CG 4.47Å; F238-M242 HydrophobicContact CE1-CG 4.04Å; F238-M242 HydrophobicContact CZ-CG 4.45Å; F238-M242 PolarHBondContact O-N 3.05Å
239	I	96.7	Very high	91.5	Very high	103 Å²	103	97 Å²	97	53%	0.528	52%	0.524	S	S	.	.	H	α-helix	trans	-62.9	-44.7	177.3	-67.4	165.4	0	0	0	110.6	S235 V236 S237 L241 M242 V243	S235-I239 VanDerWaalsContact O-CG1 3.28Å; S235-I239 WeakPolarHBondContact O-CG1 3.17Å; S235-I239 PolarHBondContact O-N 2.9Å; V236-I239 PolarHBondContact O-N 2.95Å; S237-I239 PolarHBondContact O-N 3.18Å; I239-L241 PolarHBondContact O-N 3.17Å; I239-M242 PolarHBondContact O-N 2.65Å; I239-V243 HydrophobicContact CG2-CG2 4.47Å; I239-V243 WeakPolarHBondContact O-CG2 3.4Å; I239-V243 PolarHBondContact O-N 3.41Å
240	I	97	Very high	93.2	Very high	91 Å²	91	96.6 Å²	96.6	47%	0.467	52%	0.522	S	S	.	.	H	α-helix	trans	-60.5	-46.3	179	-69.3	166.3	0	0	0	110.7	V236 S237 M242 V243 I244	V236-I240 HydrophobicContact CG1-CD1 3.8Å; V236-I240 VanDerWaalsContact O-CG1 3.28Å; V236-I240 WeakPolarHBondContact O-CG1 3.43Å; V236-I240 PolarHBondContact O-N 3.45Å; S237-I240 PolarHBondContact O-N 3.4Å; I240-M242 VanDerWaalsContact C-N 3.35Å; I240-M242 PolarHBondContact O-N 2.78Å; I240-V243 PolarHBondContact O-N 2.96Å; I240-I244 HydrophobicContact CG2-CD1 3.79Å; I240-I244 VanDerWaalsContact O-CG1 3.31Å; I240-I244 WeakPolarHBondContact O-CG1 3.14Å; I240-I244 PolarHBondContact O-N 3.29Å
241	L	97.6	Very high	94.2	Very high	107 Å²	107	99.1 Å²	99.1	56%	0.56	53%	0.525	S	S	*	.	H	α-helix	trans	-63.6	-39	178.4	-67.9	175.1	0	0	0	112.5	S237 F238 I239 I244 S245	S237-L241 WeakPolarHBondContact O-CG 3.28Å; S237-L241 PolarHBondContact O-N 2.87Å; S237-L241 VanDerWaalsContact O-N 3.07Å; F238-L241 PolarHBondContact O-N 3.49Å; I239-L241 PolarHBondContact O-N 3.17Å; L241-I244 PolarHBondContact O-N 3.07Å; L241-S245 WeakPolarHBondContact O-CB 3.41Å; L241-S245 PolarHBondContact O-N 3.38Å
242	M	97.8	Very high	95	Very high	102 Å²	102	100.3 Å²	100.3	50%	0.502	52%	0.52	S	S	.	.	H	α-helix	trans	-61.3	-45.2	174.2	-98.1	-89.1	76.7	0	0	112.2	F238 I239 I240 S245 L246	F238-M242 HydrophobicContact CD1-CG 4.47Å; F238-M242 HydrophobicContact CE1-CG 4.04Å; F238-M242 HydrophobicContact CZ-CG 4.45Å; F238-M242 PolarHBondContact O-N 3.05Å; I239-M242 PolarHBondContact O-N 2.65Å; I240-M242 VanDerWaalsContact C-N 3.35Å; I240-M242 PolarHBondContact O-N 2.78Å; M242-S245 PolarHBondContact O-N 3.05Å; M242-L246 WeakPolarHBondContact O-CB 3.32Å; M242-L246 PolarHBondContact O-N 2.97Å
243	V	98.4	Very high	95.7	Very high	92 Å²	92	102 Å²	102	56%	0.558	52%	0.52	S	S	*	.	H	α-helix	trans	-63.9	-43.5	178.8	172.5	0	0	0	0	111.1	I239 I240 L246 A247	I239-V243 HydrophobicContact CG2-CG2 4.47Å; I239-V243 WeakPolarHBondContact O-CG2 3.4Å; I239-V243 PolarHBondContact O-N 3.41Å; I240-V243 PolarHBondContact O-N 2.96Å; V243-L246 PolarHBondContact O-N 2.66Å; V243-A247 WeakPolarHBondContact O-CB 3.24Å; V243-A247 PolarHBondContact O-N 3.02Å
244	I	98.1	Very high	96.3	Very high	105 Å²	105	98 Å²	98	54%	0.538	51%	0.508	S	S	.	.	H	α-helix	trans	-61.7	-46.2	177	-67.4	167	0	0	0	110.7	I240 L241 L246 A247 W248	I240-I244 HydrophobicContact CG2-CD1 3.79Å; I240-I244 VanDerWaalsContact O-CG1 3.31Å; I240-I244 WeakPolarHBondContact O-CG1 3.14Å; I240-I244 PolarHBondContact O-N 3.29Å; L241-I244 PolarHBondContact O-N 3.07Å; I244-L246 PolarHBondContact O-N 2.84Å; I244-A247 PolarHBondContact O-N 2.81Å; I244-W248 WeakPolarHBondContact O-CB 3.38Å; I244-W248 PolarHBondContact O-N 2.83Å
245	S	97.8	Very high	96.5	Very high	67 Å²	67	98.1 Å²	98.1	47%	0.469	50%	0.502	S	S	.	.	H	α-helix	trans	-60.6	-44.7	177.9	-178.2	0	0	0	0	112.1	L241 M242 W248 L249	L241-S245 WeakPolarHBondContact O-CB 3.41Å; L241-S245 PolarHBondContact O-N 3.38Å; M242-S245 PolarHBondContact O-N 3.05Å; S245-W248 PolarHBondContact O-N 3.03Å; S245-L249 WeakPolarHBondContact O-CB 3.17Å; S245-L249 PolarHBondContact O-N 3.41Å
246	L	98.3	Very high	96.8	Very high	106 Å²	106	103.1 Å²	103.1	56%	0.555	51%	0.514	S	S	*	.	H	α-helix	trans	-66.4	-42.6	178.6	-175.8	62.9	0	0	0	112.1	M242 V243 I244 W248 L249 V250	M242-L246 WeakPolarHBondContact O-CB 3.32Å; M242-L246 PolarHBondContact O-N 2.97Å; V243-L246 PolarHBondContact O-N 2.66Å; I244-L246 PolarHBondContact O-N 2.84Å; L246-W248 VanDerWaalsContact C-N 3.3Å; L246-W248 PolarHBondContact O-N 3.34Å; L246-L249 HydrophobicContact CD1-CD2 4.47Å; L246-L249 PolarHBondContact O-N 2.9Å; L246-V250 HydrophobicContact CD1-CG2 4.41Å; L246-V250 HydrophobicContact CG-CG2 4.48Å; L246-V250 VanDerWaalsContact O-CG2 3.31Å; L246-V250 WeakPolarHBondContact O-CG2 3.41Å; L246-V250 PolarHBondContact O-N 2.83Å
247	A	98	Very high	96.9	Very high	59 Å²	59	105.7 Å²	105.7	49%	0.488	52%	0.519	S	S	.	.	H	α-helix	trans	-60.3	-42.3	176.2	0	0	0	0	0	111.4	V243 I244 V250 F251	V243-A247 WeakPolarHBondContact O-CB 3.24Å; V243-A247 PolarHBondContact O-N 3.02Å; I244-A247 PolarHBondContact O-N 2.81Å; A247-V250 PolarHBondContact O-N 3.11Å; A247-F251 VanDerWaalsContact O-CB 3.29Å; A247-F251 WeakPolarHBondContact O-CB 3.29Å; A247-F251 PolarHBondContact O-N 3.32Å
248	W	98.1	Very high	97	Very high	202 Å²	202	107.5 Å²	107.5	77%	0.765	52%	0.518	S	S	*	.	H	α-helix	trans	-66.2	-40.1	177.4	-150.2	65	0	0	0	112.1	I244 S245 L246 F251 Y252	I244-W248 WeakPolarHBondContact O-CB 3.38Å; I244-W248 PolarHBondContact O-N 2.83Å; S245-W248 PolarHBondContact O-N 3.03Å; L246-W248 VanDerWaalsContact C-N 3.3Å; L246-W248 PolarHBondContact O-N 3.34Å; W248-F251 PolarHBondContact O-N 2.7Å; W248-Y252 WeakPolarHBondContact O-CB 3.43Å; W248-Y252 PolarHBondContact O-N 3.05Å
249	L	98.3	Very high	96.7	Very high	83 Å²	83	107.4 Å²	107.4	44%	0.435	51%	0.514	S	S	.	.	H	α-helix	trans	-64.5	-47.6	175.2	-177.7	140.5	0	0	0	111.7	S245 L246 F251 Y252 Y253	S245-L249 WeakPolarHBondContact O-CB 3.17Å; S245-L249 PolarHBondContact O-N 3.41Å; L246-L249 HydrophobicContact CD1-CD2 4.47Å; L246-L249 PolarHBondContact O-N 2.9Å; L249-F251 VanDerWaalsContact C-N 3.31Å; L249-F251 PolarHBondContact O-N 2.82Å; L249-Y252 WeakPolarHBondContact O-CB 3.36Å; L249-Y252 PolarHBondContact O-N 2.86Å; L249-Y253 HydrophobicContact CD1-CE2 4.13Å; L249-Y253 HydrophobicContact CD2-CD2 3.52Å; L249-Y253 HydrophobicContact CD2-CE2 3.53Å; L249-Y253 HydrophobicContact CG-CD2 3.75Å; L249-Y253 HydrophobicContact CG-CE2 3.62Å; L249-Y253 WeakPolarHBondContact O-CD2 3.45Å; L249-Y253 PolarHBondContact O-N 2.99Å
250	V	97.8	Very high	96.4	Very high	76 Å²	76	104.6 Å²	104.6	46%	0.461	51%	0.506	S	S	.	.	H	α-helix	trans	-58.8	-46.1	175.5	170.1	0	0	0	0	110.3	L246 A247 Y252 Y253 V254	L246-V250 HydrophobicContact CD1-CG2 4.41Å; L246-V250 HydrophobicContact CG-CG2 4.48Å; L246-V250 VanDerWaalsContact O-CG2 3.31Å; L246-V250 WeakPolarHBondContact O-CG2 3.41Å; L246-V250 PolarHBondContact O-N 2.83Å; A247-V250 PolarHBondContact O-N 3.11Å; V250-Y252 PolarHBondContact O-N 3.14Å; V250-Y253 PolarHBondContact O-N 3.47Å; V250-V254 HydrophobicContact CG1-CG2 4.28Å; V250-V254 WeakPolarHBondContact O-CB 3.29Å; V250-V254 VanDerWaalsContact O-CG2 3.27Å; V250-V254 WeakPolarHBondContact O-CG2 3.46Å; V250-V254 PolarHBondContact O-N 3.44Å
251	F	97.6	Very high	96	Very high	113 Å²	113	104.1 Å²	104.1	50%	0.496	50%	0.502	S	S	.	.	H	α-helix	trans	-59.6	-46.5	176.4	-179.1	-105.5	0	0	0	112	A247 W248 L249 Y253 V254 Q255	A247-F251 VanDerWaalsContact O-CB 3.29Å; A247-F251 WeakPolarHBondContact O-CB 3.29Å; A247-F251 PolarHBondContact O-N 3.32Å; W248-F251 PolarHBondContact O-N 2.7Å; L249-F251 VanDerWaalsContact C-N 3.31Å; L249-F251 PolarHBondContact O-N 2.82Å; F251-Y253 PolarHBondContact O-N 3.39Å; F251-V254 PolarHBondContact O-N 3.37Å; F251-Q255 HydrophobicContact CD1-CG 4.27Å; F251-Q255 HydrophobicContact CD2-CG 4.48Å; F251-Q255 HydrophobicContact CE1-CG 4.05Å; F251-Q255 HydrophobicContact CE2-CG 4.24Å; F251-Q255 VanDerWaalsContact CZ-CD 3.46Å; F251-Q255 HydrophobicContact CZ-CG 4.05Å; F251-Q255 WeakPolarHBondContact O-CB 3.12Å; F251-Q255 VanDerWaalsContact O-CG 3.31Å; F251-Q255 WeakPolarHBondContact O-CG 3.19Å; F251-Q255 PolarHBondContact O-N 3.14Å
252	Y	97.6	Very high	95.6	Very high	121 Å²	121	101 Å²	101	48%	0.475	49%	0.492	S	S	.	.	H	α-helix	trans	-57.7	-46.1	175.2	170.3	-100.2	0	0	0	112	W248 L249 V250 Q255 R256	W248-Y252 WeakPolarHBondContact O-CB 3.43Å; W248-Y252 PolarHBondContact O-N 3.05Å; L249-Y252 WeakPolarHBondContact O-CB 3.36Å; L249-Y252 PolarHBondContact O-N 2.86Å; V250-Y252 PolarHBondContact O-N 3.14Å; Y252-Q255 PolarHBondContact O-N 3.25Å; Y252-R256 VanDerWaalsContact O-CB 3.26Å; Y252-R256 WeakPolarHBondContact O-CB 3.3Å; Y252-R256 PolarHBondContact O-N 3.33Å
253	Y	98.3	Very high	95.2	Very high	141 Å²	141	102.5 Å²	102.5	55%	0.553	50%	0.495	S	S	*	.	H	α-helix	trans	-65.3	-43.6	177.6	-85.4	-73.2	0	0	0	112.1	L249 V250 F251 R256 F257	L249-Y253 HydrophobicContact CD1-CE2 4.13Å; L249-Y253 HydrophobicContact CD2-CD2 3.52Å; L249-Y253 HydrophobicContact CD2-CE2 3.53Å; L249-Y253 HydrophobicContact CG-CD2 3.75Å; L249-Y253 HydrophobicContact CG-CE2 3.62Å; L249-Y253 WeakPolarHBondContact O-CD2 3.45Å; L249-Y253 PolarHBondContact O-N 2.99Å; V250-Y253 PolarHBondContact O-N 3.47Å; F251-Y253 PolarHBondContact O-N 3.39Å; Y253-R256 PolarHBondContact O-N 2.87Å; Y253-F257 WeakPolarHBondContact O-CB 3.26Å; Y253-F257 PolarHBondContact O-N 2.84Å
254	V	96.5	Very high	94.6	Very high	71 Å²	71	102.3 Å²	102.3	43%	0.43	49%	0.491	S	S	.	.	H	α-helix	trans	-60.9	-46.4	175.9	170	0	0	0	0	110.4	V250 F251 F257 R258	V250-V254 HydrophobicContact CG1-CG2 4.28Å; V250-V254 WeakPolarHBondContact O-CB 3.29Å; V250-V254 VanDerWaalsContact O-CG2 3.27Å; V250-V254 WeakPolarHBondContact O-CG2 3.46Å; V250-V254 PolarHBondContact O-N 3.44Å; F251-V254 PolarHBondContact O-N 3.37Å; V254-F257 PolarHBondContact O-N 3.04Å; V254-R258 HydrophobicContact CG1-CG 4.39Å; V254-R258 WeakPolarHBondContact O-CB 3.04Å; V254-R258 VanDerWaalsContact O-CG 3.22Å; V254-R258 WeakPolarHBondContact O-CG 3.42Å; V254-R258 PolarHBondContact O-N 2.91Å
255	Q	93.9	Very high	94.2	Very high	101 Å²	101	102.7 Å²	102.7	47%	0.472	49%	0.486	S	S	.	.	H	α-helix	trans	-61.3	-47	176.4	-75.5	-170.4	-29.7	0	0	111.9	F251 Y252 F257 R258 Y259	F251-Q255 HydrophobicContact CD1-CG 4.27Å; F251-Q255 HydrophobicContact CD2-CG 4.48Å; F251-Q255 HydrophobicContact CE1-CG 4.05Å; F251-Q255 HydrophobicContact CE2-CG 4.24Å; F251-Q255 VanDerWaalsContact CZ-CD 3.46Å; F251-Q255 HydrophobicContact CZ-CG 4.05Å; F251-Q255 WeakPolarHBondContact O-CB 3.12Å; F251-Q255 VanDerWaalsContact O-CG 3.31Å; F251-Q255 WeakPolarHBondContact O-CG 3.19Å; F251-Q255 PolarHBondContact O-N 3.14Å; Y252-Q255 PolarHBondContact O-N 3.25Å; Q255-F257 PolarHBondContact O-N 3.5Å; Q255-R258 PolarHBondContact O-N 3.4Å; Q255-Y259 VanDerWaalsContact O-CB 3.29Å; Q255-Y259 WeakPolarHBondContact O-CB 3.1Å; Q255-Y259 PolarHBondContact O-N 3.01Å
256	R	94.2	Very high	93.6	Very high	152 Å²	152	102.8 Å²	102.8	57%	0.574	48%	0.481	S	S	*	.	H	α-helix	trans	-64.7	-40.2	179.8	-176.8	161.2	-179.6	82.9	0.3	112	Y252 Y253 Y259 A260	Y252-R256 VanDerWaalsContact O-CB 3.26Å; Y252-R256 WeakPolarHBondContact O-CB 3.3Å; Y252-R256 PolarHBondContact O-N 3.33Å; Y253-R256 PolarHBondContact O-N 2.87Å; R256-Y259 PolarHBondContact O-N 3.31Å; R256-A260 WeakPolarHBondContact O-CB 3.32Å; R256-A260 PolarHBondContact O-N 2.73Å
257	F	95.1	Very high	93	Very high	130 Å²	130	100.3 Å²	100.3	57%	0.57	48%	0.476	S	S	*	.	H	α-helix	trans	-64.2	-49.2	175.7	-177.7	-100.5	0	0	0	111.3	Y253 V254 Q255 Y259 A260 H261	Y253-F257 WeakPolarHBondContact O-CB 3.26Å; Y253-F257 PolarHBondContact O-N 2.84Å; V254-F257 PolarHBondContact O-N 3.04Å; Q255-F257 PolarHBondContact O-N 3.5Å; F257-Y259 VanDerWaalsContact C-N 3.31Å; F257-Y259 PolarHBondContact O-N 2.62Å; F257-A260 PolarHBondContact O-N 2.8Å; F257-H261 AromaticContact CD1-CD2 3.61Å; F257-H261 AromaticContact CD2-CD2 3.9Å; F257-H261 AromaticContact CD2-NE2 3.87Å; F257-H261 AromaticContact CE1-CD2 3.31Å; F257-H261 WeakPolarHBondContact CE1-CD2 3.35Å; F257-H261 AromaticContact CE1-NE2 3.4Å; F257-H261 WeakPolarHBondContact CE1-NE2 3.38Å; F257-H261 AromaticContact CE2-CD2 3.63Å; F257-H261 AromaticContact CE2-NE2 3.15Å; F257-H261 WeakPolarHBondContact CE2-NE2 3.15Å; F257-H261 AromaticContact CG-CD2 3.91Å; F257-H261 AromaticContact CZ-CD2 3.34Å; F257-H261 WeakPolarHBondContact CZ-CD2 3.36Å; F257-H261 AromaticContact CZ-NE2 2.88Å; F257-H261 WeakPolarHBondContact CZ-NE2 2.95Å; F257-H261 PolarHBondContact O-CD2 3.33Å; F257-H261 VanDerWaalsContact O-CD2 3.32Å; F257-H261 PolarHBondContact O-N 3.2Å
258	R	92.9	Very high	92.6	Very high	92 Å²	92	103.5 Å²	103.5	35%	0.347	48%	0.48	S	S	.	.	H	α-helix	trans	-59.4	-42.2	175.4	-72.4	-179.5	76	176.5	13.2	111.9	V254 Q255 H261 A262 D359	V254-R258 HydrophobicContact CG1-CG 4.39Å; V254-R258 WeakPolarHBondContact O-CB 3.04Å; V254-R258 VanDerWaalsContact O-CG 3.22Å; V254-R258 WeakPolarHBondContact O-CG 3.42Å; V254-R258 PolarHBondContact O-N 2.91Å; Q255-R258 PolarHBondContact O-N 3.4Å; R258-H261 PolarHBondContact O-N 3.15Å; R258-A262 VanDerWaalsContact O-CB 3.31Å; R258-A262 WeakPolarHBondContact O-CB 3.31Å; R258-A262 PolarHBondContact O-N 3.23Å; R258-D359 IonicContact CZ-OD1 3.48Å; R258-D359 IonicContact NE-OD1 2.65Å; R258-D359 IonicContact NH2-OD1 3.7Å; R258-D359 PolarHBondContact NH2-OD1 3.48Å
259	Y	91.6	Very high	92.1	Very high	142 Å²	142	99.9 Å²	99.9	56%	0.557	47%	0.466	S	S	*	.	H	α-helix	trans	-62.7	-44.5	176.3	179.7	-99	0	0	0	112.1	Q255 R256 F257 A262 K263	Q255-Y259 VanDerWaalsContact O-CB 3.29Å; Q255-Y259 WeakPolarHBondContact O-CB 3.1Å; Q255-Y259 PolarHBondContact O-N 3.01Å; R256-Y259 PolarHBondContact O-N 3.31Å; F257-Y259 VanDerWaalsContact C-N 3.31Å; F257-Y259 PolarHBondContact O-N 2.62Å; Y259-A262 PolarHBondContact O-N 2.93Å; Y259-K263 WeakPolarHBondContact O-CB 3.11Å; Y259-K263 PolarHBondContact O-N 2.87Å
260	A	89.2	Confident	91.5	Very high	43 Å²	43	97.8 Å²	97.8	36%	0.355	46%	0.455	S	S	.	.	H	α-helix	trans	-60.2	-49.2	176.2	0	0	0	0	0	111.5	R256 F257 A262 K263 D264	R256-A260 WeakPolarHBondContact O-CB 3.32Å; R256-A260 PolarHBondContact O-N 2.73Å; F257-A260 PolarHBondContact O-N 2.8Å; A260-A262 PolarHBondContact O-N 2.77Å; A260-K263 WeakPolarHBondContact O-CB 3.47Å; A260-K263 PolarHBondContact O-N 2.7Å; A260-D264 PolarHBondContact O-N 3.2Å
261	H	89.7	Confident	91.1	Very high	81 Å²	81	98.1 Å²	98.1	38%	0.375	45%	0.451	S	S	.	.	H	α-helix	trans	-61.5	-41.5	176.7	-84	-68.6	0	0	0	113.2	F257 R258 K263 D264 R265	F257-H261 AromaticContact CD1-CD2 3.61Å; F257-H261 AromaticContact CD2-CD2 3.9Å; F257-H261 AromaticContact CD2-NE2 3.87Å; F257-H261 AromaticContact CE1-CD2 3.31Å; F257-H261 WeakPolarHBondContact CE1-CD2 3.35Å; F257-H261 AromaticContact CE1-NE2 3.4Å; F257-H261 WeakPolarHBondContact CE1-NE2 3.38Å; F257-H261 AromaticContact CE2-CD2 3.63Å; F257-H261 AromaticContact CE2-NE2 3.15Å; F257-H261 WeakPolarHBondContact CE2-NE2 3.15Å; F257-H261 AromaticContact CG-CD2 3.91Å; F257-H261 AromaticContact CZ-CD2 3.34Å; F257-H261 WeakPolarHBondContact CZ-CD2 3.36Å; F257-H261 AromaticContact CZ-NE2 2.88Å; F257-H261 WeakPolarHBondContact CZ-NE2 2.95Å; F257-H261 PolarHBondContact O-CD2 3.33Å; F257-H261 VanDerWaalsContact O-CD2 3.32Å; F257-H261 PolarHBondContact O-N 3.2Å; R258-H261 PolarHBondContact O-N 3.15Å; H261-K263 VanDerWaalsContact C-N 3.31Å; H261-K263 PolarHBondContact O-N 2.81Å; H261-D264 PolarHBondContact O-N 2.93Å; H261-R265 WeakPolarHBondContact O-CG 3.5Å; H261-R265 PolarHBondContact O-N 2.62Å
262	A	89.2	Confident	90.7	Very high	43 Å²	43	95.7 Å²	95.7	36%	0.355	44%	0.443	S	S	.	.	H	α-helix	trans	-62.1	-41	176.3	0	0	0	0	0	111.4	R258 Y259 A260 R265 L266	R258-A262 VanDerWaalsContact O-CB 3.31Å; R258-A262 WeakPolarHBondContact O-CB 3.31Å; R258-A262 PolarHBondContact O-N 3.23Å; Y259-A262 PolarHBondContact O-N 2.93Å; A260-A262 PolarHBondContact O-N 2.77Å; A262-R265 PolarHBondContact O-N 3.48Å; A262-L266 WeakPolarHBondContact O-CB 3.43Å; A262-L266 PolarHBondContact O-N 3.35Å
263	K	87.7	Confident	90.1	Very high	132 Å²	132	90.2 Å²	90.2	57%	0.574	42%	0.423	S	S	*	.	H	α-helix	trans	-62.4	-43.8	175.9	-174.9	-179.3	176.6	-177.3	0	111.7	Y259 A260 H261 L266 A267	Y259-K263 WeakPolarHBondContact O-CB 3.11Å; Y259-K263 PolarHBondContact O-N 2.87Å; A260-K263 WeakPolarHBondContact O-CB 3.47Å; A260-K263 PolarHBondContact O-N 2.7Å; H261-K263 VanDerWaalsContact C-N 3.31Å; H261-K263 PolarHBondContact O-N 2.81Å; K263-L266 PolarHBondContact O-N 2.96Å; K263-A267 WeakPolarHBondContact O-CB 3.31Å; K263-A267 PolarHBondContact O-N 3.46Å
264	D	86.8	Confident	89.5	Confident	88 Å²	88	83.5 Å²	83.5	47%	0.471	40%	0.396	S	S	.	.	H	α-helix	trans	-66.1	-42.9	179.5	-69.2	-16.9	0	0	0	112.1	A260 H261 L266 A267 H268	A260-D264 PolarHBondContact O-N 3.2Å; H261-D264 PolarHBondContact O-N 2.93Å; D264-L266 VanDerWaalsContact C-N 3.33Å; D264-L266 PolarHBondContact O-N 3.47Å; D264-A267 PolarHBondContact O-N 3.02Å; D264-H268 PolarHBondContact O-CD2 2.68Å; D264-H268 VanDerWaalsContact O-CD2 3.29Å; D264-H268 PolarHBondContact O-N 3.34Å
265	R	89.5	Confident	89.1	Confident	113 Å²	113	86.8 Å²	86.8	43%	0.426	40%	0.401	S	S	.	.	H	α-helix	trans	-59.9	-44.5	174.9	-70.2	-166.9	-56.5	-111.9	12.8	111.5	H261 A262 R269 D359	H261-R265 WeakPolarHBondContact O-CG 3.5Å; H261-R265 PolarHBondContact O-N 2.62Å; A262-R265 PolarHBondContact O-N 3.48Å; R265-R269 WeakPolarHBondContact O-CB 3.38Å; R265-R269 VanDerWaalsContact O-CG 3.25Å; R265-R269 WeakPolarHBondContact O-CG 3.41Å; R265-R269 PolarHBondContact O-N 2.65Å; R265-D359 IonicContact CZ-OD2 3.04Å; R265-D359 IonicContact NH1-OD2 3.22Å; R265-D359 IonicContact NH2-OD2 2.91Å; R265-D359 PolarHBondContact NH2-OD2 2.91Å
266	L	86	Confident	88.8	Confident	69 Å²	69	89 Å²	89	36%	0.361	41%	0.409	S	S	.	.	H	α-helix	trans	-64.7	-44.4	177.1	-179.8	59.9	0	0	0	111.2	A262 K263 D264 H268 R269 L270 F349	A262-L266 WeakPolarHBondContact O-CB 3.43Å; A262-L266 PolarHBondContact O-N 3.35Å; K263-L266 PolarHBondContact O-N 2.96Å; D264-L266 VanDerWaalsContact C-N 3.33Å; D264-L266 PolarHBondContact O-N 3.47Å; L266-H268 PolarHBondContact O-N 2.85Å; L266-R269 PolarHBondContact O-N 3.24Å; L266-L270 HydrophobicContact CD1-CD1 4.01Å; L266-L270 HydrophobicContact CD1-CG 4.08Å; L266-L270 HydrophobicContact CG-CD1 3.89Å; L266-L270 HydrophobicContact CG-CG 4.4Å; L266-L270 WeakPolarHBondContact O-CB 3.45Å; L266-L270 VanDerWaalsContact O-CG 3.26Å; L266-L270 WeakPolarHBondContact O-CG 2.91Å; L266-L270 PolarHBondContact O-N 2.99Å; L266-F349 HydrophobicContact CD1-CZ 4.46Å
267	A	85.3	Confident	88.3	Confident	55 Å²	55	82.1 Å²	82.1	46%	0.455	38%	0.384	S	S	.	.	H	α-helix	trans	-58.5	-47.8	177.3	0	0	0	0	0	111.7	K263 D264 R269 L270 F271	K263-A267 WeakPolarHBondContact O-CB 3.31Å; K263-A267 PolarHBondContact O-N 3.46Å; D264-A267 PolarHBondContact O-N 3.02Å; A267-R269 PolarHBondContact O-N 3.33Å; A267-L270 PolarHBondContact O-N 2.92Å; A267-F271 WeakPolarHBondContact O-CB 3.14Å; A267-F271 PolarHBondContact O-N 2.98Å
268	H	88.6	Confident	87.8	Confident	125 Å²	125	76.3 Å²	76.3	58%	0.579	36%	0.359	S	S	*	.	H	α-helix	trans	-63.1	-40.1	176	-81.4	-60.8	0	0	0	113.1	D264 L266 F271 N272	D264-H268 PolarHBondContact O-CD2 2.68Å; D264-H268 VanDerWaalsContact O-CD2 3.29Å; D264-H268 PolarHBondContact O-N 3.34Å; L266-H268 PolarHBondContact O-N 2.85Å; H268-F271 PolarHBondContact O-N 3.42Å; H268-N272 WeakPolarHBondContact O-CB 3.25Å; H268-N272 PolarHBondContact O-N 2.84Å; H268-N272 PolarHBondContact O-ND2 3.18Å
269	R	88.2	Confident	87.4	Confident	126 Å²	126	76.4 Å²	76.4	48%	0.475	37%	0.374	S	S	.	.	H	α-helix	trans	-62.1	-45.3	176.1	-76	175.2	-179.9	-167.8	1.1	111.1	R265 L266 A267 N272 A273	R265-R269 WeakPolarHBondContact O-CB 3.38Å; R265-R269 VanDerWaalsContact O-CG 3.25Å; R265-R269 WeakPolarHBondContact O-CG 3.41Å; R265-R269 PolarHBondContact O-N 2.65Å; L266-R269 PolarHBondContact O-N 3.24Å; A267-R269 PolarHBondContact O-N 3.33Å; R269-N272 PolarHBondContact O-N 3.4Å; R269-A273 WeakPolarHBondContact O-CB 3.44Å; R269-A273 PolarHBondContact O-N 3.48Å
270	L	85.7	Confident	87	Confident	39 Å²	39	77.3 Å²	77.3	20%	0.204	38%	0.381	C	S	.	.	H	α-helix	trans	-66.2	-42.5	178.2	-69.1	171.6	0	0	0	112	L266 A267 N272 A273 A274 L342	L266-L270 HydrophobicContact CD1-CD1 4.01Å; L266-L270 HydrophobicContact CD1-CG 4.08Å; L266-L270 HydrophobicContact CG-CD1 3.89Å; L266-L270 HydrophobicContact CG-CG 4.4Å; L266-L270 WeakPolarHBondContact O-CB 3.45Å; L266-L270 VanDerWaalsContact O-CG 3.26Å; L266-L270 WeakPolarHBondContact O-CG 2.91Å; L266-L270 PolarHBondContact O-N 2.99Å; A267-L270 PolarHBondContact O-N 2.92Å; L270-N272 PolarHBondContact O-N 2.97Å; L270-A273 PolarHBondContact O-N 3.02Å; L270-A274 VanDerWaalsContact O-CB 3.32Å; L270-A274 WeakPolarHBondContact O-CB 3.03Å; L270-A274 PolarHBondContact O-N 2.85Å; L270-L342 HydrophobicContact CD2-CD1 4.37Å
271	F	89.4	Confident	86.8	Confident	84 Å²	84	75.6 Å²	75.6	37%	0.368	37%	0.366	S	S	.	.	H	α-helix	trans	-59.1	-46	174.2	-178.8	-89.6	0	0	0	111.4	A267 H268 A274 R275 L329	A267-F271 WeakPolarHBondContact O-CB 3.14Å; A267-F271 PolarHBondContact O-N 2.98Å; H268-F271 PolarHBondContact O-N 3.42Å; F271-A274 WeakPolarHBondContact O-CB 3.29Å; F271-A274 PolarHBondContact O-N 3.27Å; F271-R275 WeakPolarHBondContact O-CB 3.42Å; F271-R275 PolarHBondContact O-N 3.2Å; F271-L329 HydrophobicContact CD2-CB 4.12Å; F271-L329 HydrophobicContact CD2-CD2 4.5Å; F271-L329 HydrophobicContact CE2-CB 3.71Å; F271-L329 HydrophobicContact CE2-CD1 4.17Å; F271-L329 HydrophobicContact CE2-CD2 4.14Å; F271-L329 HydrophobicContact CE2-CG 4.22Å; F271-L329 HydrophobicContact CZ-CB 4.44Å; F271-L329 HydrophobicContact CZ-CD1 4.12Å; F271-L329 HydrophobicContact CZ-CD2 4.18Å; F271-L329 HydrophobicContact CZ-CG 4.49Å
272	N	88.7	Confident	86.5	Confident	61 Å²	61	75.3 Å²	75.3	33%	0.326	37%	0.371	S	S	.	.	H	α-helix	trans	-66.4	-38.8	178	-79.3	-38.8	0	0	0	112.8	H268 R269 L270 R275 K276	H268-N272 WeakPolarHBondContact O-CB 3.25Å; H268-N272 PolarHBondContact O-N 2.84Å; H268-N272 PolarHBondContact O-ND2 3.18Å; R269-N272 PolarHBondContact O-N 3.4Å; L270-N272 PolarHBondContact O-N 2.97Å; N272-R275 PolarHBondContact O-N 3.06Å; N272-R275 PolarHBondContact OD1-NH2 2.91Å; N272-K276 WeakPolarHBondContact O-CG 3.34Å; N272-K276 PolarHBondContact O-N 2.78Å; N272-K276 VanDerWaalsContact O-N 3.08Å
273	A	86.2	Confident	86.4	Confident	6 Å²	6	76.4 Å²	76.4	5%	0.05	37%	0.373	C	S	.	.	H	α-helix	trans	-65.5	-41.6	174.4	0	0	0	0	0	111.6	R269 L270 K276 T277 L342 Y347	R269-A273 WeakPolarHBondContact O-CB 3.44Å; R269-A273 PolarHBondContact O-N 3.48Å; L270-A273 PolarHBondContact O-N 3.02Å; A273-K276 PolarHBondContact O-N 2.98Å; A273-T277 WeakPolarHBondContact O-CB 3.16Å; A273-T277 PolarHBondContact O-N 3.01Å; A273-T277 PolarHBondContact O-OG1 3.47Å; A273-L342 HydrophobicContact CB-CD1 4.24Å; A273-L342 HydrophobicContact CB-CD2 4.15Å; A273-Y347 HydrophobicContact CB-CE1 4.29Å
274	A	84.8	Confident	86.3	Confident	0 Å²	0	76.8 Å²	76.8	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-59.8	-48.7	174.2	0	0	0	0	0	110.5	L270 F271 K276 T277 L278 L329 R332	L270-A274 VanDerWaalsContact O-CB 3.32Å; L270-A274 WeakPolarHBondContact O-CB 3.03Å; L270-A274 PolarHBondContact O-N 2.85Å; F271-A274 WeakPolarHBondContact O-CB 3.29Å; F271-A274 PolarHBondContact O-N 3.27Å; A274-K276 VanDerWaalsContact C-N 3.32Å; A274-K276 PolarHBondContact O-N 2.84Å; A274-T277 CarbonylContact O-C 3.38Å; A274-T277 WeakPolarHBondContact O-CA 3.39Å; A274-T277 WeakPolarHBondContact O-CB 3.46Å; A274-T277 PolarHBondContact O-N 3.13Å; A274-L278 WeakPolarHBondContact O-CG 3.41Å; A274-L278 PolarHBondContact O-N 2.84Å; A274-L329 HydrophobicContact CB-CD2 4.46Å; A274-R332 HydrophobicContact CB-CG 3.81Å
275	R	89	Confident	86.3	Confident	141 Å²	141	76.1 Å²	76.1	53%	0.532	37%	0.374	S	S	.	.	H	α-helix	trans	-58	-40.9	177.6	-173.1	172.6	61.1	158.8	-4.6	113.2	F271 N272 T277 L278 L329	F271-R275 WeakPolarHBondContact O-CB 3.42Å; F271-R275 PolarHBondContact O-N 3.2Å; N272-R275 PolarHBondContact O-N 3.06Å; N272-R275 PolarHBondContact OD1-NH2 2.91Å; R275-T277 VanDerWaalsContact C-N 3.27Å; R275-T277 PolarHBondContact O-N 3.06Å; R275-L278 CarbonylContact O-C 3.49Å; R275-L278 VanDerWaalsContact O-C 3.27Å; R275-L278 VanDerWaalsContact O-O 3.12Å; R275-L329 HydrophobicContact CB-CD2 3.68Å; R275-L329 HydrophobicContact CG-CD2 4.28Å
276	K	87.8	Confident	86	Confident	147 Å²	147	71.5 Å²	71.5	64%	0.639	36%	0.358	S	S	*	.	H	α-helix	trans	-69.6	-22.6	174.9	-71.7	178	-179	-176.3	0	113.5	N272 A273 A274 L278 S279 K280	N272-K276 WeakPolarHBondContact O-CG 3.34Å; N272-K276 PolarHBondContact O-N 2.78Å; N272-K276 VanDerWaalsContact O-N 3.08Å; A273-K276 PolarHBondContact O-N 2.98Å; A274-K276 VanDerWaalsContact C-N 3.32Å; A274-K276 PolarHBondContact O-N 2.84Å; K276-L278 CarbonylContact C-O 3.51Å; K276-S279 PolarHBondContact O-OG 2.89Å; K276-K280 WeakPolarHBondContact O-CG 3.41Å
277	T	83.4	Confident	85.5	Confident	8 Å²	8	74.6 Å²	74.6	5%	0.049	37%	0.371	C	S	.	.	H	α-helix	trans	-90	-41.2	-179	-67.2	0	0	0	0	112.5	A273 A274 R275 L281 I341 L342 I345	A273-T277 WeakPolarHBondContact O-CB 3.16Å; A273-T277 PolarHBondContact O-N 3.01Å; A273-T277 PolarHBondContact O-OG1 3.47Å; A274-T277 CarbonylContact O-C 3.38Å; A274-T277 WeakPolarHBondContact O-CA 3.39Å; A274-T277 WeakPolarHBondContact O-CB 3.46Å; A274-T277 PolarHBondContact O-N 3.13Å; R275-T277 VanDerWaalsContact C-N 3.27Å; R275-T277 PolarHBondContact O-N 3.06Å; T277-L281 WeakPolarHBondContact O-CG 3.44Å; T277-L281 PolarHBondContact O-N 3.12Å; T277-I341 HydrophobicContact CG2-CB 4.07Å; T277-I341 HydrophobicContact CG2-CD1 3.93Å; T277-I341 HydrophobicContact CG2-CG1 3.76Å; T277-L342 HydrophobicContact CG2-CD2 4.07Å; T277-L342 WeakPolarHBondContact OG1-CD2 3.38Å; T277-I345 HydrophobicContact CG2-CD1 3.3Å; T277-I345 HydrophobicContact CG2-CG1 4.23Å
278	L	85.4	Confident	84.7	Confident	7 Å²	7	73.1 Å²	73.1	4%	0.037	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-176.4	143.2	-51.5	-176.6	0	0	0	107.5	A274 R275 K276 K280 L281 D325 L328 L329 I341	A274-L278 WeakPolarHBondContact O-CG 3.41Å; A274-L278 PolarHBondContact O-N 2.84Å; R275-L278 CarbonylContact O-C 3.49Å; R275-L278 VanDerWaalsContact O-C 3.27Å; R275-L278 VanDerWaalsContact O-O 3.12Å; K276-L278 CarbonylContact C-O 3.51Å; L278-K280 PolarHBondContact O-N 3.46Å; L278-L281 HydrophobicContact CD2-CD1 3.83Å; L278-D325 HydrophobicContact CD1-CB 4.43Å; L278-L328 HydrophobicContact CD1-CB 4.06Å; L278-L328 HydrophobicContact CD2-CB 3.74Å; L278-L328 HydrophobicContact CD2-CD1 3.48Å; L278-L328 VanDerWaalsContact CD2-CD1 3.48Å; L278-L328 HydrophobicContact CD2-CG 4.24Å; L278-L328 HydrophobicContact CG-CB 4.37Å; L278-L329 HydrophobicContact CD1-CD2 3.74Å; L278-L329 HydrophobicContact CD1-CG 3.67Å; L278-I341 HydrophobicContact CD2-CD1 4.02Å; L278-I341 HydrophobicContact CG-CD1 4.5Å
279	S	84	Confident	83.7	Confident	95 Å²	95	74.2 Å²	74.2	66%	0.664	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.3	-45.4	-164.6	81.2	0	0	0	0	116.4	K276	K276-S279 PolarHBondContact O-OG 2.89Å
280	K	83.8	Confident	82.7	Confident	161 Å²	161	74.2 Å²	74.2	70%	0.7	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-28.1	177.9	-66.5	-178	-178.4	-173.4	0	113.9	K276 L278	K276-K280 WeakPolarHBondContact O-CG 3.41Å; L278-K280 PolarHBondContact O-N 3.46Å
281	L	83.5	Confident	81.6	Confident	7 Å²	7	75.4 Å²	75.4	4%	0.037	40%	0.403	C	S	.	.	S	Bend	trans	-64.6	140.6	178.8	-73.6	166	0	0	0	111.4	T277 L278 V283 R311 L313 L314	T277-L281 WeakPolarHBondContact O-CG 3.44Å; T277-L281 PolarHBondContact O-N 3.12Å; L278-L281 HydrophobicContact CD2-CD1 3.83Å; L281-V283 PolarHBondContact O-N 2.9Å; L281-R311 HydrophobicContact CB-CG 4.5Å; L281-R311 PolarHBondContact O-NH2 2.66Å; L281-L313 HydrophobicContact CD1-CD2 3.79Å; L281-L314 HydrophobicContact CD2-CD1 4.49Å; L281-L314 HydrophobicContact CD2-CD2 4.13Å; L281-L314 HydrophobicContact CD2-CG 3.83Å
282	P	83.1	Confident	80.3	Confident	74 Å²	74	77.6 Å²	77.6	48%	0.481	42%	0.415	S	S	.	.			trans	-56.3	132.8	178.4	-23.7	33.3	0	0	0	112.6	T312	P282-T312 PolarHBondContact O-N 2.79Å
283	V	87.4	Confident	79.1	Confident	67 Å²	67	79 Å²	79	41%	0.406	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	127.9	169.6	-179.8	0	0	0	0	106.9	L281 V309 V310 R311 K321	L281-V283 PolarHBondContact O-N 2.9Å; V283-V309 HydrophobicContact CG1-CG1 3.3Å; V283-V310 WeakPolarHBondContact CA-O 3.38Å; V283-R311 HydrophobicContact CG2-CG 4.43Å; V283-K321 HydrophobicContact CG1-CD 4.33Å
284	K	85.4	Confident	78.3	Confident	139 Å²	139	84.6 Å²	84.6	60%	0.604	45%	0.454	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.4	140.7	178.4	-67.6	-175.5	177.4	-176.1	0	109.1	V310	K284-V310 PolarHBondContact N-O 3.35Å; K284-V310 PolarHBondContact O-N 3.35Å; K284-V310 VanDerWaalsContact O-O 3.09Å
285	T	87.1	Confident	78.3	Confident	75 Å²	75	86.2 Å²	86.2	46%	0.46	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	131.4	166.4	45.2	0	0	0	0	108.6	H287 D308 V309	T285-H287 PolarHBondContact O-CD2 3.04Å; T285-H287 VanDerWaalsContact O-CD2 3.24Å; T285-H287 PolarHBondContact O-N 2.86Å; T285-H287 PolarHBondContact OG1-NE2 3.36Å; T285-D308 WeakPolarHBondContact CA-O 3.35Å; T285-V309 HydrophobicContact CG2-CG2 4.42Å
286	V	82.8	Confident	78.3	Confident	15 Å²	15	84 Å²	84	9%	0.091	47%	0.469	C	S	.	.			trans	-71.9	125.9	178.4	175.3	0	0	0	0	108.8	M294 F304 H305 G307 D308 V310	V286-M294 HydrophobicContact CG1-CG 4.32Å; V286-M294 HydrophobicContact CG1-SD 3.7Å; V286-F304 HydrophobicContact CG1-CB 4.33Å; V286-F304 HydrophobicContact CG2-CB 4.31Å; V286-H305 WeakPolarHBondContact CB-O 3.48Å; V286-H305 WeakPolarHBondContact CG1-O 3.48Å; V286-G307 PolarHBondContact O-N 3.16Å; V286-D308 HydrophobicContact CB-CB 4.44Å; V286-D308 HydrophobicContact CG2-CB 4.35Å; V286-D308 PolarHBondContact N-O 2.99Å; V286-V310 HydrophobicContact CG2-CB 3.99Å; V286-V310 HydrophobicContact CG2-CG2 3.36Å
287	H	76.9	Confident	78.5	Confident	135 Å²	135	77 Å²	77	63%	0.625	44%	0.439	S	S	*	.			trans	-128.7	97.9	173.6	-64.1	-75.1	0	0	0	108.3	T285	T285-H287 PolarHBondContact O-CD2 3.04Å; T285-H287 VanDerWaalsContact O-CD2 3.24Å; T285-H287 PolarHBondContact O-N 2.86Å; T285-H287 PolarHBondContact OG1-NE2 3.36Å
288	S	68.9	Low	78.8	Confident	24 Å²	24	79.3 Å²	79.3	17%	0.168	45%	0.454	C	S	.	.			trans	-84.5	117	169.7	-174	0	0	0	0	108.9	N290 G291 E292 N306	S288-N290 VanDerWaalsContact C-N 3.3Å; S288-G291 PolarHBondContact OG-N 2.93Å; S288-E292 WeakPolarHBondContact CB-O 3.31Å; S288-E292 PolarHBondContact OG-N 3.48Å; S288-E292 PolarHBondContact OG-O 3.2Å; S288-N306 VanDerWaalsContact CA-OD1 3.3Å; S288-N306 WeakPolarHBondContact CA-OD1 3.12Å; S288-N306 WeakPolarHBondContact CB-OD1 3.49Å; S288-N306 PolarHBondContact N-OD1 3.25Å; S288-N306 PolarHBondContact O-ND2 2.84Å
289	T	67.2	Low	79.1	Confident	147 Å²	147	82 Å²	82	90%	0.902	47%	0.471	S	S	*	.	S	Bend	trans	-72.6	-22.4	177.8	45.5	0	0	0	0	113
290	N	67	Low	79.6	Confident	127 Å²	127	79.3 Å²	79.3	68%	0.679	45%	0.452	S	S	*	.	S	Bend	trans	-122.2	9.6	-172.8	-141.4	47.3	0	0	0	113.8	S288 E292	S288-N290 VanDerWaalsContact C-N 3.3Å; N290-E292 PolarHBondContact O-N 3.18Å; N290-E292 VanDerWaalsContact O-N 3.11Å
291	G	61.6	Low	79.9	Confident	63 Å²	63	78.1 Å²	78.1	65%	0.649	45%	0.452	S	S	*	.	S	Bend	trans	70.8	-1.5	-178.1	0	0	0	0	0	115.1	S288	S288-G291 PolarHBondContact OG-N 2.93Å
292	E	63.2	Low	80.3	Confident	131 Å²	131	83.2 Å²	83.2	61%	0.612	48%	0.475	S	S	*	.			trans	-72.9	138.3	175.4	-69.7	178.4	163.9	0	0	110.7	S288 N290 M294	S288-E292 WeakPolarHBondContact CB-O 3.31Å; S288-E292 PolarHBondContact OG-N 3.48Å; S288-E292 PolarHBondContact OG-O 3.2Å; N290-E292 PolarHBondContact O-N 3.18Å; N290-E292 VanDerWaalsContact O-N 3.11Å; E292-M294 PolarHBondContact O-N 2.79Å
293	P	62	Low	80.5	Confident	91 Å²	91	82.1 Å²	82.1	59%	0.591	47%	0.468	S	S	*	.			trans	-65.9	130.4	178.4	25.8	-32	0	0	0	110.4	G295 P303	P293-G295 PolarHBondContact O-N 3.07Å; P293-P303 HydrophobicContact CB-CB 4.13Å
294	M	71.3	Confident	80.5	Confident	122 Å²	122	79.8 Å²	79.8	60%	0.601	45%	0.452	S	S	*	.			trans	-80	23.4	-179.3	-62.7	-171.5	71	0	0	113.2	V286 E292	V286-M294 HydrophobicContact CG1-CG 4.32Å; V286-M294 HydrophobicContact CG1-SD 3.7Å; E292-M294 PolarHBondContact O-N 2.79Å
295	G	82.9	Confident	80.5	Confident	35 Å²	35	78.2 Å²	78.2	36%	0.361	45%	0.447	S	S	.	.			trans	100.1	-178.8	-169.4	0	0	0	0	0	113.3	P293 F304	P293-G295 PolarHBondContact O-N 3.07Å; G295-F304 WeakPolarHBondContact O-CD2 3.42Å; G295-F304 PolarHBondContact O-N 2.98Å
296	D	89.1	Confident	80.4	Confident	93 Å²	93	79.1 Å²	79.1	50%	0.497	45%	0.449	S	S	.	.	B	Isolated β-bridge	trans	-112.3	147.6	-176.3	-54.6	-27.9	0	0	0	111.4	P298 E302 P303	D296-P298 VanDerWaalsContact O-CD 3.24Å; D296-P298 WeakPolarHBondContact O-CD 2.98Å; D296-E302 WeakPolarHBondContact CA-O 3.43Å; D296-P303 WeakPolarHBondContact OD1-CA 3.42Å; D296-P303 WeakPolarHBondContact OD1-CB 3.45Å
297	C	92.6	Very high	80.5	Confident	0 Å²	0	80.7 Å²	80.7	0%	0	47%	0.468	C	S	.	.			trans	-74	117.9	172.4	179.5	0	0	0	0	109.8	V299 C300 I301 E302 F304 H320	C297-V299 PolarHBondContact O-N 2.59Å; C297-C300 VanDerWaalsContact CB-SG 3.5Å; C297-C300 PolarHBondContact O-N 3.34Å; C297-C300 VanDerWaalsContact SG-SG 3.66Å; C297-I301 WeakPolarHBondContact O-CA 3.3Å; C297-I301 PolarHBondContact O-N 3.31Å; C297-E302 PolarHBondContact N-O 3.02Å; C297-F304 HydrophobicContact CB-CD1 4.45Å; C297-F304 HydrophobicContact CB-CE1 3.64Å; C297-F304 HydrophobicContact CB-CZ 3.83Å; C297-H320 WeakPolarHBondContact CB-ND1 3.08Å; C297-H320 PolarHBondContact SG-N 2.81Å; C297-H320 PolarHBondContact SG-ND1 3.16Å
298	P	90.5	Very high	81	Confident	58 Å²	58	76.2 Å²	76.2	38%	0.377	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-8	-176.7	-18.1	28.1	0	0	0	115.4	D296 F319 L336	D296-P298 VanDerWaalsContact O-CD 3.24Å; D296-P298 WeakPolarHBondContact O-CD 2.98Å; P298-F319 HydrophobicContact CB-CD1 4.4Å; P298-F319 HydrophobicContact CB-CE1 3.92Å; P298-F319 HydrophobicContact CG-CD1 4.03Å; P298-F319 HydrophobicContact CG-CE1 3.63Å; P298-F319 HydrophobicContact CG-CZ 4.44Å; P298-L336 HydrophobicContact CB-CD1 4.35Å; P298-L336 HydrophobicContact CB-CD2 3.92Å; P298-L336 HydrophobicContact CB-CG 4.21Å; P298-L336 HydrophobicContact CG-CD1 3.71Å; P298-L336 HydrophobicContact CG-CD2 4.16Å; P298-L336 HydrophobicContact CG-CG 4.11Å
299	V	91.6	Very high	82.1	Confident	62 Å²	62	78.1 Å²	78.1	38%	0.376	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-45.2	-178.1	176.9	0	0	0	0	111.7	C297 F319 C323 P335	C297-V299 PolarHBondContact O-N 2.59Å; V299-F319 HydrophobicContact CG2-CD1 3.74Å; V299-F319 HydrophobicContact CG2-CE1 4.17Å; V299-C323 HydrophobicContact CB-CB 3.91Å; V299-C323 HydrophobicContact CG1-CB 3.8Å; V299-P335 HydrophobicContact CG2-CB 4.5Å; V299-P335 HydrophobicContact CG2-CG 4.09Å
300	C	93.1	Very high	83.2	Confident	40 Å²	40	71.5 Å²	71.5	27%	0.27	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97	-11.2	174.2	57.4	0	0	0	0	113.5	C297 E302 H320	C297-C300 VanDerWaalsContact CB-SG 3.5Å; C297-C300 PolarHBondContact O-N 3.34Å; C297-C300 VanDerWaalsContact SG-SG 3.66Å; C300-E302 HydrophobicContact CB-CG 4.24Å; C300-E302 PolarHBondContact O-N 3.01Å; C300-H320 PolarHBondContact SG-ND1 3.28Å; C300-H320 VanDerWaalsContact SG-ND1 3.4Å
301	I	91.1	Very high	84.4	Confident	136 Å²	136	65.7 Å²	65.7	70%	0.697	39%	0.387	S	S	*	.			trans	62.2	23	-177.5	-37.5	174.6	0	0	0	111.5	C297	C297-I301 WeakPolarHBondContact O-CA 3.3Å; C297-I301 PolarHBondContact O-N 3.31Å
302	E	90.7	Very high	85.7	Confident	114 Å²	114	64.4 Å²	64.4	53%	0.533	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-101	143.2	177.4	-64.5	174.6	167.8	0	0	110.7	D296 C297 C300	D296-E302 WeakPolarHBondContact CA-O 3.43Å; C297-E302 PolarHBondContact N-O 3.02Å; C300-E302 HydrophobicContact CB-CG 4.24Å; C300-E302 PolarHBondContact O-N 3.01Å
303	P	88.5	Confident	86.9	Confident	50 Å²	50	58.5 Å²	58.5	33%	0.325	34%	0.34	S	S	.	.	B	Isolated β-bridge	trans	-62.7	148.7	175.6	25	-32.1	0	0	0	111.6	P293 D296 H305	P293-P303 HydrophobicContact CB-CB 4.13Å; D296-P303 WeakPolarHBondContact OD1-CA 3.42Å; D296-P303 WeakPolarHBondContact OD1-CB 3.45Å; P303-H305 PolarHBondContact O-CE1 3.01Å; P303-H305 PolarHBondContact O-N 3Å; P303-H305 PolarHBondContact O-ND1 2.99Å
304	F	87.6	Confident	88	Confident	18 Å²	18	58.2 Å²	58.2	8%	0.079	33%	0.333	C	S	.	.	P	Polyproline II helix	trans	-73.6	124.6	173.8	-65.1	-59.6	0	0	0	111	V286 G295 C297 V310 H320	V286-F304 HydrophobicContact CG1-CB 4.33Å; V286-F304 HydrophobicContact CG2-CB 4.31Å; G295-F304 WeakPolarHBondContact O-CD2 3.42Å; G295-F304 PolarHBondContact O-N 2.98Å; C297-F304 HydrophobicContact CB-CD1 4.45Å; C297-F304 HydrophobicContact CB-CE1 3.64Å; C297-F304 HydrophobicContact CB-CZ 3.83Å; F304-V310 HydrophobicContact CD1-CG2 3.49Å; F304-V310 VanDerWaalsContact CD1-CG2 3.49Å; F304-V310 HydrophobicContact CE1-CG1 4.36Å; F304-V310 HydrophobicContact CE1-CG2 3.59Å; F304-V310 HydrophobicContact CG-CG2 4.3Å; F304-V310 HydrophobicContact CZ-CG2 4.47Å; F304-H320 AromaticContact CD1-CE1 3.85Å; F304-H320 AromaticContact CD1-NE2 3.67Å; F304-H320 AromaticContact CE1-CE1 3.98Å
305	H	85.6	Confident	88.9	Confident	106 Å²	106	54 Å²	54	49%	0.491	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-100.9	160.2	178.6	-60.7	90.2	0	0	0	112.3	V286 P303 G307 D308	V286-H305 WeakPolarHBondContact CB-O 3.48Å; V286-H305 WeakPolarHBondContact CG1-O 3.48Å; P303-H305 PolarHBondContact O-CE1 3.01Å; P303-H305 PolarHBondContact O-N 3Å; P303-H305 PolarHBondContact O-ND1 2.99Å; H305-G307 PolarHBondContact O-N 2.79Å; H305-D308 PolarHBondContact N-OD2 2.92Å; H305-D308 IonicContact ND1-OD2 2.7Å; H305-D308 VanDerWaalsContact O-CB 3.27Å; H305-D308 WeakPolarHBondContact O-CB 3.08Å; H305-D308 PolarHBondContact O-N 3.42Å
306	N	83.8	Confident	89.2	Confident	95 Å²	95	61.1 Å²	61.1	51%	0.508	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	125.9	174.1	-76.5	-12.2	0	0	0	111.2	S288	S288-N306 VanDerWaalsContact CA-OD1 3.3Å; S288-N306 WeakPolarHBondContact CA-OD1 3.12Å; S288-N306 WeakPolarHBondContact CB-OD1 3.49Å; S288-N306 PolarHBondContact N-OD1 3.25Å; S288-N306 PolarHBondContact O-ND2 2.84Å
307	G	84.6	Confident	89.3	Confident	48 Å²	48	59.8 Å²	59.8	50%	0.495	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.4	-9.3	-175.4	0	0	0	0	0	114.4	V286 H305 V309	V286-G307 PolarHBondContact O-N 3.16Å; H305-G307 PolarHBondContact O-N 2.79Å; G307-V309 PolarHBondContact O-N 2.05Å
308	D	88.3	Confident	89.2	Confident	41 Å²	41	61.4 Å²	61.4	22%	0.219	34%	0.34	C	S	.	.			trans	-63	137.4	177.5	-78.4	-9.2	0	0	0	111.4	T285 V286 H305 V310 H320	T285-D308 WeakPolarHBondContact CA-O 3.35Å; V286-D308 HydrophobicContact CB-CB 4.44Å; V286-D308 HydrophobicContact CG2-CB 4.35Å; V286-D308 PolarHBondContact N-O 2.99Å; H305-D308 PolarHBondContact N-OD2 2.92Å; H305-D308 IonicContact ND1-OD2 2.7Å; H305-D308 VanDerWaalsContact O-CB 3.27Å; H305-D308 WeakPolarHBondContact O-CB 3.08Å; H305-D308 PolarHBondContact O-N 3.42Å; D308-V310 HydrophobicContact CB-CG2 4.45Å; D308-V310 PolarHBondContact O-N 3.36Å; D308-H320 IonicContact OD2-CD2 2.68Å; D308-H320 IonicContact OD2-CE1 3.79Å; D308-H320 IonicContact OD2-NE2 2.81Å; D308-H320 PolarHBondContact OD2-NE2 2.8Å
309	V	91	Very high	89.3	Confident	63 Å²	63	58.7 Å²	58.7	38%	0.382	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	105.8	177.2	-174.6	0	0	0	0	108.8	V283 T285 G307 K321	V283-V309 HydrophobicContact CG1-CG1 3.3Å; T285-V309 HydrophobicContact CG2-CG2 4.42Å; G307-V309 PolarHBondContact O-N 2.05Å; V309-K321 HydrophobicContact CB-CB 4.5Å; V309-K321 HydrophobicContact CG1-CB 4.01Å; V309-K321 HydrophobicContact CG1-CD 3.83Å; V309-K321 WeakPolarHBondContact O-CB 3.44Å; V309-K321 PolarHBondContact O-N 2.85Å
310	V	91.6	Very high	89.5	Confident	8 Å²	8	56.3 Å²	56.3	5%	0.048	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	139.5	-177.3	172.2	0	0	0	0	110.3	V283 K284 V286 F304 D308 A318 F319	V283-V310 WeakPolarHBondContact CA-O 3.38Å; K284-V310 PolarHBondContact N-O 3.35Å; K284-V310 PolarHBondContact O-N 3.35Å; K284-V310 VanDerWaalsContact O-O 3.09Å; V286-V310 HydrophobicContact CG2-CB 3.99Å; V286-V310 HydrophobicContact CG2-CG2 3.36Å; F304-V310 HydrophobicContact CD1-CG2 3.49Å; F304-V310 VanDerWaalsContact CD1-CG2 3.49Å; F304-V310 HydrophobicContact CE1-CG1 4.36Å; F304-V310 HydrophobicContact CE1-CG2 3.59Å; F304-V310 HydrophobicContact CG-CG2 4.3Å; F304-V310 HydrophobicContact CZ-CG2 4.47Å; D308-V310 HydrophobicContact CB-CG2 4.45Å; D308-V310 PolarHBondContact O-N 3.36Å; V310-A318 HydrophobicContact CG1-CB 3.74Å; V310-F319 CarbonylContact C-O 3.3Å; V310-F319 WeakPolarHBondContact CA-O 3.18Å; V310-F319 WeakPolarHBondContact CG1-O 3.34Å
311	R	90.7	Very high	89.4	Confident	6 Å²	6	58.4 Å²	58.4	2%	0.023	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	125.8	174.1	-164.3	175.1	-161.6	113.5	27.2	109.2	L281 V283 F319 K321 V324 D325	L281-R311 HydrophobicContact CB-CG 4.5Å; L281-R311 PolarHBondContact O-NH2 2.66Å; V283-R311 HydrophobicContact CG2-CG 4.43Å; R311-F319 PolarHBondContact N-O 2.87Å; R311-F319 PolarHBondContact O-N 2.84Å; R311-F319 VanDerWaalsContact O-N 3.14Å; R311-K321 HydrophobicContact CB-CB 4.43Å; R311-V324 HydrophobicContact CB-CG1 3.97Å; R311-D325 WeakPolarHBondContact CD-OD1 3.42Å; R311-D325 IonicContact CZ-OD1 3.56Å; R311-D325 IonicContact NE-OD1 3.53Å; R311-D325 VanDerWaalsContact NH1-CG 3.32Å; R311-D325 IonicContact NH1-OD1 2.82Å; R311-D325 PolarHBondContact NH1-OD1 2.8Å; R311-D325 IonicContact NH1-OD2 3.03Å; R311-D325 PolarHBondContact NH1-OD2 3.36Å
312	T	89.4	Confident	89.5	Confident	36 Å²	36	57.4 Å²	57.4	22%	0.221	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	123.4	175.7	-50.1	0	0	0	0	109.5	P282	P282-T312 PolarHBondContact O-N 2.79Å
313	L	89.4	Confident	89.6	Confident	7 Å²	7	53.5 Å²	53.5	4%	0.037	30%	0.297	C	S	.	.			trans	-78	167.2	176	-69.8	176.5	0	0	0	111.5	L281 C315 K316 H317 F319 L328 C334 I341	L281-L313 HydrophobicContact CD1-CD2 3.79Å; L313-C315 VanDerWaalsContact CB-SG 3.58Å; L313-C315 PolarHBondContact O-N 2.83Å; L313-K316 WeakPolarHBondContact O-CA 3.41Å; L313-K316 PolarHBondContact O-N 3.16Å; L313-H317 PolarHBondContact N-O 3.09Å; L313-F319 HydrophobicContact CD1-CD2 4.18Å; L313-F319 HydrophobicContact CD1-CE2 3.64Å; L313-F319 HydrophobicContact CG-CD2 4.49Å; L313-F319 HydrophobicContact CG-CE2 4.31Å; L313-L328 HydrophobicContact CD1-CD2 4.44Å; L313-L328 HydrophobicContact CD2-CD1 3.69Å; L313-L328 HydrophobicContact CD2-CD2 4.21Å; L313-C334 HydrophobicContact CD1-CB 3.67Å; L313-C334 VanDerWaalsContact CD1-SG 3.58Å; L313-I341 HydrophobicContact CD2-CG2 3.87Å
314	L	85.5	Confident	89.8	Confident	85 Å²	85	51.1 Å²	51.1	45%	0.445	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-24.4	176.4	-63.1	172.3	0	0	0	113.4	L281 K316 A344 I345	L281-L314 HydrophobicContact CD2-CD1 4.49Å; L281-L314 HydrophobicContact CD2-CD2 4.13Å; L281-L314 HydrophobicContact CD2-CG 3.83Å; L314-K316 PolarHBondContact O-N 2.95Å; L314-A344 HydrophobicContact CB-CB 4.37Å; L314-A344 HydrophobicContact CD1-CB 3.58Å; L314-I345 HydrophobicContact CD1-CD1 4.35Å; L314-I345 HydrophobicContact CD1-CG1 3.54Å
315	C	89.9	Confident	90.1	Very high	34 Å²	34	51.7 Å²	51.7	23%	0.23	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	6.1	170.3	56.5	0	0	0	0	113.8	L313 H317 C334 L339	L313-C315 VanDerWaalsContact CB-SG 3.58Å; L313-C315 PolarHBondContact O-N 2.83Å; C315-H317 PolarHBondContact O-N 2.97Å; C315-H317 PolarHBondContact SG-ND1 2.83Å; C315-C334 VanDerWaalsContact SG-SG 3.66Å; C315-L339 HydrophobicContact CB-CD2 3.8Å
316	K	87.7	Confident	90.4	Very high	184 Å²	184	50.3 Å²	50.3	80%	0.8	29%	0.286	S	S	*	.	S	Bend	trans	68.7	-0.9	-178.5	-51.5	178.4	-179.3	178.1	0	115.8	L313 L314	L313-K316 WeakPolarHBondContact O-CA 3.41Å; L313-K316 PolarHBondContact O-N 3.16Å; L314-K316 PolarHBondContact O-N 2.95Å
317	H	91.8	Very high	90.7	Very high	64 Å²	64	50.6 Å²	50.6	30%	0.296	28%	0.28	S	S	.	.			trans	-66.9	139.5	169.7	-65.1	126	0	0	0	111.6	L313 C315 F319 L336	L313-H317 PolarHBondContact N-O 3.09Å; C315-H317 PolarHBondContact O-N 2.97Å; C315-H317 PolarHBondContact SG-ND1 2.83Å; H317-F319 HydrophobicContact CB-CE2 3.51Å; H317-F319 HydrophobicContact CB-CZ 3.86Å; H317-L336 HydrophobicContact CB-CD1 4.04Å; H317-L336 WeakPolarHBondContact CD2-CD1 3.39Å
318	A	90.5	Very high	91	Very high	35 Å²	35	48.3 Å²	48.3	29%	0.289	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	140.8	-176.3	0	0	0	0	0	110.9	V310	V310-A318 HydrophobicContact CG1-CB 3.74Å
319	F	93.9	Very high	91	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	155.7	-178.8	-53.5	-94.6	0	0	0	109.6	P298 V299 V310 R311 L313 H317 K321 V324 P335 L336	P298-F319 HydrophobicContact CB-CD1 4.4Å; P298-F319 HydrophobicContact CB-CE1 3.92Å; P298-F319 HydrophobicContact CG-CD1 4.03Å; P298-F319 HydrophobicContact CG-CE1 3.63Å; P298-F319 HydrophobicContact CG-CZ 4.44Å; V299-F319 HydrophobicContact CG2-CD1 3.74Å; V299-F319 HydrophobicContact CG2-CE1 4.17Å; V310-F319 CarbonylContact C-O 3.3Å; V310-F319 WeakPolarHBondContact CA-O 3.18Å; V310-F319 WeakPolarHBondContact CG1-O 3.34Å; R311-F319 PolarHBondContact N-O 2.87Å; R311-F319 PolarHBondContact O-N 2.84Å; R311-F319 VanDerWaalsContact O-N 3.14Å; L313-F319 HydrophobicContact CD1-CD2 4.18Å; L313-F319 HydrophobicContact CD1-CE2 3.64Å; L313-F319 HydrophobicContact CG-CD2 4.49Å; L313-F319 HydrophobicContact CG-CE2 4.31Å; H317-F319 HydrophobicContact CB-CE2 3.51Å; H317-F319 HydrophobicContact CB-CZ 3.86Å; F319-K321 PolarHBondContact O-N 2.81Å; F319-V324 HydrophobicContact CB-CB 3.56Å; F319-V324 HydrophobicContact CB-CG1 3.92Å; F319-V324 HydrophobicContact CB-CG2 3.87Å; F319-V324 HydrophobicContact CD1-CG2 4.25Å; F319-V324 HydrophobicContact CD2-CB 4.4Å; F319-V324 HydrophobicContact CD2-CG2 3.79Å; F319-V324 HydrophobicContact CE2-CG2 4.43Å; F319-V324 HydrophobicContact CG-CB 3.99Å; F319-V324 HydrophobicContact CG-CG2 3.71Å; F319-P335 HydrophobicContact CE1-CB 4.22Å; F319-P335 HydrophobicContact CE1-CG 4.04Å; F319-P335 HydrophobicContact CZ-CB 4.49Å; F319-P335 HydrophobicContact CZ-CG 4.25Å; F319-L336 HydrophobicContact CE1-CD1 4.26Å; F319-L336 HydrophobicContact CE1-CG 4.19Å; F319-L336 HydrophobicContact CZ-CD1 3.88Å; F319-L336 HydrophobicContact CZ-CG 3.94Å
320	H	94	Very high	90.8	Very high	13 Å²	13	52.1 Å²	52.1	6%	0.06	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.6	136.1	166.6	-64.1	106.4	0	0	0	110.1	C297 C300 F304 D308 T322 C323 V324	C297-H320 WeakPolarHBondContact CB-ND1 3.08Å; C297-H320 PolarHBondContact SG-N 2.81Å; C297-H320 PolarHBondContact SG-ND1 3.16Å; C300-H320 PolarHBondContact SG-ND1 3.28Å; C300-H320 VanDerWaalsContact SG-ND1 3.4Å; F304-H320 AromaticContact CD1-CE1 3.85Å; F304-H320 AromaticContact CD1-NE2 3.67Å; F304-H320 AromaticContact CE1-CE1 3.98Å; D308-H320 IonicContact OD2-CD2 2.68Å; D308-H320 IonicContact OD2-CE1 3.79Å; D308-H320 IonicContact OD2-NE2 2.81Å; D308-H320 PolarHBondContact OD2-NE2 2.8Å; H320-T322 VanDerWaalsContact C-N 3.25Å; H320-T322 PolarHBondContact O-N 3.13Å; H320-C323 HydrophobicContact CB-CB 4.01Å; H320-C323 PolarHBondContact O-N 3.15Å; H320-C323 VanDerWaalsContact O-N 3.11Å; H320-V324 WeakPolarHBondContact O-CG1 3.37Å; H320-V324 PolarHBondContact O-N 3.41Å
321	K	92.2	Very high	90.7	Very high	83 Å²	83	55.5 Å²	55.5	36%	0.361	29%	0.285	S	S	.	.	H	α-helix	trans	-56.6	-42.8	179.2	-178.8	-174	172.2	-167.6	0	111.3	V283 V309 R311 F319 C323 D325	V283-K321 HydrophobicContact CG1-CD 4.33Å; V309-K321 HydrophobicContact CB-CB 4.5Å; V309-K321 HydrophobicContact CG1-CB 4.01Å; V309-K321 HydrophobicContact CG1-CD 3.83Å; V309-K321 WeakPolarHBondContact O-CB 3.44Å; V309-K321 PolarHBondContact O-N 2.85Å; R311-K321 HydrophobicContact CB-CB 4.43Å; F319-K321 PolarHBondContact O-N 2.81Å; K321-C323 VanDerWaalsContact C-N 3.33Å; K321-C323 PolarHBondContact O-N 3.09Å; K321-D325 WeakPolarHBondContact CE-OD2 3.37Å; K321-D325 VanDerWaalsContact CG-OD2 3.26Å; K321-D325 WeakPolarHBondContact CG-OD2 3.4Å; K321-D325 WeakPolarHBondContact O-CB 3.09Å; K321-D325 VanDerWaalsContact O-CG 3.24Å; K321-D325 PolarHBondContact O-N 2.05Å
322	T	92.5	Very high	90.5	Very high	115 Å²	115	58.4 Å²	58.4	71%	0.706	30%	0.296	S	S	*	.	H	α-helix	trans	-64	-35.4	178.2	46.8	0	0	0	0	112.7	H320 P326	H320-T322 VanDerWaalsContact C-N 3.25Å; H320-T322 PolarHBondContact O-N 3.13Å; T322-P326 WeakPolarHBondContact O-CD 3.45Å; T322-P326 WeakPolarHBondContact O-CG 2.98Å
323	C	93.5	Very high	90.7	Very high	33 Å²	33	58.5 Å²	58.5	22%	0.223	30%	0.296	C	S	.	.	H	α-helix	trans	-77.7	-40.4	179.5	-60.9	0	0	0	0	112.3	V299 H320 K321	V299-C323 HydrophobicContact CB-CB 3.91Å; V299-C323 HydrophobicContact CG1-CB 3.8Å; H320-C323 HydrophobicContact CB-CB 4.01Å; H320-C323 PolarHBondContact O-N 3.15Å; H320-C323 VanDerWaalsContact O-N 3.11Å; K321-C323 VanDerWaalsContact C-N 3.33Å; K321-C323 PolarHBondContact O-N 3.09Å
324	V	93.2	Very high	90.8	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-92.8	-30.4	-169.9	82	0	0	0	0	113.9	R311 F319 H320 W327 L328 P335	R311-V324 HydrophobicContact CB-CG1 3.97Å; F319-V324 HydrophobicContact CB-CB 3.56Å; F319-V324 HydrophobicContact CB-CG1 3.92Å; F319-V324 HydrophobicContact CB-CG2 3.87Å; F319-V324 HydrophobicContact CD1-CG2 4.25Å; F319-V324 HydrophobicContact CD2-CB 4.4Å; F319-V324 HydrophobicContact CD2-CG2 3.79Å; F319-V324 HydrophobicContact CE2-CG2 4.43Å; F319-V324 HydrophobicContact CG-CB 3.99Å; F319-V324 HydrophobicContact CG-CG2 3.71Å; H320-V324 WeakPolarHBondContact O-CG1 3.37Å; H320-V324 PolarHBondContact O-N 3.41Å; V324-W327 WeakPolarHBondContact O-CB 3.06Å; V324-W327 PolarHBondContact O-N 2.72Å; V324-L328 HydrophobicContact CB-CD1 4.37Å; V324-L328 HydrophobicContact CG1-CD1 4.02Å; V324-L328 HydrophobicContact CG2-CD1 3.74Å; V324-L328 HydrophobicContact CG2-CG 3.96Å; V324-L328 VanDerWaalsContact O-CG 3.25Å; V324-L328 WeakPolarHBondContact O-CG 3.49Å; V324-L328 PolarHBondContact O-N 3.11Å; V324-P335 HydrophobicContact CG2-CG 4.44Å
325	D	92.2	Very high	91.1	Very high	29 Å²	29	56.1 Å²	56.1	16%	0.155	29%	0.286	C	S	.	.	H	α-helix	trans	-60.1	-46.4	-177.6	-78.7	-3.9	0	0	0	112.7	L278 R311 K321 W327 L328 L329	L278-D325 HydrophobicContact CD1-CB 4.43Å; R311-D325 WeakPolarHBondContact CD-OD1 3.42Å; R311-D325 IonicContact CZ-OD1 3.56Å; R311-D325 IonicContact NE-OD1 3.53Å; R311-D325 VanDerWaalsContact NH1-CG 3.32Å; R311-D325 IonicContact NH1-OD1 2.82Å; R311-D325 PolarHBondContact NH1-OD1 2.8Å; R311-D325 IonicContact NH1-OD2 3.03Å; R311-D325 PolarHBondContact NH1-OD2 3.36Å; K321-D325 WeakPolarHBondContact CE-OD2 3.37Å; K321-D325 VanDerWaalsContact CG-OD2 3.26Å; K321-D325 WeakPolarHBondContact CG-OD2 3.4Å; K321-D325 WeakPolarHBondContact O-CB 3.09Å; K321-D325 VanDerWaalsContact O-CG 3.24Å; K321-D325 PolarHBondContact O-N 2.05Å; D325-W327 VanDerWaalsContact C-N 3.33Å; D325-W327 PolarHBondContact O-N 3.03Å; D325-L328 PolarHBondContact O-N 2.98Å; D325-L329 WeakPolarHBondContact O-CG 3.3Å; D325-L329 PolarHBondContact O-N 2.88Å
326	P	91.7	Very high	91.1	Very high	77 Å²	77	58.8 Å²	58.8	50%	0.5	30%	0.298	S	S	.	.	H	α-helix	trans	-59	-43.5	176.2	-24	34.8	0	0	0	112.5	T322 L328 L329 Q330	T322-P326 WeakPolarHBondContact O-CD 3.45Å; T322-P326 WeakPolarHBondContact O-CG 2.98Å; P326-L328 PolarHBondContact O-N 2.92Å; P326-L329 PolarHBondContact O-N 3.39Å; P326-Q330 PolarHBondContact O-N 3.14Å
327	W	91.8	Very high	91.3	Very high	102 Å²	102	52.8 Å²	52.8	39%	0.386	28%	0.278	S	S	.	.	H	α-helix	trans	-60.8	-46.9	177.5	176.1	-84	0	0	0	112	V324 D325 L329 Q330 H331 T333 P335	V324-W327 WeakPolarHBondContact O-CB 3.06Å; V324-W327 PolarHBondContact O-N 2.72Å; D325-W327 VanDerWaalsContact C-N 3.33Å; D325-W327 PolarHBondContact O-N 3.03Å; W327-L329 VanDerWaalsContact C-N 3.33Å; W327-L329 PolarHBondContact O-N 3.03Å; W327-Q330 PolarHBondContact O-N 3.11Å; W327-H331 AromaticContact CD2-CD2 3.98Å; W327-H331 PolarHBondContact O-N 2.86Å; W327-T333 PolarHBondContact NE1-O 3.02Å; W327-P335 HydrophobicContact CD2-CG 4.36Å; W327-P335 HydrophobicContact CG-CG 4.17Å
328	L	90.3	Very high	91.3	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-69.5	-30.2	-177.6	-67.2	168.6	0	0	0	112.6	L278 L313 V324 D325 P326 Q330 R332 I341	L278-L328 HydrophobicContact CD1-CB 4.06Å; L278-L328 HydrophobicContact CD2-CB 3.74Å; L278-L328 HydrophobicContact CD2-CD1 3.48Å; L278-L328 VanDerWaalsContact CD2-CD1 3.48Å; L278-L328 HydrophobicContact CD2-CG 4.24Å; L278-L328 HydrophobicContact CG-CB 4.37Å; L313-L328 HydrophobicContact CD1-CD2 4.44Å; L313-L328 HydrophobicContact CD2-CD1 3.69Å; L313-L328 HydrophobicContact CD2-CD2 4.21Å; V324-L328 HydrophobicContact CB-CD1 4.37Å; V324-L328 HydrophobicContact CG1-CD1 4.02Å; V324-L328 HydrophobicContact CG2-CD1 3.74Å; V324-L328 HydrophobicContact CG2-CG 3.96Å; V324-L328 VanDerWaalsContact O-CG 3.25Å; V324-L328 WeakPolarHBondContact O-CG 3.49Å; V324-L328 PolarHBondContact O-N 3.11Å; D325-L328 PolarHBondContact O-N 2.98Å; P326-L328 PolarHBondContact O-N 2.92Å; L328-Q330 VanDerWaalsContact C-N 3.31Å; L328-R332 WeakPolarHBondContact O-CA 3.49Å; L328-R332 PolarHBondContact O-N 2.77Å; L328-I341 HydrophobicContact CB-CD1 4.13Å; L328-I341 HydrophobicContact CD2-CD1 4.22Å; L328-I341 HydrophobicContact CD2-CG2 4.02Å
329	L	88.4	Confident	91.2	Very high	40 Å²	40	59.6 Å²	59.6	21%	0.209	30%	0.304	C	S	.	.	H	α-helix	trans	-65.2	-35.3	173.2	-75.8	173	0	0	0	112.4	F271 A274 R275 L278 D325 P326 W327	F271-L329 HydrophobicContact CD2-CB 4.12Å; F271-L329 HydrophobicContact CD2-CD2 4.5Å; F271-L329 HydrophobicContact CE2-CB 3.71Å; F271-L329 HydrophobicContact CE2-CD1 4.17Å; F271-L329 HydrophobicContact CE2-CD2 4.14Å; F271-L329 HydrophobicContact CE2-CG 4.22Å; F271-L329 HydrophobicContact CZ-CB 4.44Å; F271-L329 HydrophobicContact CZ-CD1 4.12Å; F271-L329 HydrophobicContact CZ-CD2 4.18Å; F271-L329 HydrophobicContact CZ-CG 4.49Å; A274-L329 HydrophobicContact CB-CD2 4.46Å; R275-L329 HydrophobicContact CB-CD2 3.68Å; R275-L329 HydrophobicContact CG-CD2 4.28Å; L278-L329 HydrophobicContact CD1-CD2 3.74Å; L278-L329 HydrophobicContact CD1-CG 3.67Å; D325-L329 WeakPolarHBondContact O-CG 3.3Å; D325-L329 PolarHBondContact O-N 2.88Å; P326-L329 PolarHBondContact O-N 3.39Å; W327-L329 VanDerWaalsContact C-N 3.33Å; W327-L329 PolarHBondContact O-N 3.03Å
330	Q	86.9	Confident	90.9	Very high	143 Å²	143	61 Å²	61	67%	0.668	31%	0.311	S	S	*	.	H	α-helix	trans	-87.1	-51	-178.4	-172.9	169.9	6.4	0	0	112.6	P326 W327 L328	P326-Q330 PolarHBondContact O-N 3.14Å; W327-Q330 PolarHBondContact O-N 3.11Å; L328-Q330 VanDerWaalsContact C-N 3.31Å
331	H	88.2	Confident	90.5	Very high	80 Å²	80	60.7 Å²	60.7	37%	0.37	31%	0.31	S	S	.	.	H	α-helix	trans	-100.1	-26.1	-171.2	-66.1	-76.9	0	0	0	113.7	W327 T333	W327-H331 AromaticContact CD2-CD2 3.98Å; W327-H331 PolarHBondContact O-N 2.86Å; H331-T333 PolarHBondContact O-N 3.18Å; H331-T333 VanDerWaalsContact O-N 3.11Å
332	R	88.3	Confident	90.1	Very high	66 Å²	66	57 Å²	57	25%	0.249	29%	0.294	C	S	.	.			trans	63.5	4	-178	-54.2	153.2	-71.3	156	-0.9	115	A274 L328 D340 I341 L342	A274-R332 HydrophobicContact CB-CG 3.81Å; L328-R332 WeakPolarHBondContact O-CA 3.49Å; L328-R332 PolarHBondContact O-N 2.77Å; R332-D340 WeakPolarHBondContact O-CA 3.38Å; R332-I341 HydrophobicContact CB-CG1 4.4Å; R332-I341 WeakPolarHBondContact O-CG1 3.1Å; R332-I341 PolarHBondContact O-N 3.36Å; R332-L342 HydrophobicContact CG-CD1 4.26Å
333	T	92.1	Very high	89.6	Confident	39 Å²	39	59.2 Å²	59.2	24%	0.239	29%	0.294	C	S	.	.	B	Isolated β-bridge	trans	-111.8	142.8	-177.4	52.7	0	0	0	0	111	W327 H331 L339 D340	W327-T333 PolarHBondContact NE1-O 3.02Å; H331-T333 PolarHBondContact O-N 3.18Å; H331-T333 VanDerWaalsContact O-N 3.11Å; T333-L339 WeakPolarHBondContact CA-O 3.02Å; T333-D340 HydrophobicContact CG2-CB 4.36Å
334	C	91.6	Very high	88.8	Confident	1 Å²	1	59.7 Å²	59.7	1%	0.007	30%	0.301	C	S	.	.			trans	-57.7	129.6	170.5	179.3	0	0	0	0	110.7	L313 C315 L336 C337 K338 L339	L313-C334 HydrophobicContact CD1-CB 3.67Å; L313-C334 VanDerWaalsContact CD1-SG 3.58Å; C315-C334 VanDerWaalsContact SG-SG 3.66Å; C334-L336 PolarHBondContact O-N 3.4Å; C334-L336 PolarHBondContact SG-N 3.39Å; C334-C337 VanDerWaalsContact CB-SG 3.55Å; C334-C337 VanDerWaalsContact SG-SG 3.63Å; C334-K338 VanDerWaalsContact O-CA 3.26Å; C334-K338 WeakPolarHBondContact O-CA 3.25Å; C334-K338 PolarHBondContact O-N 3.35Å; C334-L339 PolarHBondContact N-O 3.35Å
335	P	92.1	Very high	88	Confident	41 Å²	41	63.2 Å²	63.2	27%	0.266	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-31.4	176.3	-25.7	32.5	0	0	0	114	V299 F319 V324 W327	V299-P335 HydrophobicContact CG2-CB 4.5Å; V299-P335 HydrophobicContact CG2-CG 4.09Å; F319-P335 HydrophobicContact CE1-CB 4.22Å; F319-P335 HydrophobicContact CE1-CG 4.04Å; F319-P335 HydrophobicContact CZ-CB 4.49Å; F319-P335 HydrophobicContact CZ-CG 4.25Å; V324-P335 HydrophobicContact CG2-CG 4.44Å; W327-P335 HydrophobicContact CD2-CG 4.36Å; W327-P335 HydrophobicContact CG-CG 4.17Å
336	L	90.9	Very high	86.9	Confident	89 Å²	89	64.2 Å²	64.2	47%	0.466	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-57.1	-177.1	-71.4	176.6	0	0	0	113.2	P298 H317 F319 C334	P298-L336 HydrophobicContact CB-CD1 4.35Å; P298-L336 HydrophobicContact CB-CD2 3.92Å; P298-L336 HydrophobicContact CB-CG 4.21Å; P298-L336 HydrophobicContact CG-CD1 3.71Å; P298-L336 HydrophobicContact CG-CD2 4.16Å; P298-L336 HydrophobicContact CG-CG 4.11Å; H317-L336 HydrophobicContact CB-CD1 4.04Å; H317-L336 WeakPolarHBondContact CD2-CD1 3.39Å; F319-L336 HydrophobicContact CE1-CD1 4.26Å; F319-L336 HydrophobicContact CE1-CG 4.19Å; F319-L336 HydrophobicContact CZ-CD1 3.88Å; F319-L336 HydrophobicContact CZ-CG 3.94Å; C334-L336 PolarHBondContact O-N 3.4Å; C334-L336 PolarHBondContact SG-N 3.39Å
337	C	92.1	Very high	85.6	Confident	58 Å²	58	66.9 Å²	66.9	39%	0.392	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.1	-0.7	-172	63.7	0	0	0	0	114.8	C334 L339	C334-C337 VanDerWaalsContact CB-SG 3.55Å; C334-C337 VanDerWaalsContact SG-SG 3.63Å; C337-L339 PolarHBondContact O-N 2.85Å; C337-L339 VanDerWaalsContact SG-CB 3.53Å
338	K	90	Very high	84	Confident	171 Å²	171	66.7 Å²	66.7	74%	0.743	35%	0.347	S	S	*	.			trans	57.8	12.8	-175.8	-54.8	-178.1	-179.4	-178.5	0	115.1	C334 D340	C334-K338 VanDerWaalsContact O-CA 3.26Å; C334-K338 WeakPolarHBondContact O-CA 3.25Å; C334-K338 PolarHBondContact O-N 3.35Å; K338-D340 PolarHBondContact O-N 2.87Å
339	L	89.8	Confident	82.6	Confident	72 Å²	72	71.2 Å²	71.2	38%	0.377	37%	0.367	S	S	.	.			trans	-62.1	124.3	173.7	-176.8	67.2	0	0	0	109.8	C315 T333 C334 C337 I341 A344	C315-L339 HydrophobicContact CB-CD2 3.8Å; T333-L339 WeakPolarHBondContact CA-O 3.02Å; C334-L339 PolarHBondContact N-O 3.35Å; C337-L339 PolarHBondContact O-N 2.85Å; C337-L339 VanDerWaalsContact SG-CB 3.53Å; L339-I341 PolarHBondContact O-N 2.99Å; L339-A344 HydrophobicContact CD2-CB 4.1Å; L339-A344 HydrophobicContact CG-CB 4.29Å
340	D	87.7	Confident	80.5	Confident	30 Å²	30	77.9 Å²	77.9	16%	0.16	39%	0.394	C	S	.	.	B	Isolated β-bridge	trans	-74.9	118.7	175.2	-176.8	-17.5	0	0	0	110	R332 T333 K338 L342 K343 A344	R332-D340 WeakPolarHBondContact O-CA 3.38Å; T333-D340 HydrophobicContact CG2-CB 4.36Å; K338-D340 PolarHBondContact O-N 2.87Å; D340-L342 VanDerWaalsContact C-N 3.26Å; D340-L342 PolarHBondContact O-N 3.04Å; D340-L342 WeakPolarHBondContact OD1-CB 3.48Å; D340-L342 PolarHBondContact OD1-N 3.26Å; D340-K343 HydrophobicContact CB-CB 4.07Å; D340-K343 HydrophobicContact CB-CD 4.04Å; D340-K343 HydrophobicContact CB-CG 3.99Å; D340-K343 PolarHBondContact O-N 2.66Å; D340-A344 WeakPolarHBondContact O-CB 3.49Å; D340-A344 PolarHBondContact O-N 2.88Å
341	I	85.1	Confident	78.7	Confident	6 Å²	6	73.4 Å²	73.4	3%	0.031	38%	0.377	C	S	.	.	H	α-helix	trans	-65.5	-29.4	-177.3	68.5	-176.9	0	0	0	112.4	T277 L278 L313 L328 R332 L339 I345	T277-I341 HydrophobicContact CG2-CB 4.07Å; T277-I341 HydrophobicContact CG2-CD1 3.93Å; T277-I341 HydrophobicContact CG2-CG1 3.76Å; L278-I341 HydrophobicContact CD2-CD1 4.02Å; L278-I341 HydrophobicContact CG-CD1 4.5Å; L313-I341 HydrophobicContact CD2-CG2 3.87Å; L328-I341 HydrophobicContact CB-CD1 4.13Å; L328-I341 HydrophobicContact CD2-CD1 4.22Å; L328-I341 HydrophobicContact CD2-CG2 4.02Å; R332-I341 HydrophobicContact CB-CG1 4.4Å; R332-I341 WeakPolarHBondContact O-CG1 3.1Å; R332-I341 PolarHBondContact O-N 3.36Å; L339-I341 PolarHBondContact O-N 2.99Å; I341-I345 PolarHBondContact O-N 3.37Å
342	L	83.8	Confident	76.4	Confident	6 Å²	6	73.1 Å²	73.1	3%	0.031	38%	0.384	C	S	.	.	H	α-helix	trans	-71.8	-43	178.1	-63	-177	0	0	0	110.3	L270 A273 T277 R332 D340 A344 I345 Y347	L270-L342 HydrophobicContact CD2-CD1 4.37Å; A273-L342 HydrophobicContact CB-CD1 4.24Å; A273-L342 HydrophobicContact CB-CD2 4.15Å; T277-L342 HydrophobicContact CG2-CD2 4.07Å; T277-L342 WeakPolarHBondContact OG1-CD2 3.38Å; R332-L342 HydrophobicContact CG-CD1 4.26Å; D340-L342 VanDerWaalsContact C-N 3.26Å; D340-L342 PolarHBondContact O-N 3.04Å; D340-L342 WeakPolarHBondContact OD1-CB 3.48Å; D340-L342 PolarHBondContact OD1-N 3.26Å; L342-A344 VanDerWaalsContact C-N 3.35Å; L342-I345 PolarHBondContact O-N 2.81Å; L342-Y347 WeakPolarHBondContact O-CB 3.33Å; L342-Y347 PolarHBondContact O-N 2.88Å
343	K	81.8	Confident	74.2	Confident	160 Å²	160	78.1 Å²	78.1	70%	0.696	41%	0.41	S	S	*	.	H	α-helix	trans	-64.5	-40.8	175.4	-68.1	-174.7	-175.9	-176.7	0	111.6	D340 I345 G346	D340-K343 HydrophobicContact CB-CB 4.07Å; D340-K343 HydrophobicContact CB-CD 4.04Å; D340-K343 HydrophobicContact CB-CG 3.99Å; D340-K343 PolarHBondContact O-N 2.66Å; K343-I345 VanDerWaalsContact C-N 3.28Å; K343-I345 PolarHBondContact O-N 2.77Å; K343-G346 PolarHBondContact O-N 3.18Å
344	A	77.7	Confident	71.9	Confident	44 Å²	44	83.5 Å²	83.5	36%	0.364	43%	0.432	S	S	.	.	H	α-helix	trans	-64.9	-27.9	-179.2	0	0	0	0	0	113.6	L314 L339 D340 L342 G346	L314-A344 HydrophobicContact CB-CB 4.37Å; L314-A344 HydrophobicContact CD1-CB 3.58Å; L339-A344 HydrophobicContact CD2-CB 4.1Å; L339-A344 HydrophobicContact CG-CB 4.29Å; D340-A344 WeakPolarHBondContact O-CB 3.49Å; D340-A344 PolarHBondContact O-N 2.88Å; L342-A344 VanDerWaalsContact C-N 3.35Å; A344-G346 VanDerWaalsContact C-N 3.26Å
345	I	74.4	Confident	69.4	Low	73 Å²	73	85.9 Å²	85.9	37%	0.374	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-5.9	172.8	-66.3	-172.3	0	0	0	112.3	T277 L314 I341 L342 K343	T277-I345 HydrophobicContact CG2-CD1 3.3Å; T277-I345 HydrophobicContact CG2-CG1 4.23Å; L314-I345 HydrophobicContact CD1-CD1 4.35Å; L314-I345 HydrophobicContact CD1-CG1 3.54Å; I341-I345 PolarHBondContact O-N 3.37Å; L342-I345 PolarHBondContact O-N 2.81Å; K343-I345 VanDerWaalsContact C-N 3.28Å; K343-I345 PolarHBondContact O-N 2.77Å
346	G	70.1	Confident	67.1	Low	51 Å²	51	87.5 Å²	87.5	53%	0.526	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.3	27.2	-173.7	0	0	0	0	0	112.6	K343 A344 T348	K343-G346 PolarHBondContact O-N 3.18Å; A344-G346 VanDerWaalsContact C-N 3.26Å; G346-T348 PolarHBondContact O-N 2.78Å
347	Y	65	Low	64.9	Low	132 Å²	132	93.6 Å²	93.6	52%	0.518	48%	0.475	S	S	.	.			trans	-70.4	81.3	171.2	-163.3	-93.4	0	0	0	109.3	A273 L342 F349	A273-Y347 HydrophobicContact CB-CE1 4.29Å; L342-Y347 WeakPolarHBondContact O-CB 3.33Å; L342-Y347 PolarHBondContact O-N 2.88Å; Y347-F349 PolarHBondContact O-N 2.86Å
348	T	58.3	Low	62.6	Low	99 Å²	99	97.1 Å²	97.1	61%	0.607	49%	0.49	S	S	*	.			trans	-70.7	122.7	169.4	54.4	0	0	0	0	108.2	G346 K350	G346-T348 PolarHBondContact O-N 2.78Å; T348-K350 VanDerWaalsContact C-N 3.28Å; T348-K350 PolarHBondContact O-N 2.67Å
349	F	59.3	Low	60.4	Low	95 Å²	95	92.3 Å²	92.3	42%	0.417	47%	0.472	S	S	.	.			trans	-67.8	87.8	173.3	-169	-107.4	0	0	0	108.6	L266 Y347 V351	L266-F349 HydrophobicContact CD1-CZ 4.46Å; Y347-F349 PolarHBondContact O-N 2.86Å; F349-V351 HydrophobicContact CD1-CG2 3.59Å; F349-V351 HydrophobicContact CE1-CG2 3.54Å; F349-V351 PolarHBondContact O-N 2.68Å; F349-V351 VanDerWaalsContact O-N 3.1Å
350	K	46.3	Very low	58.2	Low	179 Å²	179	95.1 Å²	95.1	78%	0.778	49%	0.492	S	S	*	.			trans	-68.3	105.8	161.2	-73.2	-173.8	178.1	-176.1	0	105.2	T348 S352	T348-K350 VanDerWaalsContact C-N 3.28Å; T348-K350 PolarHBondContact O-N 2.67Å; K350-S352 PolarHBondContact O-N 3.34Å
351	V	48.3	Very low	56	Low	49 Å²	49	95.9 Å²	95.9	30%	0.297	51%	0.507	S	S	.	.			trans	-60.2	88.6	160.8	-177	0	0	0	0	104.7	F349 E353 V356	F349-V351 HydrophobicContact CD1-CG2 3.59Å; F349-V351 HydrophobicContact CE1-CG2 3.54Å; F349-V351 PolarHBondContact O-N 2.68Å; F349-V351 VanDerWaalsContact O-N 3.1Å; V351-E353 PolarHBondContact O-N 3.03Å; V351-V356 HydrophobicContact CG1-CG2 3.82Å
352	S	40.6	Very low	53.9	Low	75 Å²	75	98.5 Å²	98.5	52%	0.524	53%	0.526	S	S	.	.			trans	-62	115.3	174.3	53.2	0	0	0	0	106	K350 E354 S355	K350-S352 PolarHBondContact O-N 3.34Å; S352-E354 PolarHBondContact O-N 3.46Å; S352-S355 PolarHBondContact O-N 3.49Å; S352-S355 VanDerWaalsContact O-N 3.09Å
353	E	41.5	Very low	52	Low	170 Å²	170	101.8 Å²	101.8	79%	0.794	55%	0.554	S	S	*	*	G	3₁₀ helix	trans	-48.9	-21.4	-176.6	-66.4	178.1	142.2	0	0	113.1	V351 S355 V356	V351-E353 PolarHBondContact O-N 3.03Å; E353-S355 PolarHBondContact O-N 3.02Å; E353-V356 PolarHBondContact O-N 3.09Å
354	E	42.9	Very low	50.1	Low	152 Å²	152	99.2 Å²	99.2	71%	0.71	55%	0.547	S	S	*	.	G	3₁₀ helix	trans	-56.8	-30.1	176.4	-149.6	63.5	-136.5	0	0	114.3	S352	S352-E354 PolarHBondContact O-N 3.46Å
355	S	39.1	Very low	48.1	Very low	51 Å²	51	98.6 Å²	98.6	36%	0.357	55%	0.545	S	S	.	.	G	3₁₀ helix	trans	-94.9	6.2	176.7	81.6	0	0	0	0	114.5	S352 E353	S352-S355 PolarHBondContact O-N 3.49Å; S352-S355 VanDerWaalsContact O-N 3.09Å; E353-S355 PolarHBondContact O-N 3.02Å
356	V	44.3	Very low	46.5	Very low	76 Å²	76	103 Å²	103	46%	0.461	56%	0.557	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.6	-16.9	178.2	-176	0	0	0	0	111.6	V351 E353 D358	V351-V356 HydrophobicContact CG1-CG2 3.82Å; E353-V356 PolarHBondContact O-N 3.09Å; V356-D358 VanDerWaalsContact C-N 3.27Å; V356-D358 PolarHBondContact O-N 2.85Å
357	R	44.4	Very low	45.3	Very low	216 Å²	216	104.3 Å²	104.3	82%	0.815	56%	0.558	S	S	*	*	S	Bend	trans	-66.8	-29.5	175.7	-79.6	-177.2	170.4	171.8	-2.4	113.3
358	D	43.6	Very low	44.1	Very low	132 Å²	132	101.5 Å²	101.5	71%	0.706	55%	0.552	S	S	*	*	S	Bend	trans	-114.5	69.1	179.8	-59.3	-19.9	0	0	0	110.6	V356	V356-D358 VanDerWaalsContact C-N 3.27Å; V356-D358 PolarHBondContact O-N 2.85Å
359	D	44.8	Very low	43.1	Very low	70 Å²	70	102 Å²	102	37%	0.374	55%	0.547	S	S	.	.			trans	165	137.9	142.7	-86.6	-43.8	0	0	0	111.9	R258 R265 G361	R258-D359 IonicContact CZ-OD1 3.48Å; R258-D359 IonicContact NE-OD1 2.65Å; R258-D359 IonicContact NH2-OD1 3.7Å; R258-D359 PolarHBondContact NH2-OD1 3.48Å; R265-D359 IonicContact CZ-OD2 3.04Å; R265-D359 IonicContact NH1-OD2 3.22Å; R265-D359 IonicContact NH2-OD2 2.91Å; R265-D359 PolarHBondContact NH2-OD2 2.91Å; D359-G361 PolarHBondContact O-N 3.03Å
360	V	43.4	Very low	42	Very low	132 Å²	132	100.4 Å²	100.4	80%	0.8	55%	0.551	S	S	*	*	S	Bend	trans	-71.8	43.4	-176.3	-174.3	0	0	0	0	111.7
361	G	41.5	Very low	41.5	Very low	45 Å²	45	95.3 Å²	95.3	46%	0.464	54%	0.542	S	S	.	.			trans	-108.7	17.2	-176.1	0	0	0	0	0	114.9	D359 A363 L364	D359-G361 PolarHBondContact O-N 3.03Å; G361-A363 PolarHBondContact O-N 3.2Å; G361-L364 PolarHBondContact O-N 3.48Å; G361-L364 VanDerWaalsContact O-N 3.08Å
362	S	41.6	Very low	41	Very low	61 Å²	61	97.8 Å²	97.8	43%	0.427	56%	0.557	S	S	.	*	H	α-helix	trans	-53.9	-26.6	-172.8	-174	0	0	0	0	114.4	R366	S362-R366 PolarHBondContact O-N 3.24Å; S362-R366 PolarHBondContact OG-NE 3.34Å; S362-R366 PolarHBondContact OG-NH2 3.2Å
363	A	43.9	Very low	40.8	Very low	75 Å²	75	98.5 Å²	98.5	62%	0.62	56%	0.558	S	S	*	*	H	α-helix	trans	-67.4	-40	178.1	0	0	0	0	0	113.1	G361 S367	G361-A363 PolarHBondContact O-N 3.2Å; A363-S367 PolarHBondContact O-N 3.09Å; A363-S367 PolarHBondContact O-OG 3.35Å
364	L	40.5	Very low	40.3	Very low	107 Å²	107	92.9 Å²	92.9	56%	0.56	55%	0.546	S	S	*	.	H	α-helix	trans	-75.5	-31.5	-179	-171.3	63.1	0	0	0	111.9	G361 S367 I368	G361-L364 PolarHBondContact O-N 3.48Å; G361-L364 VanDerWaalsContact O-N 3.08Å; L364-S367 PolarHBondContact O-N 3.04Å; L364-I368 PolarHBondContact O-N 3.5Å
365	G	36.8	Very low	39.9	Very low	31 Å²	31	93 Å²	93	32%	0.32	55%	0.551	S	S	.	*	H	α-helix	trans	-59.9	-45.5	174	0	0	0	0	0	112	S367 I368 E369	G365-S367 PolarHBondContact O-N 3.32Å; G365-I368 PolarHBondContact O-N 3.36Å; G365-E369 PolarHBondContact O-N 3.16Å
366	R	41.1	Very low	39.2	Very low	164 Å²	164	100.5 Å²	100.5	62%	0.619	57%	0.572	S	S	*	*	H	α-helix	trans	-65.4	-38.4	178.9	-71.7	-176.7	-126.9	154.1	-0.7	113.1	S362 I368 E369 A370	S362-R366 PolarHBondContact O-N 3.24Å; S362-R366 PolarHBondContact OG-NE 3.34Å; S362-R366 PolarHBondContact OG-NH2 3.2Å; R366-I368 PolarHBondContact O-N 3.41Å; R366-E369 PolarHBondContact O-N 3.32Å; R366-A370 WeakPolarHBondContact O-CB 3.39Å; R366-A370 PolarHBondContact O-N 3.48Å
367	S	43.2	Very low	38.3	Very low	79 Å²	79	105.1 Å²	105.1	55%	0.552	59%	0.588	S	S	*	*	H	α-helix	trans	-63.9	-30.2	177.8	-62.4	0	0	0	0	112.8	A363 L364 G365 A371	A363-S367 PolarHBondContact O-N 3.09Å; A363-S367 PolarHBondContact O-OG 3.35Å; L364-S367 PolarHBondContact O-N 3.04Å; G365-S367 PolarHBondContact O-N 3.32Å; S367-A371 PolarHBondContact O-N 3.34Å
368	I	41.7	Very low	37.5	Very low	74 Å²	74	100 Å²	100	38%	0.379	58%	0.582	S	S	.	*	H	α-helix	trans	-76.7	-41.1	176	-63.5	172.8	0	0	0	110.8	L364 G365 R366 A370 A371 V372	L364-I368 PolarHBondContact O-N 3.5Å; G365-I368 PolarHBondContact O-N 3.36Å; R366-I368 PolarHBondContact O-N 3.41Å; I368-A370 VanDerWaalsContact C-N 3.35Å; I368-A370 PolarHBondContact O-N 3.07Å; I368-A371 PolarHBondContact O-N 2.94Å; I368-V372 WeakPolarHBondContact O-CG2 3.3Å; I368-V372 PolarHBondContact O-N 3.27Å; I368-V372 VanDerWaalsContact O-N 3.12Å
369	E	36.1	Very low	36.6	Very low	110 Å²	110	102.7 Å²	102.7	51%	0.514	60%	0.596	S	S	.	*	H	α-helix	trans	-63.4	-38.7	175	-86.4	-176.3	148.6	0	0	113	G365 R366 A371 V372 T373	G365-E369 PolarHBondContact O-N 3.16Å; R366-E369 PolarHBondContact O-N 3.32Å; E369-A371 VanDerWaalsContact C-N 3.33Å; E369-A371 PolarHBondContact O-N 2.98Å; E369-V372 PolarHBondContact O-N 3.33Å; E369-V372 VanDerWaalsContact O-N 3.14Å; E369-T373 PolarHBondContact O-N 3.45Å; E369-T373 PolarHBondContact O-OG1 3.14Å
370	A	37.2	Very low	35.7	Very low	61 Å²	61	103.8 Å²	103.8	50%	0.504	62%	0.615	S	S	.	*	H	α-helix	trans	-61.7	-40.7	175.5	0	0	0	0	0	111.8	R366 I368 V372 T373 G374	R366-A370 WeakPolarHBondContact O-CB 3.39Å; R366-A370 PolarHBondContact O-N 3.48Å; I368-A370 VanDerWaalsContact C-N 3.35Å; I368-A370 PolarHBondContact O-N 3.07Å; A370-V372 VanDerWaalsContact C-N 3.29Å; A370-V372 PolarHBondContact O-N 2.67Å; A370-T373 PolarHBondContact O-N 2.92Å; A370-T373 PolarHBondContact O-OG1 2.84Å; A370-G374 PolarHBondContact O-N 3.36Å
371	A	35.5	Very low	34.9	Very low	71 Å²	71	103.6 Å²	103.6	59%	0.587	62%	0.619	S	S	*	*	H	α-helix	trans	-69	-26.3	176	0	0	0	0	0	113.2	S367 I368 E369	S367-A371 PolarHBondContact O-N 3.34Å; I368-A371 PolarHBondContact O-N 2.94Å; E369-A371 VanDerWaalsContact C-N 3.33Å; E369-A371 PolarHBondContact O-N 2.98Å
372	V	37.3	Very low	34	Very low	101 Å²	101	104.6 Å²	104.6	61%	0.612	63%	0.629	S	S	*	*	H	α-helix	trans	-80.5	-32.1	177.5	173.3	0	0	0	0	111.8	I368 E369 A370	I368-V372 WeakPolarHBondContact O-CG2 3.3Å; I368-V372 PolarHBondContact O-N 3.27Å; I368-V372 VanDerWaalsContact O-N 3.12Å; E369-V372 PolarHBondContact O-N 3.33Å; E369-V372 VanDerWaalsContact O-N 3.14Å; A370-V372 VanDerWaalsContact C-N 3.29Å; A370-V372 PolarHBondContact O-N 2.67Å
373	T	36.2	Very low	33.3	Very low	90 Å²	90	107 Å²	107	55%	0.552	65%	0.646	S	S	*	*	H	α-helix	trans	-85.1	-27.5	179.9	37.5	0	0	0	0	113.6	E369 A370 L375 R376	E369-T373 PolarHBondContact O-N 3.45Å; E369-T373 PolarHBondContact O-OG1 3.14Å; A370-T373 PolarHBondContact O-N 2.92Å; A370-T373 PolarHBondContact O-OG1 2.84Å; T373-L375 PolarHBondContact O-N 3.13Å; T373-R376 PolarHBondContact O-N 2.97Å
374	G	31	Very low	32.3	Very low	52 Å²	52	110.6 Å²	110.6	54%	0.536	66%	0.655	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.3	-2.1	-176.7	0	0	0	0	0	117.4	A370	A370-G374 PolarHBondContact O-N 3.36Å
375	L	33.9	Very low	31.6	Very low	156 Å²	156	115.3 Å²	115.3	82%	0.817	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.9	12.7	178.6	-75.5	167.9	0	0	0	114.3	T373 H377	T373-L375 PolarHBondContact O-N 3.13Å; L375-H377 PolarHBondContact O-N 3.39Å
376	R	26.1	Very low	31.1	Very low	208 Å²	208	122 Å²	122	79%	0.785	69%	0.694	S	S	*	*			trans	-85.5	84.1	163.9	-81	-177.4	174.1	158.1	-2.1	109.2	T373 P378	T373-R376 PolarHBondContact O-N 2.97Å; R376-P378 WeakPolarHBondContact O-CD 3.45Å
377	H	23.9	Very low	30.2	Very low	172 Å²	172	122 Å²	122	80%	0.796	71%	0.706	S	S	*	*			trans	-94.2	108.7	156.4	-77.7	-66.4	0	0	0	108.5	L375	L375-H377 PolarHBondContact O-N 3.39Å
378	P	29	Very low	29.6	Very low	109 Å²	109	123.1 Å²	123.1	71%	0.708	71%	0.714	S	S	*	*			trans	-73	127.9	160.2	-6.6	24.7	0	0	0	108.2	R376 A380	R376-P378 WeakPolarHBondContact O-CD 3.45Å; P378-A380 VanDerWaalsContact C-N 3.26Å; P378-A380 PolarHBondContact O-N 3.43Å
379	L	24.1	Very low	28.9	Very low	188 Å²	188	128.8 Å²	128.8	98%	0.984	74%	0.737	S	S	*	*			trans	-64.8	87	166.5	-69.1	166.1	0	0	0	108.1
380	A	26.6	Very low	28.4	Very low	94 Å²	94	133.1 Å²	133.1	78%	0.777	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-102	123.7	173.7	0	0	0	0	0	109.5	P378	P378-A380 VanDerWaalsContact C-N 3.26Å; P378-A380 PolarHBondContact O-N 3.43Å
381	S	25.9	Very low	28	Very low	127 Å²	127	135.4 Å²	135.4	89%	0.888	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-61.2	155.9	-172.7	-163.6	0	0	0	0	113.6
382	G	21.7	Very low	27.5	Very low	66 Å²	66	138.2 Å²	138.2	68%	0.68	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-51.3	150.8	-167.3	0	0	0	0	0	118.1
383	S	27.1	Very low	27.1	Very low	112 Å²	112	139.1 Å²	139.1	78%	0.783	78%	0.782	S	S	*	*				-177.5	116.1	123.6	30.7	0	0	0	0	109.6
384	D	22.7	Very low	26.7	Very low	150 Å²	150	141.1 Å²	141.1	80%	0.802	79%	0.794	S	S	*	*			trans	21.1	106.3	144.4	-53	-33.1	0	0	0	118.2
385	F	26.7	Very low	26.7	Very low	206 Å²	206	144.6 Å²	144.6	90%	0.904	81%	0.807	S	S	*	*			trans	-156.1	101.2	143.6	-113.3	-81	0	0	0	111.5
386	H	26.5	Very low	26.5	Very low	172 Å²	172	142.2 Å²	142.2	80%	0.796	80%	0.803	S	S	*	*			trans	36.3	105.6	150.9	-104.9	-89.4	0	0	0	120.7
387	D	22.5	Very low	27	Very low	164 Å²	164	137.9 Å²	137.9	88%	0.877	80%	0.802	S	S	*	*			trans	-52.3	128.9	156.7	-82.2	-49.7	0	0	0	112.7
388	S	30.7	Very low	27.3	Very low	103 Å²	103	135.1 Å²	135.1	72%	0.72	80%	0.8	S	S	*	*			trans	-142.4	93.4	159.5	4.6	0	0	0	0	111
389	F	26.3	Very low	27.5	Very low	193 Å²	193	135.6 Å²	135.6	85%	0.846	80%	0.803	S	S	*	*			trans	47.4	83.6	132.4	-123.9	-95.4	0	0	0	118.4
390	F	26.3	Very low	27.9	Very low	200 Å²	200	133.3 Å²	133.3	88%	0.877	80%	0.796	S	S	*	*			trans	-136.1	121.5	145.6	-86.1	-78.4	0	0	0	109.7	T392	F390-T392 PolarHBondContact O-N 3.17Å
391	P	27.2	Very low	28	Very low	109 Å²	109	137.4 Å²	137.4	71%	0.708	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-74.4	117.4	178	5.5	9.1	0	0	0	109.2	P393	P391-P393 WeakPolarHBondContact O-CD 3.28Å
392	T	25.5	Very low	28.1	Very low	130 Å²	130	139.7 Å²	139.7	80%	0.798	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-65.4	122.7	167.5	21.6	0	0	0	0	109.5	F390 T394	F390-T392 PolarHBondContact O-N 3.17Å; T392-T394 PolarHBondContact O-N 2.75Å
393	P	30	Very low	28.4	Very low	121 Å²	121	143 Å²	143	79%	0.786	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-68.6	116.6	171.5	25.8	-29	0	0	0	108.7	P391	P391-P393 WeakPolarHBondContact O-CD 3.28Å
394	T	27.5	Very low	28.4	Very low	131 Å²	131	145.5 Å²	145.5	80%	0.804	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-56.5	122.8	172.8	40.6	0	0	0	0	110.2	T392 S396	T392-T394 PolarHBondContact O-N 2.75Å; T394-S396 PolarHBondContact O-N 3.49Å
395	P	30.1	Very low	28.6	Very low	126 Å²	126	148.3 Å²	148.3	82%	0.818	81%	0.806	S	S	*	*			trans	-71.1	112.4	175	26.6	-29.8	0	0	0	109.1
396	S	30.7	Very low	28.7	Very low	105 Å²	105	144.1 Å²	144.1	73%	0.734	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-59.7	136.2	169.2	51.7	0	0	0	0	110.1	T394	T394-S396 PolarHBondContact O-N 3.49Å
397	P	35.1	Very low	28.9	Very low	117 Å²	117	143.7 Å²	143.7	76%	0.76	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-64	141.4	-177.2	24.4	-32.5	0	0	0	111.8
398	P	31.4	Very low	29.2	Very low	115 Å²	115	143.3 Å²	143.3	75%	0.747	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-64.8	144.5	177.9	26.1	-32.6	0	0	0	111.2
399	P	32.8	Very low	29.2	Very low	119 Å²	119	144 Å²	144	77%	0.773	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-65.9	136.8	-177.6	26.2	-32.1	0	0	0	111	Q401	P399-Q401 PolarHBondContact O-N 3.31Å
400	V	32.3	Very low	29.5	Very low	139 Å²	139	143 Å²	143	84%	0.842	79%	0.793	S	S	*	*			trans	-61.4	99.4	177.5	178.1	0	0	0	0	109	Q402	V400-Q402 PolarHBondContact O-N 3.35Å; V400-Q402 VanDerWaalsContact O-N 3.12Å
401	Q	28.8	Very low	29.6	Very low	181 Å²	181	139.2 Å²	139.2	85%	0.846	79%	0.79	S	S	*	*			trans	-74.1	105.3	175.4	-162.9	149.3	-24	0	0	108.2	P399 V403	P399-Q401 PolarHBondContact O-N 3.31Å; Q401-V403 PolarHBondContact O-N 2.88Å
402	Q	28.3	Very low	29.7	Very low	174 Å²	174	143.5 Å²	143.5	81%	0.813	79%	0.794	S	S	*	*			trans	-53.5	122	177.3	-74.2	177	-64.6	0	0	109.5	V400 L404	V400-Q402 PolarHBondContact O-N 3.35Å; V400-Q402 VanDerWaalsContact O-N 3.12Å; Q402-L404 PolarHBondContact O-N 2.98Å
403	V	29.2	Very low	29.7	Very low	135 Å²	135	143 Å²	143	82%	0.818	79%	0.79	S	S	*	*			trans	-59.2	100	174	177	0	0	0	0	107.7	Q401 R405	Q401-V403 PolarHBondContact O-N 2.88Å; V403-R405 PolarHBondContact O-N 3.43Å
404	L	25.8	Very low	29.6	Very low	165 Å²	165	144.6 Å²	144.6	86%	0.864	79%	0.791	S	S	*	*			trans	-64.5	109.8	174.9	-143.5	80.7	0	0	0	107.2	Q402	Q402-L404 PolarHBondContact O-N 2.98Å
405	R	27	Very low	29.6	Very low	210 Å²	210	145 Å²	145	79%	0.792	79%	0.787	S	S	*	*			trans	-62.9	131.4	174.4	-83.6	179.4	175.4	138.1	-2	108.6	V403 Q407	V403-R405 PolarHBondContact O-N 3.43Å; R405-Q407 PolarHBondContact O-N 3.37Å
406	P	29.3	Very low	29.4	Very low	117 Å²	117	144.1 Å²	144.1	76%	0.76	78%	0.781	S	S	*	*			trans	-73.8	98.5	178.5	27.5	-29.7	0	0	0	108.7
407	Q	31.5	Very low	29.3	Very low	164 Å²	164	147.6 Å²	147.6	77%	0.766	79%	0.787	S	S	*	*			trans	-119.7	-15.6	171.6	-77.7	-167.8	-26.2	0	0	115.9	R405	R405-Q407 PolarHBondContact O-N 3.37Å
408	D	28.4	Very low	29	Very low	155 Å²	155	147.8 Å²	147.8	83%	0.829	79%	0.787	S	S	*	*	S	Bend	trans	-133.8	22.8	-174	-66.3	-48.4	0	0	0	116.6	H410	D408-H410 PolarHBondContact O-N 3.1Å
409	T	29.1	Very low	28.9	Very low	118 Å²	118	148.5 Å²	148.5	72%	0.724	79%	0.789	S	S	*	*			trans	-93.1	99.8	170.2	57	0	0	0	0	109.8	C411	T409-C411 PolarHBondContact O-N 2.81Å
410	H	33.9	Very low	28.8	Very low	173 Å²	173	151.1 Å²	151.1	80%	0.801	79%	0.79	S	S	*	*			trans	-38.2	108.4	170.1	-81.3	-90.5	0	0	0	110.9	D408 Y412	D408-H410 PolarHBondContact O-N 3.1Å; H410-Y412 WeakPolarHBondContact O-CD1 3.27Å; H410-Y412 WeakPolarHBondContact O-CE1 3.49Å; H410-Y412 PolarHBondContact O-N 3.24Å
411	C	27.6	Very low	28.5	Very low	120 Å²	120	149.9 Å²	149.9	81%	0.811	79%	0.788	S	S	*	*			trans	-65.4	102.9	-177.5	-157.3	0	0	0	0	108.9	T409 T413	T409-C411 PolarHBondContact O-N 2.81Å; C411-T413 PolarHBondContact O-N 3.2Å
412	Y	30.7	Very low	28.4	Very low	199 Å²	199	146.7 Å²	146.7	78%	0.78	79%	0.785	S	S	*	*			trans	-86.5	103.8	165.8	26.3	-90.3	0	0	0	108.5	H410 I414	H410-Y412 WeakPolarHBondContact O-CD1 3.27Å; H410-Y412 WeakPolarHBondContact O-CE1 3.49Å; H410-Y412 PolarHBondContact O-N 3.24Å; Y412-I414 PolarHBondContact O-N 3.28Å
413	T	25.3	Very low	28.3	Very low	119 Å²	119	144.2 Å²	144.2	73%	0.73	79%	0.787	S	S	*	*			trans	-71.1	111.8	174.3	-14.1	0	0	0	0	109.2	C411 I415	C411-T413 PolarHBondContact O-N 3.2Å; T413-I415 PolarHBondContact O-N 2.69Å
414	I	27.4	Very low	28.3	Very low	154 Å²	154	143.2 Å²	143.2	79%	0.79	79%	0.786	S	S	*	*			trans	-76.2	101.8	171.2	-59.1	174.8	0	0	0	107.3	Y412 P416	Y412-I414 PolarHBondContact O-N 3.28Å; I414-P416 WeakPolarHBondContact O-CD 3.08Å
415	I	27.5	Very low	28.4	Very low	141 Å²	141	140.3 Å²	140.3	72%	0.723	78%	0.78	S	S	*	*			trans	-80.5	115.8	173.9	-58.9	174.4	0	0	0	108.1	T413 M417	T413-I415 PolarHBondContact O-N 2.69Å; I415-M417 PolarHBondContact O-N 2.99Å
416	P	26.6	Very low	28.4	Very low	106 Å²	106	142 Å²	142	69%	0.688	79%	0.786	S	S	*	*			trans	-71.6	115.9	176.4	27.4	-30.7	0	0	0	109.8	I414 T418	I414-P416 WeakPolarHBondContact O-CD 3.08Å; P416-T418 PolarHBondContact O-N 2.86Å
417	M	26.8	Very low	28.5	Very low	178 Å²	178	141.3 Å²	141.3	88%	0.877	79%	0.79	S	S	*	*			trans	-72.7	108.5	173.2	-67.4	-171.6	-68.1	0	0	109.7	I415 V419	I415-M417 PolarHBondContact O-N 2.99Å; M417-V419 PolarHBondContact O-N 2.84Å
418	T	29.8	Very low	28.5	Very low	122 Å²	122	143.2 Å²	143.2	75%	0.748	80%	0.796	S	S	*	*			trans	-68.4	112.6	175.6	-40.4	0	0	0	0	109.9	P416 H420	P416-T418 PolarHBondContact O-N 2.86Å; T418-H420 PolarHBondContact O-N 3.24Å
419	V	29.1	Very low	28.4	Very low	130 Å²	130	147 Å²	147	79%	0.788	80%	0.798	S	S	*	*			trans	-76.2	109.7	178.1	-176.8	0	0	0	0	109	M417 S421	M417-V419 PolarHBondContact O-N 2.84Å; V419-S421 PolarHBondContact O-N 3.14Å
420	H	30.2	Very low	28.5	Very low	174 Å²	174	150.7 Å²	150.7	81%	0.806	81%	0.807	S	S	*	*			trans	-71.7	104.4	169.3	-78	-89.7	0	0	0	109.5	T418 S422	T418-H420 PolarHBondContact O-N 3.24Å; H420-S422 PolarHBondContact O-N 2.92Å
421	S	26.6	Very low	28.2	Very low	112 Å²	112	153.1 Å²	153.1	78%	0.783	82%	0.815	S	S	*	*			trans	-77.7	94.9	168.8	57.2	0	0	0	0	109.6	V419 S423	V419-S421 PolarHBondContact O-N 3.14Å; S421-S423 PolarHBondContact O-N 2.98Å
422	S	26.3	Very low	28.3	Very low	114 Å²	114	150.4 Å²	150.4	80%	0.797	81%	0.808	S	S	*	*			trans	-81.7	104.5	168.6	51.5	0	0	0	0	109.7	H420 S424	H420-S422 PolarHBondContact O-N 2.92Å; S422-S424 PolarHBondContact O-N 3.18Å; S422-S424 VanDerWaalsContact O-N 3.08Å
423	S	25.6	Very low	28.4	Very low	122 Å²	122	148.3 Å²	148.3	85%	0.853	82%	0.815	S	S	*	*			trans	-72.8	90.8	171.9	54.8	0	0	0	0	109.9	S421	S421-S423 PolarHBondContact O-N 2.98Å
424	S	29.6	Very low	28.6	Very low	114 Å²	114	151.5 Å²	151.5	80%	0.797	82%	0.822	S	S	*	*			trans	-89.6	121	171.1	-174.3	0	0	0	0	110.7	S422	S422-S424 PolarHBondContact O-N 3.18Å; S422-S424 VanDerWaalsContact O-N 3.08Å
425	S	28.7	Very low	28.8	Very low	104 Å²	104	149.1 Å²	149.1	73%	0.727	82%	0.819	S	S	*	*			trans	-74.4	122.8	-178.8	53	0	0	0	0	112.5
426	R	25.9	Very low	29	Very low	247 Å²	247	150.1 Å²	150.1	93%	0.932	83%	0.825	S	S	*	*				53.7	88.6	129.5	-160.8	177	-166.7	169.6	3	116.7
427	A	32.3	Very low	29.2	Very low	101 Å²	101	149 Å²	149	84%	0.835	82%	0.824	S	S	*	*			trans	-143.5	117.4	151.4	0	0	0	0	0	112.4
428	K	30.8	Very low	29.5	Very low	204 Å²	204	145.7 Å²	145.7	89%	0.887	82%	0.815	S	S	*	*			trans	-7.4	125.7	163.2	-69.6	167.5	176.5	172.8	0	118.9
429	R	26.4	Very low	29.6	Very low	236 Å²	236	145.2 Å²	145.2	89%	0.891	81%	0.811	S	S	*	*				63.8	95.5	119.8	-163.1	178.3	-174	166.1	0.6	117.4
430	Q	30.7	Very low	29.7	Very low	194 Å²	194	147.4 Å²	147.4	91%	0.907	82%	0.817	S	S	*	*				-171.5	139.6	125.4	-107.5	168.3	-11.6	0	0	111.7	G432	Q430-G432 PolarHBondContact O-N 2.95Å
431	K	28.4	Very low	29.6	Very low	224 Å²	224	143.6 Å²	143.6	97%	0.974	81%	0.809	S	S	*	*			trans	-69.7	118.5	176.5	-66.8	175.1	175.7	-179.3	0	108.7
432	G	29.5	Very low	29.9	Very low	63 Å²	63	144.5 Å²	144.5	65%	0.649	80%	0.804	S	S	*	*			trans	-156.3	111.3	171.1	0	0	0	0	0	108.8	Q430 Q434	Q430-G432 PolarHBondContact O-N 2.95Å; G432-Q434 PolarHBondContact O-N 2.82Å
433	V	32	Very low	30.1	Very low	155 Å²	155	147.6 Å²	147.6	94%	0.939	81%	0.811	S	S	*	*			trans	-63.3	100.1	178.8	178	0	0	0	0	108.1
434	Q	31.4	Very low	30.6	Very low	186 Å²	186	146.2 Å²	146.2	87%	0.869	80%	0.797	S	S	*	*			trans	-94.3	111.6	171.2	-75	-167.9	-5.5	0	0	109.4	G432 L436	G432-Q434 PolarHBondContact O-N 2.82Å; Q434-L436 PolarHBondContact O-N 2.95Å
435	S	31.2	Very low	30.8	Very low	104 Å²	104	145.7 Å²	145.7	73%	0.727	80%	0.8	S	S	*	*			trans	-34.8	122.1	168.7	-177.6	0	0	0	0	112.8	A437	S435-A437 PolarHBondContact O-N 2.99Å
436	L	30.8	Very low	31.2	Very low	162 Å²	162	148.9 Å²	148.9	85%	0.848	80%	0.803	S	S	*	*			trans	-75.7	70.7	172.2	-123.6	112.3	0	0	0	109.1	Q434 T438	Q434-L436 PolarHBondContact O-N 2.95Å; L436-T438 PolarHBondContact O-N 3.1Å; L436-T438 VanDerWaalsContact O-N 3.15Å
437	A	30.7	Very low	31.6	Very low	82 Å²	82	144.6 Å²	144.6	68%	0.678	80%	0.799	S	S	*	*			trans	-84.2	66.7	170.7	0	0	0	0	0	109.4	S435 V439	S435-A437 PolarHBondContact O-N 2.99Å; A437-V439 PolarHBondContact O-N 3.19Å
438	T	32.7	Very low	31.7	Very low	109 Å²	109	145.5 Å²	145.5	67%	0.669	80%	0.798	S	S	*	*			trans	-95	80.5	174.5	-38.6	0	0	0	0	109.5	L436 I440	L436-T438 PolarHBondContact O-N 3.1Å; L436-T438 VanDerWaalsContact O-N 3.15Å; T438-I440 PolarHBondContact O-N 3.11Å
439	V	33.5	Very low	31.8	Very low	112 Å²	112	146.1 Å²	146.1	68%	0.679	80%	0.795	S	S	*	*			trans	31.5	83.3	140.2	-169.5	0	0	0	0	115.4	A437 C441	A437-V439 PolarHBondContact O-N 3.19Å; V439-C441 VanDerWaalsContact C-N 3.27Å; V439-C441 HydrophobicContact CG1-CB 3.78Å; V439-C441 WeakPolarHBondContact CG1-SG 3.23Å; V439-C441 PolarHBondContact O-N 2.89Å; V439-C441 VanDerWaalsContact O-N 3.13Å
440	I	30.7	Very low	32.2	Very low	176 Å²	176	141 Å²	141	90%	0.903	79%	0.793	S	S	*	*			trans	-76.2	83.1	157.3	-59.9	171.6	0	0	0	106.3	T438	T438-I440 PolarHBondContact O-N 3.11Å
441	C	28.9	Very low	32.2	Very low	95 Å²	95	138.9 Å²	138.9	64%	0.642	79%	0.788	S	S	*	*			trans	-91.6	105.2	174.7	-100.7	0	0	0	0	110.8	V439	V439-C441 VanDerWaalsContact C-N 3.27Å; V439-C441 HydrophobicContact CG1-CB 3.78Å; V439-C441 WeakPolarHBondContact CG1-SG 3.23Å; V439-C441 PolarHBondContact O-N 2.89Å; V439-C441 VanDerWaalsContact O-N 3.13Å
442	L	32.7	Very low	32.2	Very low	131 Å²	131	135.7 Å²	135.7	69%	0.686	82%	0.819	S	S	*	*			trans	61.9	71.3	131.2	-61.2	162.7	0	0	0	117.2	T444	L442-T444 HydrophobicContact CD2-CG2 4.25Å; L442-T444 PolarHBondContact O-N 2.69Å
443	L	30.6	Very low	32.4	Very low	179 Å²	179	139.3 Å²	139.3	94%	0.937	83%	0.827	S	S	*	*			trans	-79.9	65.5	144.2	-85.6	159.3	0	0	0	109.1
444	T	34.5	Very low	32.4	Very low	92 Å²	92	138.5 Å²	138.5	56%	0.564	82%	0.821	S	S	*	*			trans	-115	62.4	165.4	55	0	0	0	0	108	L442 Q446	L442-T444 HydrophobicContact CD2-CG2 4.25Å; L442-T444 PolarHBondContact O-N 2.69Å; T444-Q446 PolarHBondContact O-N 2.81Å
445	A	35.5	Very low	32.4	Very low	103 Å²	103	135.8 Å²	135.8	85%	0.851	82%	0.819	S	S	*	*			trans	-71.1	90.8	162.5	0	0	0	0	0	106.7
446	Q	35.7	Very low	32.5	Very low	172 Å²	172	137.7 Å²	137.7	80%	0.804	82%	0.824	S	S	*	*			trans	-53.1	137.3	176.5	-78.7	162.1	-41.8	0	0	110.7	T444 C448	T444-Q446 PolarHBondContact O-N 2.81Å; Q446-C448 PolarHBondContact O-N 3.08Å
447	N	34.5	Very low	32.6	Very low	156 Å²	156	136.2 Å²	136.2	83%	0.834	82%	0.823	S	S	*	*			trans	-37.4	94	159	-80.2	-32.9	0	0	0	112.2	R449	N447-R449 VanDerWaalsContact C-N 3.32Å; N447-R449 PolarHBondContact O-N 3.08Å; N447-R449 VanDerWaalsContact O-N 3.1Å
448	C	34	Very low	32.7	Very low	121 Å²	121	139.8 Å²	139.8	82%	0.818	83%	0.832	S	S	*	*			trans	-75	92.5	156.8	-73.7	0	0	0	0	107.4	Q446 C450	Q446-C448 PolarHBondContact O-N 3.08Å; C448-C450 PolarHBondContact O-N 3.35Å
449	R	34.5	Very low	32.7	Very low	217 Å²	217	142 Å²	142	82%	0.819	84%	0.844	S	S	*	*			trans	-68.2	108.2	163.9	-84.9	-176.1	177.7	-164.3	-1	108.1	N447 N451	N447-R449 VanDerWaalsContact C-N 3.32Å; N447-R449 PolarHBondContact O-N 3.08Å; N447-R449 VanDerWaalsContact O-N 3.1Å; R449-N451 PolarHBondContact O-N 3.48Å
450	C	33.1	Very low	32.7	Very low	128 Å²	128	144.3 Å²	144.3	87%	0.865	86%	0.857	S	S	*	*			trans	-65.7	105.6	161.9	-59.3	0	0	0	0	108	C448	C448-C450 PolarHBondContact O-N 3.35Å
451	N	31.1	Very low	32.9	Very low	149 Å²	149	141.7 Å²	141.7	80%	0.797	85%	0.853	S	S	*	*			trans	-113.5	118.1	168.4	-109.4	7.7	0	0	0	107.4	R449	R449-N451 PolarHBondContact O-N 3.48Å
452	G	29.5	Very low	33.2	Very low	157 Å²	157	145.9 Å²	145.9	100%	1.619	87%	0.872	S	S	*	*			trans	62.2	0	153.5	0	0	0	0	0	117.2

Retrieved 452 of 452 residues in 89.8 ms (Link to these results)

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