C4QU02_SCHMA Loading...

Small ribosomal subunit protein uS9

AlphaFold DB , UniProt , Accession C4QU02, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 151 aa.

						>C4QU02_SCHMA|C4QU02
MQTVCNQPKEKPKAVQVFGRKKTATAVAHCKLGSGTIRVNGRPLDVLEPRPLLPKLMEPILLLGKHGLSNLDIRVRVSGGGRVAQIYAVRQAIAKSVVAFHQKYVDECSKNMIKEKFVQYDRSLLVADPRRCEPKKFGGSGARARYQKSYR
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	51.6	Low	63.7	Low	242 Å²	242	165.4 Å²	165.4	100%	1.192	85%	0.852	S	S	*	*				0	103.3	0	-70.3	172.4	169.4	0	0	107.6	T3	M1-T3 PolarHBondContact O-N 3.19Å
2	Q	46.4	Very low	65.4	Low	193 Å²	193	160.4 Å²	160.4	90%	0.902	84%	0.838	S	S	*	*			trans	-78.3	108	177.3	-75.3	176.7	-5.7	0	0	108.7	V4	Q2-V4 PolarHBondContact O-N 2.62Å; Q2-V4 VanDerWaalsContact O-N 3.1Å
3	T	55.2	Low	67.3	Low	138 Å²	138	158.2 Å²	158.2	85%	0.847	82%	0.818	S	S	*	*			trans	-65.7	101.8	168.1	8.5	0	0	0	0	108.2	M1 C5	M1-T3 PolarHBondContact O-N 3.19Å; T3-C5 PolarHBondContact O-N 2.75Å
4	V	60.7	Low	69.1	Low	137 Å²	137	148.1 Å²	148.1	83%	0.83	77%	0.769	S	S	*	*			trans	-68.9	98.3	171.8	-161.4	0	0	0	0	106.8	Q2 N6	Q2-V4 PolarHBondContact O-N 2.62Å; Q2-V4 VanDerWaalsContact O-N 3.1Å; V4-N6 PolarHBondContact O-N 3.18Å
5	C	57.1	Low	71	Confident	110 Å²	110	139.2 Å²	139.2	74%	0.743	72%	0.724	S	S	*	*			trans	-65.2	105.2	178.8	-152.8	0	0	0	0	108.2	T3 Q7	T3-C5 PolarHBondContact O-N 2.75Å; C5-Q7 PolarHBondContact O-N 3.39Å
6	N	66.6	Low	72.6	Confident	152 Å²	152	139.3 Å²	139.3	81%	0.813	72%	0.72	S	S	*	*			trans	-75.1	88.3	-176.4	-151.3	6.5	0	0	0	108.4	V4	V4-N6 PolarHBondContact O-N 3.18Å
7	Q	64.9	Low	74.1	Confident	152 Å²	152	132.4 Å²	132.4	71%	0.71	69%	0.685	S	S	*	*			trans	-58.1	134.4	176.6	-69.4	-89.5	-13.7	0	0	109.6	C5 K9	C5-Q7 PolarHBondContact O-N 3.39Å; Q7-K9 PolarHBondContact O-N 2.86Å; Q7-K9 VanDerWaalsContact O-N 3.1Å
8	P	67.6	Low	75.4	Confident	116 Å²	116	131.8 Å²	131.8	75%	0.753	68%	0.676	S	S	*	*			trans	-64.5	115.8	-178.8	26.1	-31.8	0	0	0	109.4	E10	P8-E10 PolarHBondContact O-N 3.19Å
9	K	71.9	Confident	76.6	Confident	193 Å²	193	124.8 Å²	124.8	84%	0.839	64%	0.641	S	S	*	*	P	Polyproline II helix	trans	-60.6	122.3	177.2	-70.9	-178.8	179	176.8	0	109.8	Q7 K11	Q7-K9 PolarHBondContact O-N 2.86Å; Q7-K9 VanDerWaalsContact O-N 3.1Å; K9-K11 PolarHBondContact O-N 3.34Å
10	E	76.7	Confident	77.6	Confident	188 Å²	188	124.2 Å²	124.2	88%	0.879	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-55.8	130.3	174.1	-74	-169.8	153.4	0	0	110.5	P8	P8-E10 PolarHBondContact O-N 3.19Å
11	K	81.8	Confident	78.5	Confident	198 Å²	198	120 Å²	120	86%	0.861	61%	0.608	S	S	*	*	P	Polyproline II helix	trans	-68	124.9	179.7	-67.4	180	-176.9	175.3	0	108.4	K9 K13	K9-K11 PolarHBondContact O-N 3.34Å; K11-K13 PolarHBondContact O-N 2.83Å
12	P	83.8	Confident	80.6	Confident	106 Å²	106	114.3 Å²	114.3	69%	0.688	58%	0.576	S	S	*	*	P	Polyproline II helix	trans	-60.4	136.6	178.8	23.9	-32.3	0	0	0	109.9	A14	P12-A14 VanDerWaalsContact C-N 3.26Å; P12-A14 PolarHBondContact O-N 3.43Å
13	K	90.1	Very high	83	Confident	132 Å²	132	109.6 Å²	109.6	57%	0.574	56%	0.561	S	S	*	*	S	Bend	trans	-67.2	88.4	172.9	-68.3	-175.1	-177.3	179.4	0	109.1	K11 L32 Y104	K11-K13 PolarHBondContact O-N 2.83Å; K13-L32 HydrophobicContact CB-CD1 4.08Å; K13-L32 HydrophobicContact CD-CD1 3.99Å; K13-Y104 WeakPolarHBondContact CA-OH 3.37Å; K13-Y104 HydrophobicContact CB-CD1 4.39Å; K13-Y104 HydrophobicContact CB-CE1 3.93Å; K13-Y104 HydrophobicContact CB-CE2 4.3Å; K13-Y104 HydrophobicContact CD-CD1 4.23Å; K13-Y104 HydrophobicContact CD-CE1 4.31Å; K13-Y104 HydrophobicContact CG-CD1 4.24Å; K13-Y104 HydrophobicContact CG-CE1 3.82Å
14	A	93.8	Very high	85	Confident	16 Å²	16	103 Å²	103	13%	0.132	52%	0.52	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	152.1	-175.9	0	0	0	0	0	111.6	P12 C30 K31 Y104	P12-A14 VanDerWaalsContact C-N 3.26Å; P12-A14 PolarHBondContact O-N 3.43Å; A14-C30 CarbonylContact C-O 3.57Å; A14-C30 WeakPolarHBondContact CA-O 3.37Å; A14-C30 WeakPolarHBondContact CB-O 3.45Å; A14-K31 HydrophobicContact CB-CB 4.45Å; A14-Y104 PolarHBondContact N-OH 3.25Å; A14-Y104 PolarHBondContact O-OH 3.41Å
15	V	96.2	Very high	86.7	Confident	15 Å²	15	98.4 Å²	98.4	9%	0.091	49%	0.492	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	136.4	175.9	-171.4	0	0	0	0	109.1	V17 C30 A99 F100 K103 Y104	V15-V17 HydrophobicContact CG1-CG1 4.08Å; V15-C30 PolarHBondContact N-O 2.97Å; V15-C30 PolarHBondContact O-N 3.22Å; V15-A99 HydrophobicContact CG1-CB 3.61Å; V15-F100 HydrophobicContact CG2-CB 4.37Å; V15-F100 HydrophobicContact CG2-CD2 4.12Å; V15-K103 HydrophobicContact CG2-CD 4.17Å; V15-Y104 HydrophobicContact CG2-CD2 4.14Å; V15-Y104 HydrophobicContact CG2-CE2 3.61Å
16	Q	97.3	Very high	88.7	Confident	141 Å²	141	93.2 Å²	93.2	66%	0.659	46%	0.457	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.4	128.8	174.2	-169.8	173.4	4.9	0	0	109.5	V27 A28	Q16-V27 HydrophobicContact CG-CG1 3.97Å; Q16-V27 VanDerWaalsContact NE2-CG1 3.28Å; Q16-A28 WeakPolarHBondContact CA-O 3.26Å
17	V	98	Very high	90.2	Very high	21 Å²	21	88.5 Å²	88.5	13%	0.127	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	165.1	179.1	-65	0	0	0	0	110.7	V15 V27 A28 A92 K95 A99	V15-V17 HydrophobicContact CG1-CG1 4.08Å; V17-V27 CarbonylContact O-C 3.57Å; V17-V27 WeakPolarHBondContact O-CA 3.4Å; V17-A28 HydrophobicContact CG2-CB 3.92Å; V17-A28 PolarHBondContact N-O 3.4Å; V17-A28 PolarHBondContact O-N 3.14Å; V17-A92 WeakPolarHBondContact CG2-O 3.49Å; V17-K95 HydrophobicContact CB-CB 4.14Å; V17-K95 HydrophobicContact CG1-CB 4.42Å; V17-K95 HydrophobicContact CG2-CB 4.02Å; V17-A99 HydrophobicContact CG1-CB 3.7Å
18	F	97.6	Very high	91.8	Very high	122 Å²	122	81.3 Å²	81.3	54%	0.535	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	142.6	177.8	67.6	-90.9	0	0	0	112.8	R20 A26 K95	F18-R20 HydrophobicContact CD2-CG 3.99Å; F18-R20 HydrophobicContact CE2-CG 4.47Å; F18-A26 CarbonylContact C-O 3.49Å; F18-A26 WeakPolarHBondContact CA-O 3.39Å; F18-K95 WeakPolarHBondContact O-CD 3.39Å; F18-K95 PolarHBondContact O-NZ 3.02Å
19	G	97.4	Very high	93.2	Very high	0 Å²	0	79.6 Å²	79.6	0%	0	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	145.2	167.6	0	0	0	0	0	110.5	A26	G19-A26 PolarHBondContact N-O 3.23Å; G19-A26 PolarHBondContact O-N 3.38Å
20	R	96.9	Very high	94.3	Very high	111 Å²	111	70.4 Å²	70.4	42%	0.419	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	133.4	-179.1	-64	-176.2	80.1	178.7	5	110.9	F18 A24 T25 Q91	F18-R20 HydrophobicContact CD2-CG 3.99Å; F18-R20 HydrophobicContact CE2-CG 4.47Å; R20-A24 WeakPolarHBondContact CA-O 3.12Å; R20-T25 HydrophobicContact CG-CG2 4.1Å; R20-Q91 PolarHBondContact O-OE1 3.22Å; R20-Q91 VanDerWaalsContact O-OE1 3.09Å
21	K	97	Very high	95.1	Very high	38 Å²	38	66.1 Å²	66.1	17%	0.165	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	120.9	169.7	-176.5	71.9	165	-168.5	0	108.7	T23 A24 A84 A88 D128	K21-T23 PolarHBondContact O-N 2.86Å; K21-A24 PolarHBondContact N-O 2.98Å; K21-A24 VanDerWaalsContact N-O 3.09Å; K21-A24 WeakPolarHBondContact O-CB 3.34Å; K21-A24 PolarHBondContact O-N 3.35Å; K21-A84 HydrophobicContact CB-CB 4.43Å; K21-A84 WeakPolarHBondContact CB-O 3.37Å; K21-A84 HydrophobicContact CG-CB 4.2Å; K21-A88 HydrophobicContact CB-CB 4.4Å; K21-D128 HydrophobicContact CD-CB 3.94Å; K21-D128 IonicContact NZ-OD2 3.67Å; K21-D128 PolarHBondContact NZ-OD2 3.29Å
22	K	95.9	Very high	95.7	Very high	122 Å²	122	61 Å²	61	53%	0.53	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	45.8	-141	-168	-57.4	-177.2	176.6	-175.7	0	108.6	A24 A84 R131	K22-A24 PolarHBondContact O-N 3.02Å; K22-A84 HydrophobicContact CB-CB 4.47Å; K22-R131 VanDerWaalsContact C-CZ 3.42Å; K22-R131 PolarHBondContact O-NH1 2.85Å; K22-R131 PolarHBondContact O-NH2 2.77Å
23	T	96.4	Very high	96	Very high	94 Å²	94	57.6 Å²	57.6	58%	0.577	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-5.6	179.4	50.3	0	0	0	0	114.4	K21 G80	K21-T23 PolarHBondContact O-N 2.86Å; T23-G80 WeakPolarHBondContact OG1-CA 3.34Å; T23-G80 PolarHBondContact OG1-N 3.36Å
24	A	97.3	Very high	96	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	131.6	175.7	0	0	0	0	0	111.3	R20 K21 K22 A84 Q85 A88	R20-A24 WeakPolarHBondContact CA-O 3.12Å; K21-A24 PolarHBondContact N-O 2.98Å; K21-A24 VanDerWaalsContact N-O 3.09Å; K21-A24 WeakPolarHBondContact O-CB 3.34Å; K21-A24 PolarHBondContact O-N 3.35Å; K22-A24 PolarHBondContact O-N 3.02Å; A24-A84 HydrophobicContact CB-CB 3.92Å; A24-Q85 HydrophobicContact CB-CG 3.93Å; A24-A88 HydrophobicContact CB-CB 4.21Å
25	T	97.6	Very high	95.8	Very high	40 Å²	40	56.3 Å²	56.3	25%	0.245	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	126.1	176.1	46.1	0	0	0	0	109.2	R20 V77 S78	R20-T25 HydrophobicContact CG-CG2 4.1Å; T25-V77 WeakPolarHBondContact O-CA 3.25Å; T25-S78 PolarHBondContact N-O 3.18Å; T25-S78 PolarHBondContact O-N 3.41Å; T25-S78 PolarHBondContact OG1-O 3.1Å; T25-S78 PolarHBondContact OG1-OG 3.01Å
26	A	97.9	Very high	95.6	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	126.4	173.2	0	0	0	0	0	108.7	F18 G19 V75 R76 V77 A88 V89 A92	F18-A26 CarbonylContact C-O 3.49Å; F18-A26 WeakPolarHBondContact CA-O 3.39Å; G19-A26 PolarHBondContact N-O 3.23Å; G19-A26 PolarHBondContact O-N 3.38Å; A26-V75 HydrophobicContact CB-CG1 3.93Å; A26-R76 CarbonylContact C-O 3.54Å; A26-R76 WeakPolarHBondContact CA-O 3.42Å; A26-V77 HydrophobicContact CB-CG1 4.49Å; A26-V77 HydrophobicContact CB-CG2 4.07Å; A26-A88 HydrophobicContact CB-CB 3.83Å; A26-A88 WeakPolarHBondContact CB-O 3.36Å; A26-V89 HydrophobicContact CB-CG2 4.25Å; A26-A92 HydrophobicContact CB-CB 3.98Å
27	V	98.3	Very high	95.5	Very high	54 Å²	54	52.9 Å²	52.9	33%	0.327	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	115	177.3	-179.7	0	0	0	0	107.3	Q16 V17 V75 R76	Q16-V27 HydrophobicContact CG-CG1 3.97Å; Q16-V27 VanDerWaalsContact NE2-CG1 3.28Å; V17-V27 CarbonylContact O-C 3.57Å; V17-V27 WeakPolarHBondContact O-CA 3.4Å; V27-V75 CarbonylContact O-C 3.48Å; V27-V75 WeakPolarHBondContact O-CA 3.5Å; V27-R76 PolarHBondContact N-O 3.05Å; V27-R76 PolarHBondContact O-N 3.1Å
28	A	97.7	Very high	95.3	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	132.5	178.2	0	0	0	0	0	110.1	Q16 V17 I73 R74 V75 A92	Q16-A28 WeakPolarHBondContact CA-O 3.26Å; V17-A28 HydrophobicContact CG2-CB 3.92Å; V17-A28 PolarHBondContact N-O 3.4Å; V17-A28 PolarHBondContact O-N 3.14Å; A28-I73 HydrophobicContact CB-CG2 4.19Å; A28-R74 CarbonylContact C-O 3.59Å; A28-R74 WeakPolarHBondContact CA-O 3.31Å; A28-V75 HydrophobicContact CB-CG2 4Å; A28-A92 HydrophobicContact CB-CB 3.87Å
29	H	97	Very high	95.2	Very high	81 Å²	81	52.6 Å²	52.6	38%	0.375	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	114.3	169.6	-176.2	-81.1	0	0	0	108	R74	H29-R74 PolarHBondContact N-O 3.25Å; H29-R74 PolarHBondContact O-N 3.46Å
30	C	95.5	Very high	95.2	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	132	-177.9	-176.5	0	0	0	0	109.7	A14 V15 D72 I73	A14-C30 CarbonylContact C-O 3.57Å; A14-C30 WeakPolarHBondContact CA-O 3.37Å; A14-C30 WeakPolarHBondContact CB-O 3.45Å; V15-C30 PolarHBondContact N-O 2.97Å; V15-C30 PolarHBondContact O-N 3.22Å; C30-D72 WeakPolarHBondContact CA-O 3.22Å; C30-I73 HydrophobicContact CB-CG1 4.38Å
31	K	94.3	Very high	95	Very high	97 Å²	97	54.2 Å²	54.2	42%	0.422	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	162.7	177.2	63.5	170.5	-173.2	152.5	0	109.3	A14 L71 D72	A14-K31 HydrophobicContact CB-CB 4.45Å; K31-L71 WeakPolarHBondContact O-CA 3.18Å; K31-D72 HydrophobicContact CD-CB 4.39Å; K31-D72 WeakPolarHBondContact CE-OD2 3.46Å; K31-D72 HydrophobicContact CG-CB 3.82Å; K31-D72 PolarHBondContact N-O 3.45Å; K31-D72 IonicContact NZ-OD2 3.58Å; K31-D72 PolarHBondContact NZ-OD2 2.9Å; K31-D72 PolarHBondContact O-N 2.9Å
32	L	93	Very high	94.9	Very high	90 Å²	90	60.4 Å²	60.4	47%	0.471	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62	136.9	167	-74	155.8	0	0	0	110.1	K13 N70 F100	K13-L32 HydrophobicContact CB-CD1 4.08Å; K13-L32 HydrophobicContact CD-CD1 3.99Å; L32-N70 WeakPolarHBondContact CA-O 3.47Å; L32-F100 HydrophobicContact CD1-CZ 4.16Å; L32-F100 HydrophobicContact CD2-CE1 4.28Å; L32-F100 HydrophobicContact CD2-CZ 3.69Å; L32-F100 HydrophobicContact CG-CE2 4.12Å; L32-F100 HydrophobicContact CG-CZ 3.61Å
33	G	91.1	Very high	94.8	Very high	35 Å²	35	57.7 Å²	57.7	36%	0.361	33%	0.326	S	S	.	.	S	Bend	trans	-178.7	-154.1	-177.2	0	0	0	0	0	113.4	N70	G33-N70 PolarHBondContact N-O 3.41Å; G33-N70 CarbonylContact O-C 3.59Å; G33-N70 VanDerWaalsContact O-C 3.23Å; G33-N70 WeakPolarHBondContact O-CA 3.49Å
34	S	90	Very high	94.5	Very high	93 Å²	93	53.6 Å²	53.6	65%	0.65	30%	0.301	S	S	*	.	S	Bend	trans	-98.2	7.1	-171.1	60.6	0	0	0	0	114.6	T36 S69 D72	S34-T36 PolarHBondContact OG-OG1 3.21Å; S34-S69 CarbonylContact C-O 3.06Å; S34-D72 PolarHBondContact N-OD1 3.26Å
35	G	89.7	Confident	94.1	Very high	28 Å²	28	58.8 Å²	58.8	29%	0.289	33%	0.329	S	S	.	.			trans	92.7	19.8	-178.5	0	0	0	0	0	113.5	I37 L68 S69 L71 D72	G35-I37 PolarHBondContact O-N 3.17Å; G35-L68 WeakPolarHBondContact CA-O 3.15Å; G35-S69 PolarHBondContact N-O 3.41Å; G35-S69 VanDerWaalsContact N-O 3.13Å; G35-L71 CarbonylContact C-O 3.27Å; G35-L71 VanDerWaalsContact CA-O 3.23Å; G35-L71 WeakPolarHBondContact CA-O 3.43Å; G35-D72 PolarHBondContact N-OD1 3.3Å; G35-D72 VanDerWaalsContact N-OD1 3.12Å
36	T	92.6	Very high	93.9	Very high	57 Å²	57	61 Å²	61	35%	0.35	34%	0.342	S	S	.	.			trans	-80.6	117.1	-176.4	-57.6	0	0	0	0	111	S34 R38 D72 I73	S34-T36 PolarHBondContact OG-OG1 3.21Å; T36-R38 HydrophobicContact CG2-CG 4.09Å; T36-D72 PolarHBondContact N-OD1 3.14Å; T36-D72 WeakPolarHBondContact O-CA 3.27Å; T36-I73 PolarHBondContact O-N 3.21Å
37	I	93.8	Very high	93.6	Very high	28 Å²	28	62.8 Å²	62.8	14%	0.144	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	120.6	176.4	-52.3	175.7	0	0	0	110.1	G35 L44 I60 L68 I73 I93	G35-I37 PolarHBondContact O-N 3.17Å; I37-L44 HydrophobicContact CG2-CD1 3.97Å; I37-I60 HydrophobicContact CD1-CD1 3.58Å; I37-I60 HydrophobicContact CD1-CG1 4.15Å; I37-L68 HydrophobicContact CD1-CD2 4.37Å; I37-I73 WeakPolarHBondContact CA-O 3.36Å; I37-I73 HydrophobicContact CG1-CB 4.33Å; I37-I73 HydrophobicContact CG2-CB 4.36Å; I37-I93 HydrophobicContact CG2-CD1 4.28Å
38	R	95.2	Very high	93.2	Very high	133 Å²	133	66 Å²	66	50%	0.502	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	137.2	179.2	-71	-178.7	173.9	172.7	-1.2	112	T36 R42 I73 V75	T36-R38 HydrophobicContact CG2-CG 4.09Å; R38-R42 CarbonylContact C-O 3.57Å; R38-R42 VanDerWaalsContact CA-O 3.26Å; R38-R42 WeakPolarHBondContact CA-O 3.3Å; R38-I73 PolarHBondContact N-O 3.27Å; R38-V75 PolarHBondContact O-N 2.81Å
39	V	95.7	Very high	93	Very high	3 Å²	3	67.8 Å²	67.8	2%	0.018	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	118.4	176.4	-175.5	0	0	0	0	108.6	G41 R42 L44 L47 V75 V77 V89	V39-G41 PolarHBondContact O-N 3.44Å; V39-G41 VanDerWaalsContact O-N 3.13Å; V39-R42 PolarHBondContact N-O 3.3Å; V39-R42 PolarHBondContact O-N 3.5Å; V39-L44 HydrophobicContact CG2-CD1 3.8Å; V39-L47 HydrophobicContact CG1-CD1 4.12Å; V39-V75 CarbonylContact C-O 3.55Å; V39-V75 WeakPolarHBondContact CA-O 3.48Å; V39-V75 HydrophobicContact CG2-CB 4.32Å; V39-V77 HydrophobicContact CG1-CG2 3.67Å; V39-V89 HydrophobicContact CG1-CG2 4.04Å; V39-V89 HydrophobicContact CG2-CG1 3.77Å
40	N	95.4	Very high	92.8	Very high	86 Å²	86	73.2 Å²	73.2	46%	0.46	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.4	38.9	-176.7	-70.7	-18.9	0	0	0	113.1	R42 V75 R76 V77	N40-R42 VanDerWaalsContact C-N 3.26Å; N40-R42 PolarHBondContact O-N 2.91Å; N40-V75 PolarHBondContact N-O 3.02Å; N40-R76 WeakPolarHBondContact OD1-CA 3.4Å; N40-V77 PolarHBondContact ND2-O 3.13Å; N40-V77 PolarHBondContact OD1-N 2.69Å
41	G	93.8	Very high	92.8	Very high	59 Å²	59	78.6 Å²	78.6	61%	0.608	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.7	-8.8	-179	0	0	0	0	0	115.4	V39	V39-G41 PolarHBondContact O-N 3.44Å; V39-G41 VanDerWaalsContact O-N 3.13Å
42	R	94.3	Very high	92.8	Very high	168 Å²	168	75.6 Å²	75.6	63%	0.634	42%	0.415	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.3	151.1	179.1	-59.4	-178.8	-175.3	-177.6	-0.4	111.3	R38 V39 N40	R38-R42 CarbonylContact C-O 3.57Å; R38-R42 VanDerWaalsContact CA-O 3.26Å; R38-R42 WeakPolarHBondContact CA-O 3.3Å; V39-R42 PolarHBondContact N-O 3.3Å; V39-R42 PolarHBondContact O-N 3.5Å; N40-R42 VanDerWaalsContact C-N 3.26Å; N40-R42 PolarHBondContact O-N 2.91Å
43	P	94.3	Very high	92.8	Very high	65 Å²	65	72.8 Å²	72.8	42%	0.422	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	159.7	171.7	29.9	-34.9	0	0	0	111.3	D45 V46	P43-D45 VanDerWaalsContact C-N 3.29Å; P43-D45 PolarHBondContact O-N 2.98Å; P43-V46 HydrophobicContact CG-CB 4.33Å; P43-V46 HydrophobicContact CG-CG2 3.73Å; P43-V46 PolarHBondContact O-N 2.9Å
44	L	90.3	Very high	92.9	Very high	9 Å²	9	75.2 Å²	75.2	5%	0.047	41%	0.41	C	S	.	.	G	3₁₀ helix	trans	-60.3	-37	-173.8	-153.8	79.3	0	0	0	112.9	I37 V39 V46 L47 L53 L56 M57 I60 I93	I37-L44 HydrophobicContact CG2-CD1 3.97Å; V39-L44 HydrophobicContact CG2-CD1 3.8Å; L44-V46 PolarHBondContact O-N 3.3Å; L44-L47 WeakPolarHBondContact O-CB 3.25Å; L44-L47 PolarHBondContact O-N 2.65Å; L44-L53 VanDerWaalsContact O-CD2 3.26Å; L44-L53 WeakPolarHBondContact O-CD2 3.37Å; L44-L56 HydrophobicContact CD1-CD1 4.44Å; L44-L56 HydrophobicContact CD1-CD2 3.48Å; L44-L56 VanDerWaalsContact CD1-CD2 3.48Å; L44-L56 HydrophobicContact CD1-CG 3.85Å; L44-L56 HydrophobicContact CD2-CD2 4.17Å; L44-L56 HydrophobicContact CD2-CG 4.04Å; L44-L56 HydrophobicContact CG-CD2 3.59Å; L44-L56 HydrophobicContact CG-CG 4Å; L44-M57 HydrophobicContact CB-CE 4.33Å; L44-M57 HydrophobicContact CD2-CE 3.47Å; L44-M57 VanDerWaalsContact CD2-CE 3.47Å; L44-M57 HydrophobicContact CD2-CG 3.76Å; L44-M57 HydrophobicContact CD2-SD 4.46Å; L44-M57 HydrophobicContact CG-CE 4.39Å; L44-I60 HydrophobicContact CD2-CD1 3.74Å; L44-I93 HydrophobicContact CD1-CD1 4.2Å
45	D	89.3	Confident	93.1	Very high	108 Å²	108	74.6 Å²	74.6	58%	0.578	40%	0.396	S	S	*	.	G	3₁₀ helix	trans	-70.3	-19	-172.9	-53.3	-38.1	0	0	0	113.9	P43 L47 L53 M57	P43-D45 VanDerWaalsContact C-N 3.29Å; P43-D45 PolarHBondContact O-N 2.98Å; D45-L47 VanDerWaalsContact C-N 3.32Å; D45-L53 WeakPolarHBondContact O-CD1 3.43Å; D45-M57 WeakPolarHBondContact OD1-CE 3.43Å
46	V	92.3	Very high	93.3	Very high	87 Å²	87	73.3 Å²	73.3	53%	0.527	38%	0.382	S	S	.	.	G	3₁₀ helix	trans	-91.7	1.1	-177.7	-176	0	0	0	0	111.2	P43 L44	P43-V46 HydrophobicContact CG-CB 4.33Å; P43-V46 HydrophobicContact CG-CG2 3.73Å; P43-V46 PolarHBondContact O-N 2.9Å; L44-V46 PolarHBondContact O-N 3.3Å
47	L	91.2	Very high	93.3	Very high	37 Å²	37	74 Å²	74	19%	0.194	38%	0.382	C	S	.	.	P	Polyproline II helix	trans	-74.4	137.1	-179	-159.2	73.6	0	0	0	111.7	V39 L44 D45 L53 L56 I86	V39-L47 HydrophobicContact CG1-CD1 4.12Å; L44-L47 WeakPolarHBondContact O-CB 3.25Å; L44-L47 PolarHBondContact O-N 2.65Å; D45-L47 VanDerWaalsContact C-N 3.32Å; L47-L53 HydrophobicContact CB-CD2 3.98Å; L47-L53 WeakPolarHBondContact O-CD2 3.16Å; L47-L56 HydrophobicContact CD2-CD2 3.57Å; L47-I86 HydrophobicContact CD2-CG1 3.86Å
48	E	90.3	Very high	93.2	Very high	122 Å²	122	73.7 Å²	73.7	57%	0.57	38%	0.38	S	S	*	.	S	Bend	trans	-102.5	147.6	175.6	-67.6	-173.7	170	0	0	112
49	P	94.3	Very high	93.1	Very high	38 Å²	38	67.4 Å²	67.4	25%	0.247	36%	0.357	C	S	.	.	P	Polyproline II helix	cis	-83	141.8	0.5	33.8	-40.6	0	0	0	114	P51 L52 I86	P49-P51 VanDerWaalsContact C-CD 3.44Å; P49-L52 HydrophobicContact CG-CB 4.26Å; P49-L52 HydrophobicContact CG-CD1 3.75Å; P49-L52 HydrophobicContact CG-CG 4.09Å; P49-L52 PolarHBondContact O-N 3.48Å; P49-I86 HydrophobicContact CG-CD1 4.22Å
50	R	92.6	Very high	92.9	Very high	194 Å²	194	69 Å²	69	73%	0.732	36%	0.364	S	S	*	.	G	3₁₀ helix	trans	-53	-40.3	-177.8	-64.3	-175.6	-179.2	-174.8	-0.1	115.3	L52 L53	R50-L52 PolarHBondContact O-N 3.47Å; R50-L53 HydrophobicContact CB-CD1 4.3Å; R50-L53 HydrophobicContact CG-CD1 4.36Å; R50-L53 WeakPolarHBondContact O-CB 3.4Å; R50-L53 WeakPolarHBondContact O-CG 3.47Å; R50-L53 PolarHBondContact O-N 3.02Å
51	P	94.5	Very high	92.8	Very high	113 Å²	113	71.8 Å²	71.8	73%	0.734	38%	0.378	S	S	*	.	G	3₁₀ helix	trans	-60.3	-19	178.2	-25.6	35.2	0	0	0	114.6	P49	P49-P51 VanDerWaalsContact C-CD 3.44Å
52	L	95.2	Very high	92.7	Very high	34 Å²	34	71.7 Å²	71.7	18%	0.178	36%	0.364	C	S	.	.	G	3₁₀ helix	trans	-99.1	1.7	178.9	-66.8	-179.3	0	0	0	113.2	P49 R50 K55 L56 V83 I86	P49-L52 HydrophobicContact CG-CB 4.26Å; P49-L52 HydrophobicContact CG-CD1 3.75Å; P49-L52 HydrophobicContact CG-CG 4.09Å; P49-L52 PolarHBondContact O-N 3.48Å; R50-L52 PolarHBondContact O-N 3.47Å; L52-K55 HydrophobicContact CD2-CG 4.16Å; L52-K55 WeakPolarHBondContact O-CB 3.28Å; L52-K55 PolarHBondContact O-N 3.04Å; L52-L56 PolarHBondContact O-N 3.29Å; L52-V83 HydrophobicContact CD1-CB 4.07Å; L52-V83 HydrophobicContact CD1-CG1 3.83Å; L52-V83 HydrophobicContact CD1-CG2 3.77Å; L52-I86 HydrophobicContact CB-CD1 3.4Å; L52-I86 HydrophobicContact CB-CG2 4.28Å; L52-I86 HydrophobicContact CD1-CD1 4.03Å; L52-I86 HydrophobicContact CG-CD1 4.36Å
53	L	92.6	Very high	92.5	Very high	31 Å²	31	65.1 Å²	65.1	16%	0.162	34%	0.341	C	S	.	.	H	α-helix	trans	-59.8	-41.6	172.8	-73.1	172.1	0	0	0	113.4	L44 D45 L47 R50 K55 L56 M57	L44-L53 VanDerWaalsContact O-CD2 3.26Å; L44-L53 WeakPolarHBondContact O-CD2 3.37Å; D45-L53 WeakPolarHBondContact O-CD1 3.43Å; L47-L53 HydrophobicContact CB-CD2 3.98Å; L47-L53 WeakPolarHBondContact O-CD2 3.16Å; R50-L53 HydrophobicContact CB-CD1 4.3Å; R50-L53 HydrophobicContact CG-CD1 4.36Å; R50-L53 WeakPolarHBondContact O-CB 3.4Å; R50-L53 WeakPolarHBondContact O-CG 3.47Å; R50-L53 PolarHBondContact O-N 3.02Å; L53-K55 PolarHBondContact O-N 3.48Å; L53-L56 WeakPolarHBondContact O-CB 3.33Å; L53-L56 PolarHBondContact O-N 3.28Å; L53-M57 PolarHBondContact O-N 3.12Å; L53-M57 VanDerWaalsContact O-N 3.13Å
54	P	93.7	Very high	92.1	Very high	87 Å²	87	63.4 Å²	63.4	57%	0.565	34%	0.335	S	S	*	.	H	α-helix	trans	-58.3	-38.1	175.4	-24.4	34.4	0	0	0	111.6	L56 M57 E58	P54-L56 VanDerWaalsContact C-N 3.29Å; P54-L56 PolarHBondContact O-N 3.31Å; P54-M57 PolarHBondContact O-N 3.4Å; P54-E58 PolarHBondContact O-N 3Å
55	K	94.1	Very high	91.3	Very high	80 Å²	80	72 Å²	72	35%	0.348	37%	0.372	S	S	.	.	H	α-helix	trans	-62.1	-38.1	175.8	-69.7	-71.3	166.5	-158.9	0	111.1	L52 L53 M57 E58 R90	L52-K55 HydrophobicContact CD2-CG 4.16Å; L52-K55 WeakPolarHBondContact O-CB 3.28Å; L52-K55 PolarHBondContact O-N 3.04Å; L53-K55 PolarHBondContact O-N 3.48Å; K55-M57 VanDerWaalsContact C-N 3.33Å; K55-E58 VanDerWaalsContact CD-OE1 3.26Å; K55-E58 WeakPolarHBondContact CD-OE1 3.48Å; K55-E58 IonicContact NZ-OE1 3.41Å; K55-E58 PolarHBondContact NZ-OE1 3.45Å; K55-R90 VanDerWaalsContact C-NH2 3.26Å; K55-R90 PolarHBondContact O-NE 3.26Å; K55-R90 PolarHBondContact O-NH2 3.05Å
56	L	93.2	Very high	90.7	Very high	0 Å²	0	75 Å²	75	0%	0	38%	0.382	C	S	.	.	H	α-helix	trans	-68.8	-32.9	178	-174.9	55.5	0	0	0	113.1	L44 L47 L52 L53 P54 P59 I86 V89 R90 I93	L44-L56 HydrophobicContact CD1-CD1 4.44Å; L44-L56 HydrophobicContact CD1-CD2 3.48Å; L44-L56 VanDerWaalsContact CD1-CD2 3.48Å; L44-L56 HydrophobicContact CD1-CG 3.85Å; L44-L56 HydrophobicContact CD2-CD2 4.17Å; L44-L56 HydrophobicContact CD2-CG 4.04Å; L44-L56 HydrophobicContact CG-CD2 3.59Å; L44-L56 HydrophobicContact CG-CG 4Å; L47-L56 HydrophobicContact CD2-CD2 3.57Å; L52-L56 PolarHBondContact O-N 3.29Å; L53-L56 WeakPolarHBondContact O-CB 3.33Å; L53-L56 PolarHBondContact O-N 3.28Å; P54-L56 VanDerWaalsContact C-N 3.29Å; P54-L56 PolarHBondContact O-N 3.31Å; L56-P59 WeakPolarHBondContact O-CD 3.44Å; L56-I86 HydrophobicContact CB-CG2 4.14Å; L56-V89 HydrophobicContact CD1-CB 3.73Å; L56-V89 HydrophobicContact CD1-CG1 3.54Å; L56-R90 HydrophobicContact CD1-CB 4.17Å; L56-I93 HydrophobicContact CD1-CD1 4.21Å
57	M	92.3	Very high	89.7	Confident	71 Å²	71	72 Å²	72	35%	0.35	37%	0.369	S	S	.	.	H	α-helix	trans	-83.1	-12.3	-176.7	-71	-146.5	155.8	0	0	115.2	L44 D45 L53 P54 K55 I60 L61	L44-M57 HydrophobicContact CB-CE 4.33Å; L44-M57 HydrophobicContact CD2-CE 3.47Å; L44-M57 VanDerWaalsContact CD2-CE 3.47Å; L44-M57 HydrophobicContact CD2-CG 3.76Å; L44-M57 HydrophobicContact CD2-SD 4.46Å; L44-M57 HydrophobicContact CG-CE 4.39Å; D45-M57 WeakPolarHBondContact OD1-CE 3.43Å; L53-M57 PolarHBondContact O-N 3.12Å; L53-M57 VanDerWaalsContact O-N 3.13Å; P54-M57 PolarHBondContact O-N 3.4Å; K55-M57 VanDerWaalsContact C-N 3.33Å; M57-I60 WeakPolarHBondContact O-CA 3.2Å; M57-I60 WeakPolarHBondContact O-CB 3.23Å; M57-I60 PolarHBondContact O-N 3.05Å; M57-L61 PolarHBondContact O-N 3.23Å
58	E	92.7	Very high	89.1	Confident	23 Å²	23	70.7 Å²	70.7	11%	0.107	36%	0.362	C	S	.	.	H	α-helix	trans	-46.4	-49.7	177.7	-72.6	179	-171.3	0	0	115.1	P54 K55 I60 L61 L62 R90 Y120	P54-E58 PolarHBondContact O-N 3Å; K55-E58 VanDerWaalsContact CD-OE1 3.26Å; K55-E58 WeakPolarHBondContact CD-OE1 3.48Å; K55-E58 IonicContact NZ-OE1 3.41Å; K55-E58 PolarHBondContact NZ-OE1 3.45Å; E58-I60 PolarHBondContact O-N 2.96Å; E58-L61 PolarHBondContact O-N 3.19Å; E58-L62 WeakPolarHBondContact O-CB 3.38Å; E58-L62 PolarHBondContact O-N 3.25Å; E58-R90 IonicContact OE1-NH2 2.97Å; E58-R90 PolarHBondContact OE1-NH2 2.91Å; E58-R90 IonicContact OE2-CZ 3.24Å; E58-R90 IonicContact OE2-NE 3.06Å; E58-R90 IonicContact OE2-NH1 2.59Å; E58-R90 PolarHBondContact OE2-NH1 2.63Å; E58-R90 IonicContact OE2-NH2 2.83Å; E58-R90 PolarHBondContact OE2-NH2 3.38Å; E58-Y120 HydrophobicContact CB-CE1 4.33Å; E58-Y120 HydrophobicContact CG-CE1 4.37Å; E58-Y120 PolarHBondContact OE1-OH 3.22Å; E58-Y120 VanDerWaalsContact OE1-OH 3.05Å; E58-Y120 WeakPolarHBondContact OE2-CE1 3.49Å; E58-Y120 PolarHBondContact OE2-OH 3.16Å
59	P	92.9	Very high	88.6	Confident	1 Å²	1	67.3 Å²	67.3	1%	0.006	35%	0.352	C	S	.	.	H	α-helix	trans	-63.2	-29	178.5	23.8	-34.2	0	0	0	113.3	L56 L63 R90 I93 A94 F117 L124	L56-P59 WeakPolarHBondContact O-CD 3.44Å; P59-L63 WeakPolarHBondContact O-CG 3.2Å; P59-L63 PolarHBondContact O-N 3.16Å; P59-R90 HydrophobicContact CG-CG 4.23Å; P59-I93 HydrophobicContact CB-CG2 4.38Å; P59-I93 HydrophobicContact CG-CB 4.43Å; P59-I93 HydrophobicContact CG-CG2 4.11Å; P59-A94 HydrophobicContact CB-CB 4.15Å; P59-F117 HydrophobicContact CB-CE1 4.04Å; P59-F117 HydrophobicContact CB-CZ 4.27Å; P59-L124 HydrophobicContact CB-CD2 4.24Å; P59-L124 HydrophobicContact CG-CD2 4.36Å
60	I	92.1	Very high	88.3	Confident	35 Å²	35	70.4 Å²	70.4	18%	0.179	37%	0.367	C	S	.	.	H	α-helix	trans	-73.5	-45.6	177.4	-56.6	173	0	0	0	109.8	I37 L44 M57 E58 G64 L68	I37-I60 HydrophobicContact CD1-CD1 3.58Å; I37-I60 HydrophobicContact CD1-CG1 4.15Å; L44-I60 HydrophobicContact CD2-CD1 3.74Å; M57-I60 WeakPolarHBondContact O-CA 3.2Å; M57-I60 WeakPolarHBondContact O-CB 3.23Å; M57-I60 PolarHBondContact O-N 3.05Å; E58-I60 PolarHBondContact O-N 2.96Å; I60-G64 PolarHBondContact O-N 3.26Å; I60-G64 VanDerWaalsContact O-N 3.14Å; I60-L68 HydrophobicContact CB-CD1 3.83Å; I60-L68 HydrophobicContact CG1-CD1 3.81Å; I60-L68 HydrophobicContact CG2-CD1 3.73Å
61	L	92.6	Very high	88.3	Confident	145 Å²	145	61.4 Å²	61.4	76%	0.759	33%	0.333	S	S	*	.	H	α-helix	trans	-66	-40.1	180	-174.2	63.1	0	0	0	111.9	M57 E58 L63 G64	M57-L61 PolarHBondContact O-N 3.23Å; E58-L61 PolarHBondContact O-N 3.19Å; L61-L63 VanDerWaalsContact C-N 3.34Å; L61-L63 PolarHBondContact O-N 2.95Å; L61-G64 PolarHBondContact O-N 2.92Å
62	L	92.3	Very high	88.3	Confident	58 Å²	58	57 Å²	57	30%	0.304	30%	0.304	S	S	.	.	H	α-helix	trans	-67.5	-33.5	-177.7	-158.2	79.2	0	0	0	113	E58 K116 F117 Y120	E58-L62 WeakPolarHBondContact O-CB 3.38Å; E58-L62 PolarHBondContact O-N 3.25Å; L62-K116 HydrophobicContact CD2-CB 4.17Å; L62-K116 WeakPolarHBondContact CD2-O 3.4Å; L62-F117 HydrophobicContact CB-CE1 4.45Å; L62-F117 HydrophobicContact CD2-CD1 3.58Å; L62-F117 HydrophobicContact CD2-CE1 4.08Å; L62-Y120 HydrophobicContact CD1-CD2 4.14Å; L62-Y120 HydrophobicContact CD1-CG 4.13Å; L62-Y120 HydrophobicContact CD2-CG 4.36Å
63	L	89.7	Confident	88.3	Confident	29 Å²	29	55.5 Å²	55.5	15%	0.152	30%	0.296	C	S	.	.	H	α-helix	trans	-79.3	-22.8	174.3	-76.5	173.5	0	0	0	113	P59 L61 L68 V97 I113 F117	P59-L63 WeakPolarHBondContact O-CG 3.2Å; P59-L63 PolarHBondContact O-N 3.16Å; L61-L63 VanDerWaalsContact C-N 3.34Å; L61-L63 PolarHBondContact O-N 2.95Å; L63-L68 HydrophobicContact CB-CD1 4.5Å; L63-L68 HydrophobicContact CD1-CD1 4.12Å; L63-L68 HydrophobicContact CD1-CG 4.32Å; L63-V97 HydrophobicContact CD1-CB 4.17Å; L63-V97 HydrophobicContact CD1-CG1 3.76Å; L63-V97 HydrophobicContact CD1-CG2 3.91Å; L63-I113 HydrophobicContact CD2-CB 4.22Å; L63-I113 HydrophobicContact CD2-CD1 4.06Å; L63-I113 HydrophobicContact CD2-CG1 3.68Å; L63-I113 HydrophobicContact CD2-CG2 3.72Å; L63-F117 HydrophobicContact CD1-CE1 4.35Å; L63-F117 HydrophobicContact CD1-CE2 4.5Å; L63-F117 HydrophobicContact CD1-CZ 3.63Å; L63-F117 HydrophobicContact CD2-CZ 4.2Å; L63-F117 HydrophobicContact CG-CE1 4.06Å; L63-F117 HydrophobicContact CG-CZ 3.76Å
64	G	85.8	Confident	88.5	Confident	29 Å²	29	62.6 Å²	62.6	30%	0.299	32%	0.32	S	S	.	.			trans	76.4	167.5	-168.7	0	0	0	0	0	112.7	I60 L61 H66 G67	I60-G64 PolarHBondContact O-N 3.26Å; I60-G64 VanDerWaalsContact O-N 3.14Å; L61-G64 PolarHBondContact O-N 2.92Å; G64-H66 PolarHBondContact O-N 3.04Å; G64-G67 PolarHBondContact O-N 2.86Å
65	K	74	Confident	88.7	Confident	190 Å²	190	58.5 Å²	58.5	83%	0.826	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	-58.5	-32	-176.5	-71.8	-178.9	177.7	177.2	0	113.4	S69	K65-S69 PolarHBondContact O-N 2.93Å
66	H	75.5	Confident	88.9	Confident	170 Å²	170	64 Å²	64	79%	0.787	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-73.9	-26.8	-177.4	-62.5	-74.1	0	0	0	113.7	G64 L68 S69	G64-H66 PolarHBondContact O-N 3.04Å; H66-L68 PolarHBondContact O-N 2.9Å; H66-S69 PolarHBondContact O-OG 2.92Å
67	G	72.9	Confident	89.1	Confident	24 Å²	24	64.7 Å²	64.7	25%	0.247	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-70.3	-18.7	-177.1	0	0	0	0	0	114	G64	G64-G67 PolarHBondContact O-N 2.86Å
68	L	77	Confident	89.3	Confident	10 Å²	10	64.4 Å²	64.4	5%	0.052	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121.4	-9.5	-173.9	-76.9	144	0	0	0	114.1	G35 I37 I60 L63 H66 N70 L71 I73 V97	G35-L68 WeakPolarHBondContact CA-O 3.15Å; I37-L68 HydrophobicContact CD1-CD2 4.37Å; I60-L68 HydrophobicContact CB-CD1 3.83Å; I60-L68 HydrophobicContact CG1-CD1 3.81Å; I60-L68 HydrophobicContact CG2-CD1 3.73Å; L63-L68 HydrophobicContact CB-CD1 4.5Å; L63-L68 HydrophobicContact CD1-CD1 4.12Å; L63-L68 HydrophobicContact CD1-CG 4.32Å; H66-L68 PolarHBondContact O-N 2.9Å; L68-N70 PolarHBondContact O-N 3.12Å; L68-L71 PolarHBondContact O-N 2.92Å; L68-I73 HydrophobicContact CD2-CD1 3.66Å; L68-V97 HydrophobicContact CD2-CG2 3.72Å; L68-V97 HydrophobicContact CG-CG2 4.42Å
69	S	80.9	Confident	89.4	Confident	51 Å²	51	65.3 Å²	65.3	36%	0.357	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-24.4	-176.1	57.2	0	0	0	0	113.7	S34 G35 K65 H66	S34-S69 CarbonylContact C-O 3.06Å; G35-S69 PolarHBondContact N-O 3.41Å; G35-S69 VanDerWaalsContact N-O 3.13Å; K65-S69 PolarHBondContact O-N 2.93Å; H66-S69 PolarHBondContact O-OG 2.92Å
70	N	88.9	Confident	89.5	Confident	104 Å²	104	67.1 Å²	67.1	56%	0.556	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.3	1.1	-175.4	-55.1	-8.5	0	0	0	112.7	L32 G33 L68	L32-N70 WeakPolarHBondContact CA-O 3.47Å; G33-N70 PolarHBondContact N-O 3.41Å; G33-N70 CarbonylContact O-C 3.59Å; G33-N70 VanDerWaalsContact O-C 3.23Å; G33-N70 WeakPolarHBondContact O-CA 3.49Å; L68-N70 PolarHBondContact O-N 3.12Å
71	L	91.9	Very high	89.6	Confident	4 Å²	4	67.2 Å²	67.2	2%	0.021	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	118.6	-170	-62.8	176.2	0	0	0	111.7	K31 G35 L68 V97 F100	K31-L71 WeakPolarHBondContact O-CA 3.18Å; G35-L71 CarbonylContact C-O 3.27Å; G35-L71 VanDerWaalsContact CA-O 3.23Å; G35-L71 WeakPolarHBondContact CA-O 3.43Å; L68-L71 PolarHBondContact O-N 2.92Å; L71-V97 HydrophobicContact CD1-CG2 4.39Å; L71-F100 HydrophobicContact CD1-CD1 4.4Å; L71-F100 HydrophobicContact CD1-CG 4.48Å; L71-F100 HydrophobicContact CD2-CD1 3.55Å; L71-F100 HydrophobicContact CD2-CD2 3.75Å; L71-F100 HydrophobicContact CD2-CE1 3.6Å; L71-F100 HydrophobicContact CD2-CE2 3.8Å; L71-F100 HydrophobicContact CD2-CG 3.65Å; L71-F100 HydrophobicContact CD2-CZ 3.75Å
72	D	94.6	Very high	89.7	Confident	22 Å²	22	68.3 Å²	68.3	12%	0.118	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	126.6	166.5	-72.8	-12.5	0	0	0	109.7	C30 K31 S34 G35 T36	C30-D72 WeakPolarHBondContact CA-O 3.22Å; K31-D72 HydrophobicContact CD-CB 4.39Å; K31-D72 WeakPolarHBondContact CE-OD2 3.46Å; K31-D72 HydrophobicContact CG-CB 3.82Å; K31-D72 PolarHBondContact N-O 3.45Å; K31-D72 IonicContact NZ-OD2 3.58Å; K31-D72 PolarHBondContact NZ-OD2 2.9Å; K31-D72 PolarHBondContact O-N 2.9Å; S34-D72 PolarHBondContact N-OD1 3.26Å; G35-D72 PolarHBondContact N-OD1 3.3Å; G35-D72 VanDerWaalsContact N-OD1 3.12Å; T36-D72 PolarHBondContact N-OD1 3.14Å; T36-D72 WeakPolarHBondContact O-CA 3.27Å
73	I	95.6	Very high	89.9	Confident	2 Å²	2	69.2 Å²	69.2	1%	0.01	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	114.9	-179	-57.1	171.7	0	0	0	109.2	A28 C30 T36 I37 R38 L68 V75 I93 S96	A28-I73 HydrophobicContact CB-CG2 4.19Å; C30-I73 HydrophobicContact CB-CG1 4.38Å; T36-I73 PolarHBondContact O-N 3.21Å; I37-I73 WeakPolarHBondContact CA-O 3.36Å; I37-I73 HydrophobicContact CG1-CB 4.33Å; I37-I73 HydrophobicContact CG2-CB 4.36Å; R38-I73 PolarHBondContact N-O 3.27Å; L68-I73 HydrophobicContact CD2-CD1 3.66Å; I73-V75 HydrophobicContact CG2-CG2 3.76Å; I73-I93 HydrophobicContact CD1-CG2 4.24Å; I73-S96 WeakPolarHBondContact CD1-OG 3.41Å
74	R	96.5	Very high	90.2	Very high	180 Å²	180	68.4 Å²	68.4	68%	0.679	36%	0.364	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.2	119.3	170.6	-175.9	-177.2	-67.3	-178.2	-2	109.3	A28 H29	A28-R74 CarbonylContact C-O 3.59Å; A28-R74 WeakPolarHBondContact CA-O 3.31Å; H29-R74 PolarHBondContact N-O 3.25Å; H29-R74 PolarHBondContact O-N 3.46Å
75	V	97.4	Very high	90.7	Very high	1 Å²	1	69.7 Å²	69.7	1%	0.006	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	125.3	178.8	-167	0	0	0	0	110.2	A26 V27 A28 R38 V39 N40 I73 V77 V89 A92 I93	A26-V75 HydrophobicContact CB-CG1 3.93Å; V27-V75 CarbonylContact O-C 3.48Å; V27-V75 WeakPolarHBondContact O-CA 3.5Å; A28-V75 HydrophobicContact CB-CG2 4Å; R38-V75 PolarHBondContact O-N 2.81Å; V39-V75 CarbonylContact C-O 3.55Å; V39-V75 WeakPolarHBondContact CA-O 3.48Å; V39-V75 HydrophobicContact CG2-CB 4.32Å; N40-V75 PolarHBondContact N-O 3.02Å; I73-V75 HydrophobicContact CG2-CG2 3.76Å; V75-V77 HydrophobicContact CG1-CG2 3.88Å; V75-V89 HydrophobicContact CB-CG1 4.47Å; V75-V89 HydrophobicContact CG1-CG1 4.22Å; V75-V89 HydrophobicContact CG1-CG2 4.24Å; V75-V89 HydrophobicContact CG2-CG1 4.32Å; V75-A92 HydrophobicContact CG1-CB 4.47Å; V75-I93 HydrophobicContact CG2-CG1 4.42Å
76	R	97.8	Very high	91.7	Very high	196 Å²	196	60.7 Å²	60.7	74%	0.74	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.1	128.8	167.5	-170.3	-177.5	-174.6	172.5	2.4	109	A26 V27 N40	A26-R76 CarbonylContact C-O 3.54Å; A26-R76 WeakPolarHBondContact CA-O 3.42Å; V27-R76 PolarHBondContact N-O 3.05Å; V27-R76 PolarHBondContact O-N 3.1Å; N40-R76 WeakPolarHBondContact OD1-CA 3.4Å
77	V	97.1	Very high	92.7	Very high	13 Å²	13	55.6 Å²	55.6	8%	0.079	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	134.7	-176	-169.4	0	0	0	0	110.2	T25 A26 V39 N40 V75 Q85 V89	T25-V77 WeakPolarHBondContact O-CA 3.25Å; A26-V77 HydrophobicContact CB-CG1 4.49Å; A26-V77 HydrophobicContact CB-CG2 4.07Å; V39-V77 HydrophobicContact CG1-CG2 3.67Å; N40-V77 PolarHBondContact ND2-O 3.13Å; N40-V77 PolarHBondContact OD1-N 2.69Å; V75-V77 HydrophobicContact CG1-CG2 3.88Å; V77-Q85 HydrophobicContact CG1-CB 3.85Å; V77-Q85 HydrophobicContact CG1-CG 3.7Å; V77-V89 HydrophobicContact CG1-CG2 4.45Å; V77-V89 HydrophobicContact CG2-CG2 3.3Å
78	S	96.7	Very high	93.9	Very high	65 Å²	65	54.4 Å²	54.4	46%	0.455	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	154.6	177.1	56.3	0	0	0	0	111.5	T25	T25-S78 PolarHBondContact N-O 3.18Å; T25-S78 PolarHBondContact O-N 3.41Å; T25-S78 PolarHBondContact OG1-O 3.1Å; T25-S78 PolarHBondContact OG1-OG 3.01Å
79	G	95.7	Very high	94.8	Very high	42 Å²	42	54 Å²	54	43%	0.433	28%	0.284	S	S	.	.	S	Bend	trans	74.8	176.5	175.8	0	0	0	0	0	115.2	Q85	G79-Q85 WeakPolarHBondContact O-CG 3.49Å; G79-Q85 PolarHBondContact O-NE2 3.24Å
80	G	94.4	Very high	95.5	Very high	39 Å²	39	51.8 Å²	51.8	40%	0.402	27%	0.268	S	S	.	.	S	Bend	trans	65	-152.7	-179.8	0	0	0	0	0	114.4	T23	T23-G80 WeakPolarHBondContact OG1-CA 3.34Å; T23-G80 PolarHBondContact OG1-N 3.36Å
81	G	94.6	Very high	95.9	Very high	38 Å²	38	47 Å²	47	39%	0.392	24%	0.242	S	C	.	.			trans	-127.8	172.2	174.8	0	0	0	0	0	111	V83 A84 Q85	G81-V83 VanDerWaalsContact C-N 3.32Å; G81-V83 PolarHBondContact O-N 3.45Å; G81-V83 VanDerWaalsContact O-N 3.16Å; G81-A84 PolarHBondContact O-N 2.94Å; G81-Q85 WeakPolarHBondContact O-CG 3.26Å; G81-Q85 PolarHBondContact O-N 3.48Å
82	R	94.7	Very high	96.2	Very high	167 Å²	167	46.8 Å²	46.8	63%	0.63	24%	0.241	S	C	*	.	H	α-helix	trans	-50.9	-46.2	-169.1	-52.9	173.2	-172.8	171.1	0.4	113.4	Q85 I86	R82-Q85 PolarHBondContact O-N 2.83Å; R82-I86 WeakPolarHBondContact O-CG1 3.46Å; R82-I86 PolarHBondContact O-N 2.96Å; R82-I86 VanDerWaalsContact O-N 3.12Å
83	V	95.9	Very high	96.2	Very high	78 Å²	78	45.8 Å²	45.8	47%	0.473	24%	0.235	S	C	.	.	H	α-helix	trans	-62.7	-49.4	177.3	-178	0	0	0	0	111.7	L52 G81 Q85 I86 Y87	L52-V83 HydrophobicContact CD1-CB 4.07Å; L52-V83 HydrophobicContact CD1-CG1 3.83Å; L52-V83 HydrophobicContact CD1-CG2 3.77Å; G81-V83 VanDerWaalsContact C-N 3.32Å; G81-V83 PolarHBondContact O-N 3.45Å; G81-V83 VanDerWaalsContact O-N 3.16Å; V83-Q85 VanDerWaalsContact C-N 3.28Å; V83-Q85 PolarHBondContact O-N 2.59Å; V83-I86 PolarHBondContact O-N 3.05Å; V83-Y87 HydrophobicContact CG1-CD2 4.01Å; V83-Y87 HydrophobicContact CG1-CE2 3.78Å; V83-Y87 VanDerWaalsContact O-CD2 3.26Å; V83-Y87 WeakPolarHBondContact O-CD2 3.46Å; V83-Y87 PolarHBondContact O-N 3.06Å
84	A	96.1	Very high	96.2	Very high	11 Å²	11	45.7 Å²	45.7	9%	0.091	24%	0.235	C	C	.	.	H	α-helix	trans	-64	-36.4	-178.9	0	0	0	0	0	111.6	K21 K22 A24 G81 Y87 A88	K21-A84 HydrophobicContact CB-CB 4.43Å; K21-A84 WeakPolarHBondContact CB-O 3.37Å; K21-A84 HydrophobicContact CG-CB 4.2Å; K22-A84 HydrophobicContact CB-CB 4.47Å; A24-A84 HydrophobicContact CB-CB 3.92Å; G81-A84 PolarHBondContact O-N 2.94Å; A84-Y87 PolarHBondContact O-N 3.32Å; A84-A88 WeakPolarHBondContact O-CB 3.33Å; A84-A88 PolarHBondContact O-N 2.99Å
85	Q	96.1	Very high	96.3	Very high	57 Å²	57	39 Å²	39	27%	0.266	21%	0.211	S	C	.	.	H	α-helix	trans	-60.5	-45.8	174.3	-72	179.4	-8.3	0	0	111.6	A24 V77 G79 G81 R82 V83 Y87 A88 V89	A24-Q85 HydrophobicContact CB-CG 3.93Å; V77-Q85 HydrophobicContact CG1-CB 3.85Å; V77-Q85 HydrophobicContact CG1-CG 3.7Å; G79-Q85 WeakPolarHBondContact O-CG 3.49Å; G79-Q85 PolarHBondContact O-NE2 3.24Å; G81-Q85 WeakPolarHBondContact O-CG 3.26Å; G81-Q85 PolarHBondContact O-N 3.48Å; R82-Q85 PolarHBondContact O-N 2.83Å; V83-Q85 VanDerWaalsContact C-N 3.28Å; V83-Q85 PolarHBondContact O-N 2.59Å; Q85-Y87 PolarHBondContact O-N 2.7Å; Q85-A88 WeakPolarHBondContact O-CB 3.37Å; Q85-A88 PolarHBondContact O-N 2.77Å; Q85-A88 VanDerWaalsContact O-N 3.12Å; Q85-V89 WeakPolarHBondContact O-CG2 3.41Å; Q85-V89 PolarHBondContact O-N 3.18Å
86	I	96.1	Very high	96.2	Very high	1 Å²	1	38.9 Å²	38.9	1%	0.005	21%	0.21	C	C	.	.	H	α-helix	trans	-57.2	-48.6	177	-71.3	178.6	0	0	0	111.7	L47 P49 L52 L56 R82 V83 A88 V89 R90	L47-I86 HydrophobicContact CD2-CG1 3.86Å; P49-I86 HydrophobicContact CG-CD1 4.22Å; L52-I86 HydrophobicContact CB-CD1 3.4Å; L52-I86 HydrophobicContact CB-CG2 4.28Å; L52-I86 HydrophobicContact CD1-CD1 4.03Å; L52-I86 HydrophobicContact CG-CD1 4.36Å; L56-I86 HydrophobicContact CB-CG2 4.14Å; R82-I86 WeakPolarHBondContact O-CG1 3.46Å; R82-I86 PolarHBondContact O-N 2.96Å; R82-I86 VanDerWaalsContact O-N 3.12Å; V83-I86 PolarHBondContact O-N 3.05Å; I86-A88 VanDerWaalsContact C-N 3.3Å; I86-A88 PolarHBondContact O-N 3.49Å; I86-V89 PolarHBondContact O-N 3.44Å; I86-R90 WeakPolarHBondContact O-CB 3.49Å; I86-R90 PolarHBondContact O-N 3.38Å
87	Y	96.7	Very high	96	Very high	62 Å²	62	29.6 Å²	29.6	24%	0.243	18%	0.175	C	C	.	.	H	α-helix	trans	-63.7	-35.8	177.5	-77.5	-77.9	0	0	0	112.5	V83 A84 Q85 Q91	V83-Y87 HydrophobicContact CG1-CD2 4.01Å; V83-Y87 HydrophobicContact CG1-CE2 3.78Å; V83-Y87 VanDerWaalsContact O-CD2 3.26Å; V83-Y87 WeakPolarHBondContact O-CD2 3.46Å; V83-Y87 PolarHBondContact O-N 3.06Å; A84-Y87 PolarHBondContact O-N 3.32Å; Q85-Y87 PolarHBondContact O-N 2.7Å; Y87-Q91 WeakPolarHBondContact O-CB 3.19Å; Y87-Q91 PolarHBondContact O-N 2.95Å
88	A	97.2	Very high	95.9	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-66.3	-41.9	175.3	0	0	0	0	0	111.8	K21 A24 A26 A84 Q85 I86 Q91 A92	K21-A88 HydrophobicContact CB-CB 4.4Å; A24-A88 HydrophobicContact CB-CB 4.21Å; A26-A88 HydrophobicContact CB-CB 3.83Å; A26-A88 WeakPolarHBondContact CB-O 3.36Å; A84-A88 WeakPolarHBondContact O-CB 3.33Å; A84-A88 PolarHBondContact O-N 2.99Å; Q85-A88 WeakPolarHBondContact O-CB 3.37Å; Q85-A88 PolarHBondContact O-N 2.77Å; Q85-A88 VanDerWaalsContact O-N 3.12Å; I86-A88 VanDerWaalsContact C-N 3.3Å; I86-A88 PolarHBondContact O-N 3.49Å; A88-Q91 PolarHBondContact O-N 2.88Å; A88-A92 WeakPolarHBondContact O-CB 3.37Å; A88-A92 PolarHBondContact O-N 3.2Å
89	V	96.6	Very high	95.9	Very high	1 Å²	1	27.8 Å²	27.8	1%	0.006	16%	0.164	C	C	.	.	H	α-helix	trans	-64.6	-47.5	175.9	-179.4	0	0	0	0	110.6	A26 V39 L56 V75 V77 Q85 I86 Q91 A92 I93	A26-V89 HydrophobicContact CB-CG2 4.25Å; V39-V89 HydrophobicContact CG1-CG2 4.04Å; V39-V89 HydrophobicContact CG2-CG1 3.77Å; L56-V89 HydrophobicContact CD1-CB 3.73Å; L56-V89 HydrophobicContact CD1-CG1 3.54Å; V75-V89 HydrophobicContact CB-CG1 4.47Å; V75-V89 HydrophobicContact CG1-CG1 4.22Å; V75-V89 HydrophobicContact CG1-CG2 4.24Å; V75-V89 HydrophobicContact CG2-CG1 4.32Å; V77-V89 HydrophobicContact CG1-CG2 4.45Å; V77-V89 HydrophobicContact CG2-CG2 3.3Å; Q85-V89 WeakPolarHBondContact O-CG2 3.41Å; Q85-V89 PolarHBondContact O-N 3.18Å; I86-V89 PolarHBondContact O-N 3.44Å; V89-Q91 VanDerWaalsContact C-N 3.26Å; V89-Q91 PolarHBondContact O-N 3.26Å; V89-A92 PolarHBondContact O-N 3.13Å; V89-I93 HydrophobicContact CG1-CD1 3.85Å; V89-I93 HydrophobicContact CG1-CG1 4.29Å; V89-I93 WeakPolarHBondContact O-CG1 3.42Å; V89-I93 PolarHBondContact O-N 2.95Å
90	R	95.8	Very high	95.9	Very high	4 Å²	4	26.2 Å²	26.2	2%	0.015	15%	0.145	C	C	.	.	H	α-helix	trans	-50.3	-49.8	174.7	178.1	-153	-88.7	-145.6	-17.4	110.8	K55 L56 E58 P59 I86 A92 I93 A94 D121 L124	K55-R90 VanDerWaalsContact C-NH2 3.26Å; K55-R90 PolarHBondContact O-NE 3.26Å; K55-R90 PolarHBondContact O-NH2 3.05Å; L56-R90 HydrophobicContact CD1-CB 4.17Å; E58-R90 IonicContact OE1-NH2 2.97Å; E58-R90 PolarHBondContact OE1-NH2 2.91Å; E58-R90 IonicContact OE2-CZ 3.24Å; E58-R90 IonicContact OE2-NE 3.06Å; E58-R90 IonicContact OE2-NH1 2.59Å; E58-R90 PolarHBondContact OE2-NH1 2.63Å; E58-R90 IonicContact OE2-NH2 2.83Å; E58-R90 PolarHBondContact OE2-NH2 3.38Å; P59-R90 HydrophobicContact CG-CG 4.23Å; I86-R90 WeakPolarHBondContact O-CB 3.49Å; I86-R90 PolarHBondContact O-N 3.38Å; R90-A92 PolarHBondContact O-N 3.02Å; R90-I93 PolarHBondContact O-N 3.39Å; R90-A94 PolarHBondContact O-N 3.37Å; R90-D121 IonicContact NH1-OD2 2.77Å; R90-D121 PolarHBondContact NH1-OD2 2.94Å; R90-L124 HydrophobicContact CG-CD2 3.5Å
91	Q	97.3	Very high	95.9	Very high	4 Å²	4	25.8 Å²	25.8	2%	0.019	13%	0.133	C	C	.	.	H	α-helix	trans	-63.9	-40.5	178.5	-166.5	-172.5	8	0	0	112.2	R20 Y87 A88 V89 K95 L124 L125 A127	R20-Q91 PolarHBondContact O-OE1 3.22Å; R20-Q91 VanDerWaalsContact O-OE1 3.09Å; Y87-Q91 WeakPolarHBondContact O-CB 3.19Å; Y87-Q91 PolarHBondContact O-N 2.95Å; A88-Q91 PolarHBondContact O-N 2.88Å; V89-Q91 VanDerWaalsContact C-N 3.26Å; V89-Q91 PolarHBondContact O-N 3.26Å; Q91-K95 HydrophobicContact CG-CD 4.38Å; Q91-K95 VanDerWaalsContact NE2-CE 3.25Å; Q91-K95 VanDerWaalsContact NE2-NZ 3.17Å; Q91-K95 WeakPolarHBondContact O-CB 3.26Å; Q91-K95 WeakPolarHBondContact O-CG 3.41Å; Q91-K95 PolarHBondContact O-N 3.33Å; Q91-L124 WeakPolarHBondContact CA-O 3.48Å; Q91-L124 WeakPolarHBondContact CG-O 3.4Å; Q91-L125 PolarHBondContact NE2-O 2.78Å; Q91-L125 VanDerWaalsContact NE2-O 3.14Å; Q91-A127 VanDerWaalsContact NE2-CA 3.28Å
92	A	97.2	Very high	95.9	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-65.8	-39.2	179.9	0	0	0	0	0	112.2	V17 A26 A28 V75 A88 V89 R90 S96	V17-A92 WeakPolarHBondContact CG2-O 3.49Å; A26-A92 HydrophobicContact CB-CB 3.98Å; A28-A92 HydrophobicContact CB-CB 3.87Å; V75-A92 HydrophobicContact CG1-CB 4.47Å; A88-A92 WeakPolarHBondContact O-CB 3.37Å; A88-A92 PolarHBondContact O-N 3.2Å; V89-A92 PolarHBondContact O-N 3.13Å; R90-A92 PolarHBondContact O-N 3.02Å; A92-S96 WeakPolarHBondContact O-CB 3.34Å; A92-S96 PolarHBondContact O-N 3.38Å; A92-S96 PolarHBondContact O-OG 3.18Å
93	I	95.3	Very high	95.9	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-62.8	-52.3	175.6	-67.2	169.6	0	0	0	110	I37 L44 L56 P59 I73 V75 V89 R90 K95 S96 V97	I37-I93 HydrophobicContact CG2-CD1 4.28Å; L44-I93 HydrophobicContact CD1-CD1 4.2Å; L56-I93 HydrophobicContact CD1-CD1 4.21Å; P59-I93 HydrophobicContact CB-CG2 4.38Å; P59-I93 HydrophobicContact CG-CB 4.43Å; P59-I93 HydrophobicContact CG-CG2 4.11Å; I73-I93 HydrophobicContact CD1-CG2 4.24Å; V75-I93 HydrophobicContact CG2-CG1 4.42Å; V89-I93 HydrophobicContact CG1-CD1 3.85Å; V89-I93 HydrophobicContact CG1-CG1 4.29Å; V89-I93 WeakPolarHBondContact O-CG1 3.42Å; V89-I93 PolarHBondContact O-N 2.95Å; R90-I93 PolarHBondContact O-N 3.39Å; I93-K95 PolarHBondContact O-N 3.22Å; I93-S96 PolarHBondContact O-N 3.19Å; I93-S96 PolarHBondContact O-OG 3.24Å; I93-V97 PolarHBondContact O-N 3Å
94	A	95.8	Very high	95.8	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-58.8	-46.3	-179.7	0	0	0	0	0	112.2	P59 R90 S96 V97 V98 F117 L124 L125	P59-A94 HydrophobicContact CB-CB 4.15Å; R90-A94 PolarHBondContact O-N 3.37Å; A94-S96 VanDerWaalsContact C-N 3.29Å; A94-S96 PolarHBondContact O-N 2.81Å; A94-V97 PolarHBondContact O-N 3.37Å; A94-V98 PolarHBondContact O-N 2.91Å; A94-F117 HydrophobicContact CB-CD2 4.27Å; A94-F117 HydrophobicContact CB-CE2 4.01Å; A94-F117 HydrophobicContact CB-CZ 4.2Å; A94-L124 HydrophobicContact CB-CB 3.93Å; A94-L124 HydrophobicContact CB-CD2 4.11Å; A94-L124 WeakPolarHBondContact CB-O 3.4Å; A94-L125 HydrophobicContact CB-CD2 4.34Å
95	K	96.9	Very high	95.6	Very high	39 Å²	39	30.1 Å²	30.1	17%	0.17	14%	0.143	C	C	.	.	H	α-helix	trans	-61.1	-36.3	174.9	-76.1	-178.4	-179.8	179.1	0	113.1	V17 F18 Q91 I93 V97 V98 A99 L125	V17-K95 HydrophobicContact CB-CB 4.14Å; V17-K95 HydrophobicContact CG1-CB 4.42Å; V17-K95 HydrophobicContact CG2-CB 4.02Å; F18-K95 WeakPolarHBondContact O-CD 3.39Å; F18-K95 PolarHBondContact O-NZ 3.02Å; Q91-K95 HydrophobicContact CG-CD 4.38Å; Q91-K95 VanDerWaalsContact NE2-CE 3.25Å; Q91-K95 VanDerWaalsContact NE2-NZ 3.17Å; Q91-K95 WeakPolarHBondContact O-CB 3.26Å; Q91-K95 WeakPolarHBondContact O-CG 3.41Å; Q91-K95 PolarHBondContact O-N 3.33Å; I93-K95 PolarHBondContact O-N 3.22Å; K95-V97 VanDerWaalsContact C-N 3.32Å; K95-V97 PolarHBondContact O-N 3.05Å; K95-V98 PolarHBondContact O-N 3.31Å; K95-A99 VanDerWaalsContact O-CB 3.25Å; K95-A99 WeakPolarHBondContact O-CB 3.36Å; K95-A99 PolarHBondContact O-N 3.14Å; K95-L125 WeakPolarHBondContact CE-O 3.33Å; K95-L125 HydrophobicContact CG-CD2 4.23Å
96	S	95.5	Very high	95.5	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-65.5	-39	-177.2	63.3	0	0	0	0	111.8	I73 A92 I93 A94 F100	I73-S96 WeakPolarHBondContact CD1-OG 3.41Å; A92-S96 WeakPolarHBondContact O-CB 3.34Å; A92-S96 PolarHBondContact O-N 3.38Å; A92-S96 PolarHBondContact O-OG 3.18Å; I93-S96 PolarHBondContact O-N 3.19Å; I93-S96 PolarHBondContact O-OG 3.24Å; A94-S96 VanDerWaalsContact C-N 3.29Å; A94-S96 PolarHBondContact O-N 2.81Å; S96-F100 VanDerWaalsContact O-CB 3.28Å; S96-F100 WeakPolarHBondContact O-CB 3.2Å; S96-F100 PolarHBondContact O-N 3.02Å
97	V	94.4	Very high	95.4	Very high	1 Å²	1	34.4 Å²	34.4	1%	0.006	17%	0.166	C	C	.	.	H	α-helix	trans	-66.1	-50.8	177.1	-178.6	0	0	0	0	110.1	L63 L68 L71 I93 A94 K95 A99 F100 H101 I113	L63-V97 HydrophobicContact CD1-CB 4.17Å; L63-V97 HydrophobicContact CD1-CG1 3.76Å; L63-V97 HydrophobicContact CD1-CG2 3.91Å; L68-V97 HydrophobicContact CD2-CG2 3.72Å; L68-V97 HydrophobicContact CG-CG2 4.42Å; L71-V97 HydrophobicContact CD1-CG2 4.39Å; I93-V97 PolarHBondContact O-N 3Å; A94-V97 PolarHBondContact O-N 3.37Å; K95-V97 VanDerWaalsContact C-N 3.32Å; K95-V97 PolarHBondContact O-N 3.05Å; V97-A99 VanDerWaalsContact C-N 3.31Å; V97-A99 PolarHBondContact O-N 2.9Å; V97-F100 PolarHBondContact O-N 2.93Å; V97-F100 VanDerWaalsContact O-N 3.16Å; V97-H101 PolarHBondContact O-CD2 3.4Å; V97-H101 VanDerWaalsContact O-CD2 3.3Å; V97-H101 PolarHBondContact O-N 3.3Å; V97-I113 HydrophobicContact CG1-CD1 4.09Å; V97-I113 HydrophobicContact CG1-CG2 4.36Å
98	V	95.5	Very high	95.4	Very high	15 Å²	15	36.2 Å²	36.2	9%	0.091	19%	0.186	C	C	.	.	H	α-helix	trans	-57.4	-45.8	179.7	175.1	0	0	0	0	111.5	A94 K95 F100 H101 Q102 K110 I113 F117 L125	A94-V98 PolarHBondContact O-N 2.91Å; K95-V98 PolarHBondContact O-N 3.31Å; V98-F100 VanDerWaalsContact C-N 3.34Å; V98-F100 PolarHBondContact O-N 3.26Å; V98-H101 PolarHBondContact O-N 3.26Å; V98-Q102 WeakPolarHBondContact O-CB 2.81Å; V98-Q102 PolarHBondContact O-N 3.09Å; V98-K110 HydrophobicContact CG1-CG 4.03Å; V98-I113 HydrophobicContact CG2-CG2 3.95Å; V98-F117 HydrophobicContact CG2-CD2 3.89Å; V98-F117 HydrophobicContact CG2-CE2 3.96Å; V98-L125 HydrophobicContact CG2-CD2 3.9Å
99	A	96.4	Very high	95.2	Very high	24 Å²	24	38.3 Å²	38.3	20%	0.198	20%	0.201	C	C	.	.	H	α-helix	trans	-70.7	-29.9	-178.5	0	0	0	0	0	112.7	V15 V17 K95 V97 K103	V15-A99 HydrophobicContact CG1-CB 3.61Å; V17-A99 HydrophobicContact CG1-CB 3.7Å; K95-A99 VanDerWaalsContact O-CB 3.25Å; K95-A99 WeakPolarHBondContact O-CB 3.36Å; K95-A99 PolarHBondContact O-N 3.14Å; V97-A99 VanDerWaalsContact C-N 3.31Å; V97-A99 PolarHBondContact O-N 2.9Å; A99-K103 PolarHBondContact O-N 3.03Å
100	F	95.2	Very high	95.1	Very high	9 Å²	9	39.1 Å²	39.1	4%	0.039	20%	0.204	C	C	.	.	H	α-helix	trans	-68	-49.5	173.5	-171.6	-84.5	0	0	0	111.6	V15 L32 L71 S96 V97 V98 Q102 K103 Y104 V105	V15-F100 HydrophobicContact CG2-CB 4.37Å; V15-F100 HydrophobicContact CG2-CD2 4.12Å; L32-F100 HydrophobicContact CD1-CZ 4.16Å; L32-F100 HydrophobicContact CD2-CE1 4.28Å; L32-F100 HydrophobicContact CD2-CZ 3.69Å; L32-F100 HydrophobicContact CG-CE2 4.12Å; L32-F100 HydrophobicContact CG-CZ 3.61Å; L71-F100 HydrophobicContact CD1-CD1 4.4Å; L71-F100 HydrophobicContact CD1-CG 4.48Å; L71-F100 HydrophobicContact CD2-CD1 3.55Å; L71-F100 HydrophobicContact CD2-CD2 3.75Å; L71-F100 HydrophobicContact CD2-CE1 3.6Å; L71-F100 HydrophobicContact CD2-CE2 3.8Å; L71-F100 HydrophobicContact CD2-CG 3.65Å; L71-F100 HydrophobicContact CD2-CZ 3.75Å; S96-F100 VanDerWaalsContact O-CB 3.28Å; S96-F100 WeakPolarHBondContact O-CB 3.2Å; S96-F100 PolarHBondContact O-N 3.02Å; V97-F100 PolarHBondContact O-N 2.93Å; V97-F100 VanDerWaalsContact O-N 3.16Å; V98-F100 VanDerWaalsContact C-N 3.34Å; V98-F100 PolarHBondContact O-N 3.26Å; F100-Q102 VanDerWaalsContact C-N 3.31Å; F100-Q102 PolarHBondContact O-N 2.94Å; F100-K103 PolarHBondContact O-N 2.84Å; F100-K103 VanDerWaalsContact O-N 3.12Å; F100-Y104 HydrophobicContact CD1-CD2 4.5Å; F100-Y104 AromaticContact CD2-CD2 3.69Å; F100-Y104 HydrophobicContact CD2-CD2 3.69Å; F100-Y104 HydrophobicContact CD2-CE2 4.19Å; F100-Y104 HydrophobicContact CE1-CD2 4.3Å; F100-Y104 AromaticContact CE2-CD2 3.45Å; F100-Y104 HydrophobicContact CE2-CD2 3.45Å; F100-Y104 VanDerWaalsContact CE2-CD2 3.45Å; F100-Y104 HydrophobicContact CE2-CE2 4Å; F100-Y104 HydrophobicContact CE2-CG 4.29Å; F100-Y104 HydrophobicContact CG-CD2 4.19Å; F100-Y104 AromaticContact CZ-CD2 3.76Å; F100-Y104 HydrophobicContact CZ-CD2 3.76Å; F100-Y104 HydrophobicContact CZ-CG 4.17Å; F100-Y104 PolarHBondContact O-N 2.85Å; F100-V105 HydrophobicContact CD1-CG2 4.25Å; F100-V105 HydrophobicContact CE1-CG2 4.11Å
101	H	93.9	Very high	95.1	Very high	30 Å²	30	42 Å²	42	14%	0.139	22%	0.22	C	C	.	.	H	α-helix	trans	-60.6	-41.6	178	-82.1	-96.8	0	0	0	112.1	V97 V98 K103 V105 D106 K110	V97-H101 PolarHBondContact O-CD2 3.4Å; V97-H101 VanDerWaalsContact O-CD2 3.3Å; V97-H101 PolarHBondContact O-N 3.3Å; V98-H101 PolarHBondContact O-N 3.26Å; H101-K103 PolarHBondContact O-N 2.95Å; H101-V105 HydrophobicContact CB-CB 4.46Å; H101-V105 PolarHBondContact O-N 2.89Å; H101-V105 VanDerWaalsContact O-N 3.1Å; H101-D106 PolarHBondContact O-N 3.26Å; H101-K110 HydrophobicContact CB-CB 4.03Å
102	Q	95	Very high	95	Very high	104 Å²	104	47.1 Å²	47.1	49%	0.486	25%	0.245	S	C	.	.	H	α-helix	trans	-58.8	-34.4	175.9	176.7	156.7	17.3	0	0	113.3	V98 F100 E107 K110	V98-Q102 WeakPolarHBondContact O-CB 2.81Å; V98-Q102 PolarHBondContact O-N 3.09Å; F100-Q102 VanDerWaalsContact C-N 3.31Å; F100-Q102 PolarHBondContact O-N 2.94Å; Q102-E107 WeakPolarHBondContact CG-OE1 3.43Å; Q102-K110 HydrophobicContact CB-CD 3.85Å; Q102-K110 HydrophobicContact CB-CG 4.09Å; Q102-K110 VanDerWaalsContact CD-CE 3.46Å; Q102-K110 HydrophobicContact CG-CD 4.21Å; Q102-K110 VanDerWaalsContact NE2-NZ 3.14Å; Q102-K110 VanDerWaalsContact OE1-CE 3.24Å
103	K	95.2	Very high	94.9	Very high	129 Å²	129	48 Å²	48	56%	0.561	25%	0.25	S	C	*	.	H	α-helix	trans	-94.1	-31.2	-173.9	-166.9	175.3	177.2	-166.3	0	113.8	V15 A99 F100 H101	V15-K103 HydrophobicContact CG2-CD 4.17Å; A99-K103 PolarHBondContact O-N 3.03Å; F100-K103 PolarHBondContact O-N 2.84Å; F100-K103 VanDerWaalsContact O-N 3.12Å; H101-K103 PolarHBondContact O-N 2.95Å
104	Y	93.7	Very high	94.9	Very high	72 Å²	72	52.5 Å²	52.5	28%	0.282	27%	0.269	S	S	.	.	H	α-helix	trans	-129.1	-9.1	-165.7	-62	-61.5	0	0	0	115.7	K13 A14 V15 F100	K13-Y104 WeakPolarHBondContact CA-OH 3.37Å; K13-Y104 HydrophobicContact CB-CD1 4.39Å; K13-Y104 HydrophobicContact CB-CE1 3.93Å; K13-Y104 HydrophobicContact CB-CE2 4.3Å; K13-Y104 HydrophobicContact CD-CD1 4.23Å; K13-Y104 HydrophobicContact CD-CE1 4.31Å; K13-Y104 HydrophobicContact CG-CD1 4.24Å; K13-Y104 HydrophobicContact CG-CE1 3.82Å; A14-Y104 PolarHBondContact N-OH 3.25Å; A14-Y104 PolarHBondContact O-OH 3.41Å; V15-Y104 HydrophobicContact CG2-CD2 4.14Å; V15-Y104 HydrophobicContact CG2-CE2 3.61Å; F100-Y104 HydrophobicContact CD1-CD2 4.5Å; F100-Y104 AromaticContact CD2-CD2 3.69Å; F100-Y104 HydrophobicContact CD2-CD2 3.69Å; F100-Y104 HydrophobicContact CD2-CE2 4.19Å; F100-Y104 HydrophobicContact CE1-CD2 4.3Å; F100-Y104 AromaticContact CE2-CD2 3.45Å; F100-Y104 HydrophobicContact CE2-CD2 3.45Å; F100-Y104 VanDerWaalsContact CE2-CD2 3.45Å; F100-Y104 HydrophobicContact CE2-CE2 4Å; F100-Y104 HydrophobicContact CE2-CG 4.29Å; F100-Y104 HydrophobicContact CG-CD2 4.19Å; F100-Y104 AromaticContact CZ-CD2 3.76Å; F100-Y104 HydrophobicContact CZ-CD2 3.76Å; F100-Y104 HydrophobicContact CZ-CG 4.17Å; F100-Y104 PolarHBondContact O-N 2.85Å
105	V	91.2	Very high	94.9	Very high	80 Å²	80	58.8 Å²	58.8	49%	0.485	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.5	-88.5	-177	-165.7	0	0	0	0	109.7	F100 H101	F100-V105 HydrophobicContact CD1-CG2 4.25Å; F100-V105 HydrophobicContact CE1-CG2 4.11Å; H101-V105 HydrophobicContact CB-CB 4.46Å; H101-V105 PolarHBondContact O-N 2.89Å; H101-V105 VanDerWaalsContact O-N 3.1Å
106	D	94.4	Very high	94.8	Very high	61 Å²	61	61 Å²	61	33%	0.326	31%	0.308	S	S	.	.			trans	-167.2	159.2	-179.5	69.5	-75.4	0	0	0	111	H101 C108 S109 K110	H101-D106 PolarHBondContact O-N 3.26Å; D106-C108 WeakPolarHBondContact OD2-CA 3.38Å; D106-C108 VanDerWaalsContact OD2-CB 3.26Å; D106-C108 WeakPolarHBondContact OD2-CB 3.43Å; D106-C108 PolarHBondContact OD2-N 2.81Å; D106-S109 VanDerWaalsContact CG-OG 3.28Å; D106-S109 WeakPolarHBondContact OD1-CB 3.26Å; D106-S109 PolarHBondContact OD1-OG 3.1Å; D106-S109 PolarHBondContact OD2-N 2.88Å; D106-S109 PolarHBondContact OD2-OG 3.04Å; D106-K110 PolarHBondContact O-N 2.8Å
107	E	95	Very high	94.8	Very high	88 Å²	88	61.1 Å²	61.1	41%	0.411	31%	0.309	S	S	.	.	H	α-helix	trans	-73.7	-27.2	-179.3	-80.4	-70.9	142.4	0	0	113.3	Q102 K110 N111	Q102-E107 WeakPolarHBondContact CG-OE1 3.43Å; E107-K110 IonicContact OE1-NZ 2.98Å; E107-K110 PolarHBondContact OE1-NZ 3.02Å; E107-K110 VanDerWaalsContact OE2-CD 3.25Å; E107-K110 WeakPolarHBondContact OE2-CD 3.46Å; E107-K110 IonicContact OE2-NZ 2.65Å; E107-K110 PolarHBondContact OE2-NZ 2.96Å; E107-N111 WeakPolarHBondContact O-CB 3.35Å; E107-N111 VanDerWaalsContact O-CG 3.29Å; E107-N111 PolarHBondContact O-N 3.39Å; E107-N111 PolarHBondContact O-ND2 3.06Å
108	C	95.8	Very high	94.9	Very high	100 Å²	100	64.4 Å²	64.4	68%	0.676	33%	0.328	S	S	*	.	H	α-helix	trans	-68.8	-51.3	-179.8	-176.2	0	0	0	0	111	D106 K110 N111 M112	D106-C108 WeakPolarHBondContact OD2-CA 3.38Å; D106-C108 VanDerWaalsContact OD2-CB 3.26Å; D106-C108 WeakPolarHBondContact OD2-CB 3.43Å; D106-C108 PolarHBondContact OD2-N 2.81Å; C108-K110 VanDerWaalsContact C-N 3.28Å; C108-K110 PolarHBondContact O-N 2.93Å; C108-N111 PolarHBondContact O-N 2.92Å; C108-N111 VanDerWaalsContact O-N 3.14Å; C108-M112 PolarHBondContact O-N 3.01Å
109	S	92.9	Very high	94.9	Very high	43 Å²	43	71.9 Å²	71.9	30%	0.301	36%	0.363	S	S	.	.	H	α-helix	trans	-57.8	-42	175.2	-63.1	0	0	0	0	111.5	D106 M112 I113	D106-S109 VanDerWaalsContact CG-OG 3.28Å; D106-S109 WeakPolarHBondContact OD1-CB 3.26Å; D106-S109 PolarHBondContact OD1-OG 3.1Å; D106-S109 PolarHBondContact OD2-N 2.88Å; D106-S109 PolarHBondContact OD2-OG 3.04Å; S109-M112 PolarHBondContact O-N 3.08Å; S109-I113 VanDerWaalsContact O-CG1 3.27Å; S109-I113 WeakPolarHBondContact O-CG1 3.33Å; S109-I113 PolarHBondContact O-N 2.7Å
110	K	94.9	Very high	94.8	Very high	19 Å²	19	76.2 Å²	76.2	8%	0.083	38%	0.375	C	S	.	.	H	α-helix	trans	-60	-47.6	175.5	170.8	-139	176.3	176.7	0	111.3	V98 H101 Q102 D106 E107 C108 I113 K114	V98-K110 HydrophobicContact CG1-CG 4.03Å; H101-K110 HydrophobicContact CB-CB 4.03Å; Q102-K110 HydrophobicContact CB-CD 3.85Å; Q102-K110 HydrophobicContact CB-CG 4.09Å; Q102-K110 VanDerWaalsContact CD-CE 3.46Å; Q102-K110 HydrophobicContact CG-CD 4.21Å; Q102-K110 VanDerWaalsContact NE2-NZ 3.14Å; Q102-K110 VanDerWaalsContact OE1-CE 3.24Å; D106-K110 PolarHBondContact O-N 2.8Å; E107-K110 IonicContact OE1-NZ 2.98Å; E107-K110 PolarHBondContact OE1-NZ 3.02Å; E107-K110 VanDerWaalsContact OE2-CD 3.25Å; E107-K110 WeakPolarHBondContact OE2-CD 3.46Å; E107-K110 IonicContact OE2-NZ 2.65Å; E107-K110 PolarHBondContact OE2-NZ 2.96Å; C108-K110 VanDerWaalsContact C-N 3.28Å; C108-K110 PolarHBondContact O-N 2.93Å; K110-I113 PolarHBondContact O-N 2.8Å; K110-K114 WeakPolarHBondContact O-CB 3.44Å; K110-K114 PolarHBondContact O-N 2.96Å
111	N	96	Very high	94.8	Very high	65 Å²	65	78 Å²	78	35%	0.348	38%	0.384	S	S	.	.	H	α-helix	trans	-63.9	-42.6	-179.8	-73.2	-20	0	0	0	111.4	E107 C108 I113 K114 E115	E107-N111 WeakPolarHBondContact O-CB 3.35Å; E107-N111 VanDerWaalsContact O-CG 3.29Å; E107-N111 PolarHBondContact O-N 3.39Å; E107-N111 PolarHBondContact O-ND2 3.06Å; C108-N111 PolarHBondContact O-N 2.92Å; C108-N111 VanDerWaalsContact O-N 3.14Å; N111-I113 PolarHBondContact O-N 3.35Å; N111-K114 PolarHBondContact O-N 3.13Å; N111-E115 WeakPolarHBondContact O-CB 3.42Å; N111-E115 WeakPolarHBondContact O-CG 3.41Å; N111-E115 PolarHBondContact O-N 2.96Å
112	M	94.9	Very high	94.9	Very high	111 Å²	111	84.7 Å²	84.7	55%	0.547	41%	0.408	S	S	.	.	H	α-helix	trans	-59.1	-44.8	175.6	-167.2	-168.9	-166.9	0	0	112.2	C108 S109 K116	C108-M112 PolarHBondContact O-N 3.01Å; S109-M112 PolarHBondContact O-N 3.08Å; M112-K116 WeakPolarHBondContact O-CG 3.26Å; M112-K116 PolarHBondContact O-N 3.09Å; M112-K116 VanDerWaalsContact O-N 3.1Å
113	I	94.3	Very high	94.9	Very high	18 Å²	18	81.6 Å²	81.6	9%	0.092	40%	0.398	C	S	.	.	H	α-helix	trans	-65.8	-44.1	177.2	-69.1	170.4	0	0	0	111	L63 V97 V98 S109 K110 N111 K116 F117	L63-I113 HydrophobicContact CD2-CB 4.22Å; L63-I113 HydrophobicContact CD2-CD1 4.06Å; L63-I113 HydrophobicContact CD2-CG1 3.68Å; L63-I113 HydrophobicContact CD2-CG2 3.72Å; V97-I113 HydrophobicContact CG1-CD1 4.09Å; V97-I113 HydrophobicContact CG1-CG2 4.36Å; V98-I113 HydrophobicContact CG2-CG2 3.95Å; S109-I113 VanDerWaalsContact O-CG1 3.27Å; S109-I113 WeakPolarHBondContact O-CG1 3.33Å; S109-I113 PolarHBondContact O-N 2.7Å; K110-I113 PolarHBondContact O-N 2.8Å; N111-I113 PolarHBondContact O-N 3.35Å; I113-K116 PolarHBondContact O-N 2.79Å; I113-F117 HydrophobicContact CG2-CD2 3.74Å; I113-F117 HydrophobicContact CG2-CE2 3.37Å; I113-F117 HydrophobicContact CG2-CZ 4Å; I113-F117 WeakPolarHBondContact O-CD2 3.38Å; I113-F117 WeakPolarHBondContact O-CG 3.24Å; I113-F117 PolarHBondContact O-N 3.38Å
114	K	95.7	Very high	95	Very high	95 Å²	95	75.5 Å²	75.5	41%	0.413	37%	0.372	S	S	.	.	H	α-helix	trans	-62.1	-45.5	-179.9	-177.9	-177.1	175.3	-169.1	0	111	K110 N111 F117 V118 L125	K110-K114 WeakPolarHBondContact O-CB 3.44Å; K110-K114 PolarHBondContact O-N 2.96Å; N111-K114 PolarHBondContact O-N 3.13Å; K114-F117 PolarHBondContact O-N 2.69Å; K114-V118 HydrophobicContact CG-CG2 4.48Å; K114-V118 VanDerWaalsContact O-CG2 3.3Å; K114-V118 WeakPolarHBondContact O-CG2 3.35Å; K114-V118 PolarHBondContact O-N 3.4Å; K114-L125 HydrophobicContact CG-CD1 3.78Å
115	E	96	Very high	95.1	Very high	131 Å²	131	73.3 Å²	73.3	61%	0.612	37%	0.365	S	S	*	.	H	α-helix	trans	-61.8	-46.6	177.5	-76.5	171.2	-168	0	0	111.4	N111 F117 V118 Q119	N111-E115 WeakPolarHBondContact O-CB 3.42Å; N111-E115 WeakPolarHBondContact O-CG 3.41Å; N111-E115 PolarHBondContact O-N 2.96Å; E115-F117 VanDerWaalsContact C-N 3.31Å; E115-F117 PolarHBondContact O-N 3.12Å; E115-V118 PolarHBondContact O-N 3.4Å; E115-Q119 WeakPolarHBondContact O-CB 3.45Å; E115-Q119 PolarHBondContact O-N 3.42Å
116	K	94.7	Very high	95.3	Very high	87 Å²	87	72.8 Å²	72.8	38%	0.378	36%	0.362	S	S	.	.	H	α-helix	trans	-53.9	-47.7	173.5	-76.9	179.6	179.1	-179.1	0	111.9	L62 M112 I113 Y120	L62-K116 HydrophobicContact CD2-CB 4.17Å; L62-K116 WeakPolarHBondContact CD2-O 3.4Å; M112-K116 WeakPolarHBondContact O-CG 3.26Å; M112-K116 PolarHBondContact O-N 3.09Å; M112-K116 VanDerWaalsContact O-N 3.1Å; I113-K116 PolarHBondContact O-N 2.79Å; K116-Y120 PolarHBondContact O-N 2.88Å
117	F	95.7	Very high	95.4	Very high	1 Å²	1	71.8 Å²	71.8	0%	0.004	36%	0.362	C	S	.	.	H	α-helix	trans	-64.8	-42.9	178.4	-70.9	-33.4	0	0	0	113.1	P59 L62 L63 A94 V98 I113 K114 E115 Y120 D121 L124 L125	P59-F117 HydrophobicContact CB-CE1 4.04Å; P59-F117 HydrophobicContact CB-CZ 4.27Å; L62-F117 HydrophobicContact CB-CE1 4.45Å; L62-F117 HydrophobicContact CD2-CD1 3.58Å; L62-F117 HydrophobicContact CD2-CE1 4.08Å; L63-F117 HydrophobicContact CD1-CE1 4.35Å; L63-F117 HydrophobicContact CD1-CE2 4.5Å; L63-F117 HydrophobicContact CD1-CZ 3.63Å; L63-F117 HydrophobicContact CD2-CZ 4.2Å; L63-F117 HydrophobicContact CG-CE1 4.06Å; L63-F117 HydrophobicContact CG-CZ 3.76Å; A94-F117 HydrophobicContact CB-CD2 4.27Å; A94-F117 HydrophobicContact CB-CE2 4.01Å; A94-F117 HydrophobicContact CB-CZ 4.2Å; V98-F117 HydrophobicContact CG2-CD2 3.89Å; V98-F117 HydrophobicContact CG2-CE2 3.96Å; I113-F117 HydrophobicContact CG2-CD2 3.74Å; I113-F117 HydrophobicContact CG2-CE2 3.37Å; I113-F117 HydrophobicContact CG2-CZ 4Å; I113-F117 WeakPolarHBondContact O-CD2 3.38Å; I113-F117 WeakPolarHBondContact O-CG 3.24Å; I113-F117 PolarHBondContact O-N 3.38Å; K114-F117 PolarHBondContact O-N 2.69Å; E115-F117 VanDerWaalsContact C-N 3.31Å; E115-F117 PolarHBondContact O-N 3.12Å; F117-Y120 PolarHBondContact O-N 2.98Å; F117-D121 CarbonylContact O-C 3.23Å; F117-D121 VanDerWaalsContact O-C 3.27Å; F117-D121 PolarHBondContact O-N 3.12Å; F117-L124 HydrophobicContact CB-CB 4.44Å; F117-L124 HydrophobicContact CB-CD1 4.18Å; F117-L124 HydrophobicContact CD1-CD1 3.8Å; F117-L124 HydrophobicContact CG-CD1 4.27Å; F117-L125 HydrophobicContact CB-CD1 4.08Å; F117-L125 HydrophobicContact CB-CG 4.23Å; F117-L125 HydrophobicContact CD2-CD2 4.16Å
118	V	95.4	Very high	95.4	Very high	70 Å²	70	69 Å²	69	42%	0.424	35%	0.35	S	S	.	.	H	α-helix	trans	-66.8	-40.1	-179.8	172.4	0	0	0	0	111.5	K114 E115 Y120 L125	K114-V118 HydrophobicContact CG-CG2 4.48Å; K114-V118 VanDerWaalsContact O-CG2 3.3Å; K114-V118 WeakPolarHBondContact O-CG2 3.35Å; K114-V118 PolarHBondContact O-N 3.4Å; E115-V118 PolarHBondContact O-N 3.4Å; V118-Y120 VanDerWaalsContact C-N 3.33Å; V118-Y120 PolarHBondContact O-N 2.9Å; V118-L125 HydrophobicContact CG2-CD1 3.95Å
119	Q	96	Very high	95.4	Very high	173 Å²	173	69.7 Å²	69.7	81%	0.808	35%	0.353	S	S	*	.	H	α-helix	trans	-64.3	-38.3	178.8	-172.7	179.9	10.8	0	0	111.9	E115	E115-Q119 WeakPolarHBondContact O-CB 3.45Å; E115-Q119 PolarHBondContact O-N 3.42Å
120	Y	95.6	Very high	95.5	Very high	115 Å²	115	76.1 Å²	76.1	45%	0.451	37%	0.371	S	S	.	.	H	α-helix	trans	-77.8	-57.5	178	178.9	-94.4	0	0	0	112.4	E58 L62 K116 F117 V118 L124	E58-Y120 HydrophobicContact CB-CE1 4.33Å; E58-Y120 HydrophobicContact CG-CE1 4.37Å; E58-Y120 PolarHBondContact OE1-OH 3.22Å; E58-Y120 VanDerWaalsContact OE1-OH 3.05Å; E58-Y120 WeakPolarHBondContact OE2-CE1 3.49Å; E58-Y120 PolarHBondContact OE2-OH 3.16Å; L62-Y120 HydrophobicContact CD1-CD2 4.14Å; L62-Y120 HydrophobicContact CD1-CG 4.13Å; L62-Y120 HydrophobicContact CD2-CG 4.36Å; K116-Y120 PolarHBondContact O-N 2.88Å; F117-Y120 PolarHBondContact O-N 2.98Å; V118-Y120 VanDerWaalsContact C-N 3.33Å; V118-Y120 PolarHBondContact O-N 2.9Å; Y120-L124 HydrophobicContact CD1-CD1 4.04Å
121	D	95.3	Very high	95.5	Very high	45 Å²	45	80.9 Å²	80.9	24%	0.241	39%	0.388	C	S	.	.			trans	-156.8	110.4	-179.9	-178.9	2.8	0	0	0	111.2	R90 F117 S123 L124	R90-D121 IonicContact NH1-OD2 2.77Å; R90-D121 PolarHBondContact NH1-OD2 2.94Å; F117-D121 CarbonylContact O-C 3.23Å; F117-D121 VanDerWaalsContact O-C 3.27Å; F117-D121 PolarHBondContact O-N 3.12Å; D121-S123 PolarHBondContact O-N 3.1Å; D121-S123 WeakPolarHBondContact OD1-CA 3.44Å; D121-S123 WeakPolarHBondContact OD1-CB 3.37Å; D121-S123 PolarHBondContact OD1-N 3.31Å; D121-S123 PolarHBondContact OD1-OG 2.79Å; D121-S123 PolarHBondContact OD2-OG 2.83Å; D121-L124 HydrophobicContact CB-CD1 4.26Å; D121-L124 HydrophobicContact CB-CG 4.26Å; D121-L124 VanDerWaalsContact O-CB 3.31Å; D121-L124 WeakPolarHBondContact O-CB 3.2Å; D121-L124 WeakPolarHBondContact O-CG 3.36Å; D121-L124 PolarHBondContact O-N 3.47Å
122	R	95.6	Very high	95.4	Very high	172 Å²	172	83.6 Å²	83.6	65%	0.649	41%	0.411	S	S	*	.	G	3₁₀ helix	trans	-56	-26	176.2	-168.9	177.5	176.7	-153.2	0.1	113.1	L124 L125 V126	R122-L124 PolarHBondContact O-N 2.84Å; R122-L125 PolarHBondContact O-N 3.22Å; R122-V126 HydrophobicContact CG-CB 4.21Å; R122-V126 HydrophobicContact CG-CG2 3.9Å; R122-V126 PolarHBondContact O-N 2.82Å
123	S	95.4	Very high	95.5	Very high	38 Å²	38	83 Å²	83	27%	0.266	41%	0.406	S	S	.	.	G	3₁₀ helix	trans	-67.5	-16	179.7	89.8	0	0	0	0	114	D121 L125 V126	D121-S123 PolarHBondContact O-N 3.1Å; D121-S123 WeakPolarHBondContact OD1-CA 3.44Å; D121-S123 WeakPolarHBondContact OD1-CB 3.37Å; D121-S123 PolarHBondContact OD1-N 3.31Å; D121-S123 PolarHBondContact OD1-OG 2.79Å; D121-S123 PolarHBondContact OD2-OG 2.83Å; S123-L125 VanDerWaalsContact C-N 3.28Å; S123-L125 PolarHBondContact O-N 3.32Å; S123-V126 CarbonylContact C-O 3.59Å; S123-V126 WeakPolarHBondContact CA-O 3.34Å
124	L	95.8	Very high	95.6	Very high	1 Å²	1	87.2 Å²	87.2	1%	0.005	44%	0.435	C	S	.	.	G	3₁₀ helix	trans	-63.8	-33.3	172.6	-72.8	170.1	0	0	0	112.6	P59 R90 Q91 A94 F117 Y120 D121 R122	P59-L124 HydrophobicContact CB-CD2 4.24Å; P59-L124 HydrophobicContact CG-CD2 4.36Å; R90-L124 HydrophobicContact CG-CD2 3.5Å; Q91-L124 WeakPolarHBondContact CA-O 3.48Å; Q91-L124 WeakPolarHBondContact CG-O 3.4Å; A94-L124 HydrophobicContact CB-CB 3.93Å; A94-L124 HydrophobicContact CB-CD2 4.11Å; A94-L124 WeakPolarHBondContact CB-O 3.4Å; F117-L124 HydrophobicContact CB-CB 4.44Å; F117-L124 HydrophobicContact CB-CD1 4.18Å; F117-L124 HydrophobicContact CD1-CD1 3.8Å; F117-L124 HydrophobicContact CG-CD1 4.27Å; Y120-L124 HydrophobicContact CD1-CD1 4.04Å; D121-L124 HydrophobicContact CB-CD1 4.26Å; D121-L124 HydrophobicContact CB-CG 4.26Å; D121-L124 VanDerWaalsContact O-CB 3.31Å; D121-L124 WeakPolarHBondContact O-CB 3.2Å; D121-L124 WeakPolarHBondContact O-CG 3.36Å; D121-L124 PolarHBondContact O-N 3.47Å; R122-L124 PolarHBondContact O-N 2.84Å
125	L	96.3	Very high	95.6	Very high	27 Å²	27	89.3 Å²	89.3	14%	0.141	45%	0.445	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.8	-39.2	-178.9	-62	178.2	0	0	0	111.5	Q91 A94 K95 V98 K114 F117 V118 R122 S123	Q91-L125 PolarHBondContact NE2-O 2.78Å; Q91-L125 VanDerWaalsContact NE2-O 3.14Å; A94-L125 HydrophobicContact CB-CD2 4.34Å; K95-L125 WeakPolarHBondContact CE-O 3.33Å; K95-L125 HydrophobicContact CG-CD2 4.23Å; V98-L125 HydrophobicContact CG2-CD2 3.9Å; K114-L125 HydrophobicContact CG-CD1 3.78Å; F117-L125 HydrophobicContact CB-CD1 4.08Å; F117-L125 HydrophobicContact CB-CG 4.23Å; F117-L125 HydrophobicContact CD2-CD2 4.16Å; V118-L125 HydrophobicContact CG2-CD1 3.95Å; R122-L125 PolarHBondContact O-N 3.22Å; S123-L125 VanDerWaalsContact C-N 3.28Å; S123-L125 PolarHBondContact O-N 3.32Å
126	V	96.4	Very high	95.6	Very high	69 Å²	69	89.5 Å²	89.5	42%	0.418	44%	0.443	S	S	.	.	S	Bend	trans	-97.9	131.2	-176.3	-175.1	0	0	0	0	110.5	R122 S123	R122-V126 HydrophobicContact CG-CB 4.21Å; R122-V126 HydrophobicContact CG-CG2 3.9Å; R122-V126 PolarHBondContact O-N 2.82Å; S123-V126 CarbonylContact C-O 3.59Å; S123-V126 WeakPolarHBondContact CA-O 3.34Å
127	A	95.8	Very high	95.6	Very high	40 Å²	40	94.3 Å²	94.3	33%	0.331	47%	0.465	S	S	.	.	P	Polyproline II helix	trans	-74.4	140.9	178.9	0	0	0	0	0	110.5	Q91 P129	Q91-A127 VanDerWaalsContact NE2-CA 3.28Å; A127-P129 WeakPolarHBondContact O-CD 3.36Å
128	D	94.7	Very high	95.5	Very high	30 Å²	30	96.2 Å²	96.2	16%	0.16	48%	0.484	C	S	.	.	B	Isolated β-bridge	trans	-72.1	118.4	172.9	-174.8	-17.5	0	0	0	109.7	K21 R130	K21-D128 HydrophobicContact CD-CB 3.94Å; K21-D128 IonicContact NZ-OD2 3.67Å; K21-D128 PolarHBondContact NZ-OD2 3.29Å; D128-R130 PolarHBondContact O-N 2.98Å; D128-R130 WeakPolarHBondContact OD1-CB 3.41Å; D128-R130 VanDerWaalsContact OD1-CG 3.24Å; D128-R130 WeakPolarHBondContact OD1-CG 3.2Å; D128-R130 IonicContact OD1-CZ 3.01Å; D128-R130 PolarHBondContact OD1-N 2.67Å; D128-R130 VanDerWaalsContact OD1-N 3.08Å; D128-R130 IonicContact OD1-NE 3.92Å; D128-R130 PolarHBondContact OD1-NE 3.39Å; D128-R130 IonicContact OD2-CZ 3.06Å; D128-R130 VanDerWaalsContact OD2-CZ 3.3Å; D128-R130 IonicContact OD2-NE 2.99Å; D128-R130 PolarHBondContact OD2-NE 3.01Å; D128-R130 IonicContact OD2-NH2 3.01Å; D128-R130 PolarHBondContact OD2-NH2 3.18Å
129	P	95.5	Very high	95.5	Very high	114 Å²	114	93 Å²	93	74%	0.74	47%	0.465	S	S	*	.			trans	-72.6	-15.1	-174.7	29.2	-35.3	0	0	0	113.4	A127 R131	A127-P129 WeakPolarHBondContact O-CD 3.36Å; P129-R131 PolarHBondContact O-N 2.87Å
130	R	95.1	Very high	95.4	Very high	178 Å²	178	88.9 Å²	88.9	67%	0.672	46%	0.455	S	S	*	.			trans	-59.8	134.3	-171.2	-67.2	179.4	-66.9	179.3	-1.6	113.2	D128	D128-R130 PolarHBondContact O-N 2.98Å; D128-R130 WeakPolarHBondContact OD1-CB 3.41Å; D128-R130 VanDerWaalsContact OD1-CG 3.24Å; D128-R130 WeakPolarHBondContact OD1-CG 3.2Å; D128-R130 IonicContact OD1-CZ 3.01Å; D128-R130 PolarHBondContact OD1-N 2.67Å; D128-R130 VanDerWaalsContact OD1-N 3.08Å; D128-R130 IonicContact OD1-NE 3.92Å; D128-R130 PolarHBondContact OD1-NE 3.39Å; D128-R130 IonicContact OD2-CZ 3.06Å; D128-R130 VanDerWaalsContact OD2-CZ 3.3Å; D128-R130 IonicContact OD2-NE 2.99Å; D128-R130 PolarHBondContact OD2-NE 3.01Å; D128-R130 IonicContact OD2-NH2 3.01Å; D128-R130 PolarHBondContact OD2-NH2 3.18Å
131	R	95.4	Very high	95.4	Very high	118 Å²	118	84.5 Å²	84.5	45%	0.445	45%	0.445	S	S	.	.			trans	-133.1	160.7	177.4	-60.5	-63.7	168.6	162.3	-17.1	110.5	K22 P129 E133	K22-R131 VanDerWaalsContact C-CZ 3.42Å; K22-R131 PolarHBondContact O-NH1 2.85Å; K22-R131 PolarHBondContact O-NH2 2.77Å; P129-R131 PolarHBondContact O-N 2.87Å; R131-E133 PolarHBondContact O-N 3.01Å
132	C	94.8	Very high	95.4	Very high	122 Å²	122	83.4 Å²	83.4	82%	0.824	44%	0.443	S	S	*	.	P	Polyproline II helix	trans	-68.1	129.6	174.1	-65.5	0	0	0	0	109.7
133	E	95.3	Very high	95.3	Very high	98 Å²	98	84.2 Å²	84.2	46%	0.458	45%	0.446	S	S	.	.	P	Polyproline II helix	trans	-67.7	143.4	169.8	-66.4	-179.4	-179.2	0	0	109.7	R131 A142 R143	R131-E133 PolarHBondContact O-N 3.01Å; E133-A142 HydrophobicContact CB-CB 3.62Å; E133-R143 IonicContact OE1-CZ 3.3Å; E133-R143 IonicContact OE1-NE 3.63Å; E133-R143 IonicContact OE1-NH2 2.69Å; E133-R143 PolarHBondContact OE1-NH2 3.22Å; E133-R143 IonicContact OE2-CZ 3.95Å; E133-R143 IonicContact OE2-NE 3.74Å; E133-R143 PolarHBondContact OE2-NE 3.45Å; E133-R143 IonicContact OE2-NH2 2.7Å
134	P	96.7	Very high	95.3	Very high	108 Å²	108	85 Å²	85	70%	0.701	46%	0.455	S	S	*	.	P	Polyproline II helix	trans	-66.6	150.4	176	28.4	-34.4	0	0	0	111.4	A142	P134-A142 WeakPolarHBondContact O-CA 3.46Å; P134-A142 WeakPolarHBondContact O-CB 3.33Å
135	K	96.2	Very high	95.2	Very high	139 Å²	139	94 Å²	94	60%	0.604	49%	0.489	S	S	*	.	P	Polyproline II helix	trans	-66.1	135.3	174.7	-179.8	-177.3	177.5	-174.3	0	110.2	G139	K135-G139 WeakPolarHBondContact CE-O 3.36Å
136	K	95.1	Very high	95.2	Very high	134 Å²	134	100.2 Å²	100.2	58%	0.583	51%	0.511	S	S	*	.	P	Polyproline II helix	trans	-95.8	149.4	169.6	-62.6	-177.2	-173.6	-180	0	109.7	G141 A142	K136-G141 PolarHBondContact N-O 3.45Å; K136-A142 WeakPolarHBondContact CD-O 3.42Å; K136-A142 WeakPolarHBondContact CG-O 3.32Å
137	F	94.9	Very high	95.1	Very high	189 Å²	189	105.8 Å²	105.8	83%	0.829	53%	0.532	S	S	*	.	S	Bend	trans	-66.5	158.1	175.1	62.7	-93.2	0	0	0	111.1
138	G	94.4	Very high	95	Very high	41 Å²	41	110.2 Å²	110.2	42%	0.423	54%	0.544	S	S	.	.	S	Bend	trans	79.3	20.8	-179.7	0	0	0	0	0	115	Y146	G138-Y146 PolarHBondContact O-N 3.29Å
139	G	94.4	Very high	95	Very high	1 Å²	1	114.2 Å²	114.2	1%	0.01	58%	0.575	C	S	.	*	S	Bend	trans	-172.1	174.2	174.4	0	0	0	0	0	113.2	K135 A144	K135-G139 WeakPolarHBondContact CE-O 3.36Å; G139-A144 VanDerWaalsContact CA-O 3.32Å; G139-A144 WeakPolarHBondContact CA-O 2.99Å
140	S	95.2	Very high	94.9	Very high	87 Å²	87	117.8 Å²	117.8	61%	0.608	58%	0.575	S	S	*	*	S	Bend	trans	-78.4	-21.1	-177.9	55.8	0	0	0	0	113.5
141	G	95.4	Very high	94.3	Very high	23 Å²	23	124.4 Å²	124.4	24%	0.237	60%	0.6	C	S	.	*	S	Bend	trans	-137.2	-168.3	-172	0	0	0	0	0	115	K136 R143	K136-G141 PolarHBondContact N-O 3.45Å; G141-R143 VanDerWaalsContact C-N 3.3Å; G141-R143 PolarHBondContact O-N 3.37Å
142	A	95.2	Very high	94.2	Very high	23 Å²	23	124.7 Å²	124.7	19%	0.19	61%	0.607	C	S	.	*	S	Bend	trans	-65.4	-33.3	179.1	0	0	0	0	0	113	E133 P134 K136	E133-A142 HydrophobicContact CB-CB 3.62Å; P134-A142 WeakPolarHBondContact O-CA 3.46Å; P134-A142 WeakPolarHBondContact O-CB 3.33Å; K136-A142 WeakPolarHBondContact CD-O 3.42Å; K136-A142 WeakPolarHBondContact CG-O 3.32Å
143	R	94.6	Very high	94.2	Very high	189 Å²	189	124.8 Å²	124.8	71%	0.713	60%	0.596	S	S	*	*	S	Bend	trans	-128.2	-25.4	-178.8	-57.6	-174.6	-173.4	-164	0.9	114	E133 G141 R145	E133-R143 IonicContact OE1-CZ 3.3Å; E133-R143 IonicContact OE1-NE 3.63Å; E133-R143 IonicContact OE1-NH2 2.69Å; E133-R143 PolarHBondContact OE1-NH2 3.22Å; E133-R143 IonicContact OE2-CZ 3.95Å; E133-R143 IonicContact OE2-NE 3.74Å; E133-R143 PolarHBondContact OE2-NE 3.45Å; E133-R143 IonicContact OE2-NH2 2.7Å; G141-R143 VanDerWaalsContact C-N 3.3Å; G141-R143 PolarHBondContact O-N 3.37Å; R143-R145 PolarHBondContact O-N 3.46Å
144	A	95.4	Very high	94.1	Very high	55 Å²	55	126.3 Å²	126.3	46%	0.455	60%	0.604	S	S	.	*			trans	-64.7	130.7	176.8	0	0	0	0	0	110.1	G139	G139-A144 VanDerWaalsContact CA-O 3.32Å; G139-A144 WeakPolarHBondContact CA-O 2.99Å
145	R	93.5	Very high	94	Very high	190 Å²	190	127.4 Å²	127.4	72%	0.717	60%	0.598	S	S	*	*			trans	-108.8	156.1	174.1	-63.9	-116.5	-174	-176.6	3	109.2	R143	R143-R145 PolarHBondContact O-N 3.46Å
146	Y	94.8	Very high	93.8	Very high	157 Å²	157	126.7 Å²	126.7	62%	0.616	60%	0.597	S	S	*	*	P	Polyproline II helix	trans	-62.6	144.2	169.6	-62.8	-54.8	0	0	0	110.3	G138 K148	G138-Y146 PolarHBondContact O-N 3.29Å; Y146-K148 PolarHBondContact O-N 3.42Å
147	Q	94.5	Very high	93.8	Very high	185 Å²	185	126.2 Å²	126.2	86%	0.864	60%	0.598	S	S	*	*	P	Polyproline II helix	trans	-58.6	122.8	179.3	-178	65.2	15.4	0	0	109.3
148	K	94.2	Very high	93.7	Very high	133 Å²	133	121.7 Å²	121.7	58%	0.578	58%	0.582	S	S	*	*	P	Polyproline II helix	trans	-82.5	123.9	174.9	-175	173.7	176.7	-175.4	0	108.9	Y146 Y150	Y146-K148 PolarHBondContact O-N 3.42Å; K148-Y150 HydrophobicContact CB-CE2 4.48Å; K148-Y150 HydrophobicContact CD-CD1 4.49Å; K148-Y150 HydrophobicContact CD-CE1 3.82Å; K148-Y150 HydrophobicContact CD-CE2 4.46Å; K148-Y150 HydrophobicContact CG-CE1 4.37Å; K148-Y150 HydrophobicContact CG-CE2 4.36Å
149	S	95.3	Very high	93.6	Very high	114 Å²	114	127.9 Å²	127.9	80%	0.797	59%	0.594	S	S	*	*	P	Polyproline II helix	trans	-85.9	135.3	162.7	49.6	0	0	0	0	109
150	Y	92.6	Very high	93.6	Very high	189 Å²	189	138.5 Å²	138.5	74%	0.741	64%	0.643	S	S	*	*	P	Polyproline II helix	trans	-99.2	144.1	173.4	-64	-88.3	0	0	0	108.6	K148	K148-Y150 HydrophobicContact CB-CE2 4.48Å; K148-Y150 HydrophobicContact CD-CD1 4.49Å; K148-Y150 HydrophobicContact CD-CE1 3.82Å; K148-Y150 HydrophobicContact CD-CE2 4.46Å; K148-Y150 HydrophobicContact CG-CE1 4.37Å; K148-Y150 HydrophobicContact CG-CE2 4.36Å
151	R	82	Confident	93.4	Very high	317 Å²	317	143.2 Å²	143.2	100%	1.196	65%	0.646	S	S	*	*			trans	-118	0	169.6	179.4	176.4	179.2	175.1	0.7	107.9

Retrieved 151 of 151 residues in 107.8 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).