A0A077ZJK7_TRITR Loading...

Zf-BED domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZJK7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 140 aa.

						>A0A077ZJK7_TRITR|A0A077ZJK7
MAQVSKKCRQYNSEYLRLGLAVMPGTEHVPVCLLCERVFSNGSMKPSRLKRHLIRRHPNMSNGTAPVDQQFWLQKEIPELYPGVWDVVKKLLICLPSTSLVECAFSIVTDLVTQKRSQLQIVRRGHLRLRVTLIEPTSTG
					

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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	37.8	Very low	46.5	Very low	245 Å²	245	154.2 Å²	154.2	100%	1.207	79%	0.789	S	S	*	*				0	110.3	0	-68.4	172.5	169.1	0	0	107.9
2	A	42.9	Very low	47.5	Very low	101 Å²	101	146.9 Å²	146.9	84%	0.835	75%	0.753	S	S	*	*			trans	-75.4	124	-172.3	0	0	0	0	0	111.1	V4	A2-V4 PolarHBondContact O-N 3.4Å; A2-V4 VanDerWaalsContact O-N 3.15Å
3	Q	44.4	Very low	48.4	Very low	193 Å²	193	139.9 Å²	139.9	90%	0.902	73%	0.725	S	S	*	*			trans	-66.8	108.7	175.1	-74.5	-175.7	-35.1	0	0	110.1	S5	Q3-S5 VanDerWaalsContact C-N 3.33Å; Q3-S5 PolarHBondContact O-N 3.46Å
4	V	43.7	Very low	49.4	Very low	129 Å²	129	135.1 Å²	135.1	78%	0.782	70%	0.698	S	S	*	*			trans	-72.3	91.6	165.2	177	0	0	0	0	107.5	A2 K6	A2-V4 PolarHBondContact O-N 3.4Å; A2-V4 VanDerWaalsContact O-N 3.15Å; V4-K6 PolarHBondContact O-N 2.78Å; V4-K6 VanDerWaalsContact O-N 3.11Å
5	S	44.4	Very low	50.4	Low	108 Å²	108	127.2 Å²	127.2	76%	0.755	66%	0.655	S	S	*	*			trans	-70.8	102.1	169.6	-173.9	0	0	0	0	108.7	Q3 K7	Q3-S5 VanDerWaalsContact C-N 3.33Å; Q3-S5 PolarHBondContact O-N 3.46Å; S5-K7 PolarHBondContact O-N 3.04Å
6	K	46	Very low	51.2	Low	185 Å²	185	121.3 Å²	121.3	80%	0.804	63%	0.625	S	S	*	*			trans	-63.8	103.8	166.4	-74.7	-176.8	179	177	0	107.1	V4 C8	V4-K6 PolarHBondContact O-N 2.78Å; V4-K6 VanDerWaalsContact O-N 3.11Å; K6-C8 VanDerWaalsContact C-N 3.3Å; K6-C8 PolarHBondContact O-N 3.17Å
7	K	41.9	Very low	51.8	Low	196 Å²	196	121.8 Å²	121.8	85%	0.852	62%	0.617	S	S	*	*			trans	-64.8	87.6	177.9	-152	174	-169	176.3	0	108.9	S5 R9	S5-K7 PolarHBondContact O-N 3.04Å; K7-R9 PolarHBondContact O-N 3.38Å
8	C	49.4	Very low	52.4	Low	109 Å²	109	116.3 Å²	116.3	74%	0.736	59%	0.589	S	S	*	*			trans	-60.8	120.3	166.6	-81.8	0	0	0	0	107.6	K6 Q10	K6-C8 VanDerWaalsContact C-N 3.3Å; K6-C8 PolarHBondContact O-N 3.17Å; C8-Q10 PolarHBondContact O-N 2.77Å; C8-Q10 VanDerWaalsContact O-N 3.12Å
9	R	52.2	Low	53.1	Low	158 Å²	158	110.2 Å²	110.2	60%	0.596	56%	0.558	S	S	*	*			trans	-68.5	111.2	175.4	-68.4	-178.9	177.6	-159.7	-0.2	107.1	K7 Y11 M44	K7-R9 PolarHBondContact O-N 3.38Å; R9-Y11 PolarHBondContact O-N 2.89Å; R9-M44 HydrophobicContact CB-CE 3.83Å
10	Q	53.8	Low	53.9	Low	184 Å²	184	104.7 Å²	104.7	86%	0.86	53%	0.531	S	S	*	.	P	Polyproline II helix	trans	-53.2	137.1	170.9	-77.2	174	-17.5	0	0	109.3	C8 N12	C8-Q10 PolarHBondContact O-N 2.77Å; C8-Q10 VanDerWaalsContact O-N 3.12Å; Q10-N12 PolarHBondContact O-N 3.3Å
11	Y	55.2	Low	54.6	Low	88 Å²	88	101.1 Å²	101.1	35%	0.345	52%	0.517	S	S	.	.	P	Polyproline II helix	trans	-59.5	120.7	174	-170.1	-102.3	0	0	0	108.5	R9 Y15 L16 L20 V22	R9-Y11 PolarHBondContact O-N 2.89Å; Y11-Y15 HydrophobicContact CD2-CD2 4.17Å; Y11-Y15 HydrophobicContact CE2-CD2 4.19Å; Y11-L16 HydrophobicContact CE1-CD1 3.65Å; Y11-L16 HydrophobicContact CE1-CD2 4.45Å; Y11-L16 HydrophobicContact CE1-CG 3.7Å; Y11-L16 WeakPolarHBondContact OH-CD2 3.22Å; Y11-L16 WeakPolarHBondContact OH-CG 3.44Å; Y11-L20 PolarHBondContact OH-O 3.21Å; Y11-V22 HydrophobicContact CD2-CG2 3.95Å; Y11-V22 HydrophobicContact CE2-CB 4.45Å; Y11-V22 HydrophobicContact CE2-CG2 3.69Å
12	N	58.5	Low	55.9	Low	67 Å²	67	91.4 Å²	91.4	36%	0.358	47%	0.471	S	S	.	.	P	Polyproline II helix	trans	-85.3	127.3	177.6	-171.9	-28.3	0	0	0	107.9	Q10 E14 Y15	Q10-N12 PolarHBondContact O-N 3.3Å; N12-E14 PolarHBondContact O-N 2.67Å; N12-E14 WeakPolarHBondContact OD1-CB 3.28Å; N12-E14 WeakPolarHBondContact OD1-CG 3.24Å; N12-E14 PolarHBondContact OD1-N 2.9Å; N12-Y15 HydrophobicContact CB-CD2 3.88Å; N12-Y15 HydrophobicContact CB-CE2 3.57Å; N12-Y15 WeakPolarHBondContact O-CB 3.16Å; N12-Y15 WeakPolarHBondContact O-CD2 3.38Å; N12-Y15 PolarHBondContact O-N 3.09Å
13	S	58.8	Low	56.6	Low	56 Å²	56	91.2 Å²	91.2	39%	0.392	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-23.2	176.3	52.3	0	0	0	0	113.2	Y15 L16 R17	S13-Y15 PolarHBondContact O-N 3.23Å; S13-L16 PolarHBondContact O-N 3.37Å; S13-R17 PolarHBondContact O-N 2.99Å
14	E	62.4	Low	57	Low	73 Å²	73	86.5 Å²	86.5	34%	0.341	44%	0.44	S	S	.	.	H	α-helix	trans	-58.6	-24.7	172.3	-64.9	-72	103.5	0	0	113	N12 R17 L18	N12-E14 PolarHBondContact O-N 2.67Å; N12-E14 WeakPolarHBondContact OD1-CB 3.28Å; N12-E14 WeakPolarHBondContact OD1-CG 3.24Å; N12-E14 PolarHBondContact OD1-N 2.9Å; E14-R17 PolarHBondContact O-N 3.13Å; E14-R17 WeakPolarHBondContact OE1-CD 3.5Å; E14-R17 IonicContact OE1-CZ 3.36Å; E14-R17 IonicContact OE1-NE 3.57Å; E14-R17 IonicContact OE1-NH1 2.67Å; E14-R17 PolarHBondContact OE1-NH1 3.08Å; E14-L18 WeakPolarHBondContact O-CB 3.48Å; E14-L18 WeakPolarHBondContact O-CD1 3.07Å; E14-L18 WeakPolarHBondContact O-CG 3.04Å; E14-L18 PolarHBondContact O-N 3.42Å; E14-L18 VanDerWaalsContact O-N 3.14Å
15	Y	64.7	Low	57.7	Low	16 Å²	16	84.4 Å²	84.4	6%	0.063	45%	0.445	C	S	.	.	H	α-helix	trans	-68.8	-37.8	177.5	-63.4	-53.7	0	0	0	112.8	Y11 N12 S13 L18 G19 L20 M44 L49	Y11-Y15 HydrophobicContact CD2-CD2 4.17Å; Y11-Y15 HydrophobicContact CE2-CD2 4.19Å; N12-Y15 HydrophobicContact CB-CD2 3.88Å; N12-Y15 HydrophobicContact CB-CE2 3.57Å; N12-Y15 WeakPolarHBondContact O-CB 3.16Å; N12-Y15 WeakPolarHBondContact O-CD2 3.38Å; N12-Y15 PolarHBondContact O-N 3.09Å; S13-Y15 PolarHBondContact O-N 3.23Å; Y15-L18 CarbonylContact O-C 3.49Å; Y15-L18 WeakPolarHBondContact O-CA 3.16Å; Y15-L18 WeakPolarHBondContact O-CB 3.17Å; Y15-L18 PolarHBondContact O-N 3.4Å; Y15-G19 PolarHBondContact O-N 3.17Å; Y15-L20 PolarHBondContact O-N 3.16Å; Y15-M44 HydrophobicContact CE1-CG 3.97Å; Y15-M44 HydrophobicContact CE2-CG 3.94Å; Y15-M44 HydrophobicContact CE2-SD 4.37Å; Y15-M44 PolarHBondContact OH-O 3.49Å; Y15-L49 HydrophobicContact CD1-CD2 3.35Å; Y15-L49 HydrophobicContact CE1-CD2 3.66Å; Y15-L49 HydrophobicContact CG-CD2 4.43Å
16	L	62.7	Low	58.2	Low	32 Å²	32	83.2 Å²	83.2	17%	0.168	43%	0.433	C	S	.	.	H	α-helix	trans	-71	-36.2	176.6	-72.5	167.5	0	0	0	111.3	Y11 S13 L18 G19 E102	Y11-L16 HydrophobicContact CE1-CD1 3.65Å; Y11-L16 HydrophobicContact CE1-CD2 4.45Å; Y11-L16 HydrophobicContact CE1-CG 3.7Å; Y11-L16 WeakPolarHBondContact OH-CD2 3.22Å; Y11-L16 WeakPolarHBondContact OH-CG 3.44Å; S13-L16 PolarHBondContact O-N 3.37Å; L16-L18 PolarHBondContact O-N 2.78Å; L16-G19 PolarHBondContact O-N 3.04Å; L16-E102 WeakPolarHBondContact CD1-OE1 3.28Å; L16-E102 WeakPolarHBondContact CD1-OE2 3.3Å
17	R	61.4	Low	58.9	Low	131 Å²	131	82.6 Å²	82.6	49%	0.494	43%	0.433	S	S	.	.	H	α-helix	trans	-62.6	-19.2	168.3	-64.9	-173.6	-176.4	164.3	6.1	113.1	S13 E14 V67	S13-R17 PolarHBondContact O-N 2.99Å; E14-R17 PolarHBondContact O-N 3.13Å; E14-R17 WeakPolarHBondContact OE1-CD 3.5Å; E14-R17 IonicContact OE1-CZ 3.36Å; E14-R17 IonicContact OE1-NE 3.57Å; E14-R17 IonicContact OE1-NH1 2.67Å; E14-R17 PolarHBondContact OE1-NH1 3.08Å; R17-V67 WeakPolarHBondContact O-CB 3.33Å; R17-V67 WeakPolarHBondContact O-CG2 3.29Å
18	L	62.9	Low	60	Low	22 Å²	22	79.6 Å²	79.6	12%	0.115	42%	0.422	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	4.7	176.1	-70.6	172.4	0	0	0	111.5	E14 Y15 L16 L20 P46 L49 K50 L53	E14-L18 WeakPolarHBondContact O-CB 3.48Å; E14-L18 WeakPolarHBondContact O-CD1 3.07Å; E14-L18 WeakPolarHBondContact O-CG 3.04Å; E14-L18 PolarHBondContact O-N 3.42Å; E14-L18 VanDerWaalsContact O-N 3.14Å; Y15-L18 CarbonylContact O-C 3.49Å; Y15-L18 WeakPolarHBondContact O-CA 3.16Å; Y15-L18 WeakPolarHBondContact O-CB 3.17Å; Y15-L18 PolarHBondContact O-N 3.4Å; L16-L18 PolarHBondContact O-N 2.78Å; L18-L20 VanDerWaalsContact C-N 3.31Å; L18-L20 HydrophobicContact CB-CD1 3.5Å; L18-L20 VanDerWaalsContact CB-CD1 3.5Å; L18-L20 WeakPolarHBondContact O-CD1 3.48Å; L18-L20 PolarHBondContact O-N 2.98Å; L18-P46 HydrophobicContact CD1-CB 4.29Å; L18-L49 HydrophobicContact CD1-CB 4.1Å; L18-K50 HydrophobicContact CD2-CB 4.1Å; L18-K50 HydrophobicContact CD2-CG 4.34Å; L18-L53 HydrophobicContact CB-CD1 3.76Å; L18-L53 HydrophobicContact CD2-CD1 3.56Å; L18-L53 HydrophobicContact CG-CD1 4.24Å; L18-L53 WeakPolarHBondContact O-CD1 3.43Å
19	G	66.3	Low	60.9	Low	0 Å²	0	75.5 Å²	75.5	0%	0	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.1	30	-178.3	0	0	0	0	0	113.2	Y15 L16 L33	Y15-G19 PolarHBondContact O-N 3.17Å; L16-G19 PolarHBondContact O-N 3.04Å; G19-L33 VanDerWaalsContact O-CB 3.29Å; G19-L33 WeakPolarHBondContact O-CB 3.33Å; G19-L33 WeakPolarHBondContact O-CG 3.44Å; G19-L33 PolarHBondContact O-N 3.24Å
20	L	69.2	Low	61.7	Low	1 Å²	1	68.2 Å²	68.2	1%	0.005	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	139.4	179.3	-70.1	124.1	0	0	0	110.4	Y11 Y15 L18 V31 C32 F39 L49	Y11-L20 PolarHBondContact OH-O 3.21Å; Y15-L20 PolarHBondContact O-N 3.16Å; L18-L20 VanDerWaalsContact C-N 3.31Å; L18-L20 HydrophobicContact CB-CD1 3.5Å; L18-L20 VanDerWaalsContact CB-CD1 3.5Å; L18-L20 WeakPolarHBondContact O-CD1 3.48Å; L18-L20 PolarHBondContact O-N 2.98Å; L20-V31 WeakPolarHBondContact CA-O 3.42Å; L20-C32 HydrophobicContact CD2-CB 3.92Å; L20-F39 HydrophobicContact CD2-CD2 4.07Å; L20-F39 HydrophobicContact CD2-CE2 3.86Å; L20-L49 HydrophobicContact CB-CD2 4.14Å; L20-L49 HydrophobicContact CD1-CB 3.67Å; L20-L49 HydrophobicContact CD1-CD2 3.41Å; L20-L49 VanDerWaalsContact CD1-CD2 3.41Å; L20-L49 HydrophobicContact CD1-CG 3.55Å; L20-L49 HydrophobicContact CD2-CD2 3.72Å; L20-L49 HydrophobicContact CD2-CG 3.82Å; L20-L49 HydrophobicContact CG-CD2 3.93Å; L20-L49 HydrophobicContact CG-CG 4.29Å
21	A	67.8	Low	62.6	Low	29 Å²	29	60 Å²	60	24%	0.24	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	159.5	173.3	0	0	0	0	0	110.3	V31 L33	A21-V31 PolarHBondContact N-O 3.41Å; A21-V31 PolarHBondContact O-N 3.04Å; A21-L33 HydrophobicContact CB-CD1 4.11Å; A21-L33 HydrophobicContact CB-CD2 3.89Å; A21-L33 HydrophobicContact CB-CG 4.22Å
22	V	65.6	Low	63.6	Low	41 Å²	41	55.8 Å²	55.8	25%	0.248	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	131.2	167.3	166.9	0	0	0	0	108.4	Y11 P24 H28	Y11-V22 HydrophobicContact CD2-CG2 3.95Å; Y11-V22 HydrophobicContact CE2-CB 4.45Å; Y11-V22 HydrophobicContact CE2-CG2 3.69Å; V22-P24 WeakPolarHBondContact O-CD 3.45Å; V22-H28 HydrophobicContact CG1-CB 4.42Å
23	M	57	Low	64.2	Low	98 Å²	98	54 Å²	54	48%	0.483	30%	0.303	S	S	.	.	P	Polyproline II helix	trans	-70.6	124.9	174.4	-78.6	-65.1	-69.3	0	0	110.8	G25 V29 V31	M23-G25 PolarHBondContact O-N 2.89Å; M23-V29 PolarHBondContact N-O 3.01Å; M23-V31 HydrophobicContact CB-CG2 4.25Å; M23-V31 HydrophobicContact CG-CB 4.05Å; M23-V31 HydrophobicContact CG-CG2 3.33Å
24	P	53.9	Low	64.9	Low	93 Å²	93	53.4 Å²	53.4	60%	0.604	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	129	173.2	28.2	-32.1	0	0	0	109.7	V22	V22-P24 WeakPolarHBondContact O-CD 3.45Å
25	G	56.9	Low	65.6	Low	85 Å²	85	52.5 Å²	52.5	88%	0.876	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	99	-2.6	174.2	0	0	0	0	0	116.3	M23	M23-G25 PolarHBondContact O-N 2.89Å
26	T	55.4	Low	65.9	Low	84 Å²	84	57.3 Å²	57.3	52%	0.515	32%	0.319	S	S	.	.	S	Bend	trans	-123	162.2	167.9	55.9	0	0	0	0	109.4	H28 V29	T26-H28 VanDerWaalsContact C-N 3.33Å; T26-H28 PolarHBondContact O-N 3.14Å; T26-V29 VanDerWaalsContact OG1-CG2 3.27Å; T26-V29 WeakPolarHBondContact OG1-CG2 3.48Å
27	E	60.4	Low	66.5	Low	172 Å²	172	61.9 Å²	61.9	80%	0.804	33%	0.334	S	S	*	.	S	Bend	trans	-57.4	75.3	-169.6	-63.4	-179.9	89.6	0	0	115	V29	E27-V29 VanDerWaalsContact O-CG1 3.3Å; E27-V29 WeakPolarHBondContact O-CG1 2.85Å; E27-V29 PolarHBondContact O-N 3.47Å
28	H	65.9	Low	67.3	Low	132 Å²	132	59.8 Å²	59.8	61%	0.611	34%	0.336	S	S	*	.	S	Bend	trans	35.2	41.6	178.7	-65.4	101.8	0	0	0	114	V22 T26	V22-H28 HydrophobicContact CG1-CB 4.42Å; T26-H28 VanDerWaalsContact C-N 3.33Å; T26-H28 PolarHBondContact O-N 3.14Å
29	V	67.2	Low	67.9	Low	24 Å²	24	60 Å²	60	15%	0.145	34%	0.336	C	S	.	.			trans	-84.6	123.9	-174.8	-73.3	0	0	0	0	107.9	M23 T26 E27 V38	M23-V29 PolarHBondContact N-O 3.01Å; T26-V29 VanDerWaalsContact OG1-CG2 3.27Å; T26-V29 WeakPolarHBondContact OG1-CG2 3.48Å; E27-V29 VanDerWaalsContact O-CG1 3.3Å; E27-V29 WeakPolarHBondContact O-CG1 2.85Å; E27-V29 PolarHBondContact O-N 3.47Å; V29-V38 HydrophobicContact CB-CG1 3.65Å; V29-V38 HydrophobicContact CG1-CG1 4.2Å; V29-V38 HydrophobicContact CG2-CG1 3.67Å
30	P	70.2	Confident	68.3	Low	4 Å²	4	63.4 Å²	63.4	3%	0.026	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	136.6	173.6	-5.1	16.4	0	0	0	108.8	F39 M44 L49	P30-F39 HydrophobicContact CB-CB 4.08Å; P30-F39 HydrophobicContact CB-CD2 4.4Å; P30-F39 WeakPolarHBondContact CD-O 3.32Å; P30-F39 HydrophobicContact CG-CB 3.87Å; P30-F39 WeakPolarHBondContact O-CD2 3.44Å; P30-F39 PolarHBondContact O-N 3.2Å; P30-M44 HydrophobicContact CG-CB 3.64Å; P30-M44 HydrophobicContact CG-CG 3.64Å; P30-M44 HydrophobicContact CG-SD 4.03Å; P30-L49 HydrophobicContact CB-CD2 4.32Å
31	V	72.5	Confident	68.2	Low	12 Å²	12	67.1 Å²	67.1	7%	0.073	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	130.3	173.8	-178.8	0	0	0	0	108.6	L20 A21 M23 L33 R37 V38	L20-V31 WeakPolarHBondContact CA-O 3.42Å; A21-V31 PolarHBondContact N-O 3.41Å; A21-V31 PolarHBondContact O-N 3.04Å; M23-V31 HydrophobicContact CB-CG2 4.25Å; M23-V31 HydrophobicContact CG-CB 4.05Å; M23-V31 HydrophobicContact CG-CG2 3.33Å; V31-L33 PolarHBondContact O-N 2.98Å; V31-R37 WeakPolarHBondContact CA-O 3.42Å; V31-V38 HydrophobicContact CG2-CB 4.35Å; V31-V38 HydrophobicContact CG2-CG1 4.31Å; V31-V38 HydrophobicContact CG2-CG2 3.93Å
32	C	77	Confident	68.2	Low	0 Å²	0	68 Å²	68	0%	0	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	122	171.5	179.5	0	0	0	0	108.5	L20 L34 C35 E36 R37 F39 H52	L20-C32 HydrophobicContact CD2-CB 3.92Å; C32-L34 PolarHBondContact O-N 2.76Å; C32-L34 VanDerWaalsContact O-N 3.17Å; C32-L34 PolarHBondContact SG-N 2.68Å; C32-L34 VanDerWaalsContact SG-N 3.45Å; C32-C35 VanDerWaalsContact SG-SG 3.69Å; C32-E36 WeakPolarHBondContact O-CA 3.48Å; C32-E36 PolarHBondContact O-N 3.07Å; C32-R37 HydrophobicContact CB-CB 4.48Å; C32-R37 PolarHBondContact N-O 3.46Å; C32-F39 HydrophobicContact CB-CE2 3.98Å; C32-H52 WeakPolarHBondContact CB-NE2 3.11Å; C32-H52 PolarHBondContact SG-NE2 2.76Å; C32-H52 VanDerWaalsContact SG-NE2 3.35Å
33	L	71.1	Confident	68.2	Low	30 Å²	30	67 Å²	67	16%	0.157	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-3.4	-180	-61.4	174.8	0	0	0	113.4	G19 A21 V31 W72 Y81	G19-L33 VanDerWaalsContact O-CB 3.29Å; G19-L33 WeakPolarHBondContact O-CB 3.33Å; G19-L33 WeakPolarHBondContact O-CG 3.44Å; G19-L33 PolarHBondContact O-N 3.24Å; A21-L33 HydrophobicContact CB-CD1 4.11Å; A21-L33 HydrophobicContact CB-CD2 3.89Å; A21-L33 HydrophobicContact CB-CG 4.22Å; V31-L33 PolarHBondContact O-N 2.98Å; L33-W72 HydrophobicContact CD1-CH2 3.58Å; L33-W72 HydrophobicContact CD1-CZ3 4.16Å; L33-Y81 WeakPolarHBondContact O-CE2 3.29Å
34	L	73.5	Confident	68.6	Low	42 Å²	42	62.9 Å²	62.9	22%	0.22	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.9	-24.8	-177	-55.5	169.4	0	0	0	113.6	C32 L53 H57 M60 F71	C32-L34 PolarHBondContact O-N 2.76Å; C32-L34 VanDerWaalsContact O-N 3.17Å; C32-L34 PolarHBondContact SG-N 2.68Å; C32-L34 VanDerWaalsContact SG-N 3.45Å; L34-L53 HydrophobicContact CD1-CD2 3.72Å; L34-H57 WeakPolarHBondContact CB-CE1 3.44Å; L34-H57 WeakPolarHBondContact CB-NE2 3.47Å; L34-H57 HydrophobicContact CD1-CB 4.04Å; L34-M60 HydrophobicContact CD1-CE 3.35Å; L34-M60 HydrophobicContact CD1-SD 3.58Å; L34-M60 VanDerWaalsContact CD1-SD 3.58Å; L34-M60 HydrophobicContact CD2-CE 3.55Å; L34-M60 HydrophobicContact CD2-SD 4.03Å; L34-M60 HydrophobicContact CG-CE 4.05Å; L34-M60 HydrophobicContact CG-SD 4.39Å; L34-F71 HydrophobicContact CD1-CE2 4.21Å; L34-F71 HydrophobicContact CD2-CE2 3.84Å; L34-F71 HydrophobicContact CD2-CZ 4.04Å; L34-F71 HydrophobicContact CG-CE2 4.29Å; L34-F71 HydrophobicContact CG-CZ 4.47Å
35	C	75.2	Confident	69.5	Low	55 Å²	55	63.5 Å²	63.5	37%	0.372	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-139.3	10.9	-179	64.6	0	0	0	0	113.1	C32 R37 H52	C32-C35 VanDerWaalsContact SG-SG 3.69Å; C35-R37 PolarHBondContact O-N 3.31Å; C35-R37 VanDerWaalsContact SG-CB 3.56Å; C35-H52 PolarHBondContact SG-CE1 3.46Å; C35-H52 PolarHBondContact SG-NE2 2.71Å
36	E	72	Confident	70.1	Confident	116 Å²	116	61.7 Å²	61.7	54%	0.542	33%	0.332	S	S	.	.			trans	57.2	16.5	179.4	-61.4	178.9	-162.4	0	0	114.4	C32 V38 Y81	C32-E36 WeakPolarHBondContact O-CA 3.48Å; C32-E36 PolarHBondContact O-N 3.07Å; E36-V38 PolarHBondContact O-N 3.47Å; E36-V38 VanDerWaalsContact O-N 3.09Å; E36-Y81 HydrophobicContact CG-CE1 4.48Å; E36-Y81 WeakPolarHBondContact CG-OH 3.41Å; E36-Y81 PolarHBondContact OE1-OH 2.83Å
37	R	76	Confident	71.1	Confident	128 Å²	128	62 Å²	62	48%	0.483	34%	0.338	S	S	.	.			trans	-73.1	115.1	-175.1	-163.5	170.9	-164.7	-177.6	4.3	109.6	V31 C32 C35 F39	V31-R37 WeakPolarHBondContact CA-O 3.42Å; C32-R37 HydrophobicContact CB-CB 4.48Å; C32-R37 PolarHBondContact N-O 3.46Å; C35-R37 PolarHBondContact O-N 3.31Å; C35-R37 VanDerWaalsContact SG-CB 3.56Å; R37-F39 HydrophobicContact CB-CE2 4.35Å; R37-F39 VanDerWaalsContact O-CD2 3.24Å; R37-F39 WeakPolarHBondContact O-CD2 3.49Å; R37-F39 VanDerWaalsContact O-CE2 3.26Å; R37-F39 WeakPolarHBondContact O-CE2 3.23Å
38	V	77.3	Confident	71.9	Confident	88 Å²	88	58.9 Å²	58.9	53%	0.533	32%	0.318	S	S	.	.	B	Isolated β-bridge	trans	-74	127.8	172.2	-171.3	0	0	0	0	109.3	V29 V31 E36	V29-V38 HydrophobicContact CB-CG1 3.65Å; V29-V38 HydrophobicContact CG1-CG1 4.2Å; V29-V38 HydrophobicContact CG2-CG1 3.67Å; V31-V38 HydrophobicContact CG2-CB 4.35Å; V31-V38 HydrophobicContact CG2-CG1 4.31Å; V31-V38 HydrophobicContact CG2-CG2 3.93Å; E36-V38 PolarHBondContact O-N 3.47Å; E36-V38 VanDerWaalsContact O-N 3.09Å
39	F	76.5	Confident	72.3	Confident	25 Å²	25	52.6 Å²	52.6	11%	0.11	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-97.1	145.7	173.3	-69.1	-91.3	0	0	0	109.9	L20 P30 C32 R37 L49 H52	L20-F39 HydrophobicContact CD2-CD2 4.07Å; L20-F39 HydrophobicContact CD2-CE2 3.86Å; P30-F39 HydrophobicContact CB-CB 4.08Å; P30-F39 HydrophobicContact CB-CD2 4.4Å; P30-F39 WeakPolarHBondContact CD-O 3.32Å; P30-F39 HydrophobicContact CG-CB 3.87Å; P30-F39 WeakPolarHBondContact O-CD2 3.44Å; P30-F39 PolarHBondContact O-N 3.2Å; C32-F39 HydrophobicContact CB-CE2 3.98Å; R37-F39 HydrophobicContact CB-CE2 4.35Å; R37-F39 VanDerWaalsContact O-CD2 3.24Å; R37-F39 WeakPolarHBondContact O-CD2 3.49Å; R37-F39 VanDerWaalsContact O-CE2 3.26Å; R37-F39 WeakPolarHBondContact O-CE2 3.23Å; F39-L49 HydrophobicContact CD1-CD1 4.12Å; F39-L49 HydrophobicContact CE1-CD1 4.43Å; F39-L49 HydrophobicContact CG-CD1 4.21Å; F39-H52 HydrophobicContact CE1-CB 4.07Å; F39-H52 HydrophobicContact CZ-CB 3.75Å; F39-H52 AromaticContact CZ-CD2 3.57Å; F39-H52 AromaticContact CZ-CE1 3.95Å; F39-H52 AromaticContact CZ-CG 3.42Å; F39-H52 VanDerWaalsContact CZ-CG 3.42Å; F39-H52 AromaticContact CZ-ND1 3.69Å; F39-H52 AromaticContact CZ-NE2 3.88Å
40	S	72.7	Confident	72.7	Confident	72 Å²	72	57.3 Å²	57.3	50%	0.503	31%	0.308	S	S	.	.	P	Polyproline II helix	trans	-66.8	149.1	164.8	53.8	0	0	0	0	110.2	G42 S43 M44	S40-G42 PolarHBondContact O-N 3.21Å; S40-G42 VanDerWaalsContact O-N 3.16Å; S40-S43 CarbonylContact O-C 3.59Å; S40-S43 VanDerWaalsContact O-CA 3.32Å; S40-S43 WeakPolarHBondContact O-CA 3.36Å; S40-S43 WeakPolarHBondContact O-CB 3.37Å; S40-S43 PolarHBondContact O-N 3.26Å; S40-S43 PolarHBondContact OG-OG 3.25Å; S40-M44 PolarHBondContact O-N 3.44Å
41	N	68.6	Low	73.3	Confident	80 Å²	80	63.6 Å²	63.6	43%	0.428	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-53	-37	176.2	-173.4	-7.7	0	0	0	112	S43 M44	N41-S43 PolarHBondContact O-N 3.15Å; N41-M44 WeakPolarHBondContact O-CB 3.44Å; N41-M44 PolarHBondContact O-N 3.12Å; N41-M44 VanDerWaalsContact O-N 3.08Å
42	G	68.5	Low	73.8	Confident	46 Å²	46	63.6 Å²	63.6	47%	0.474	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-64.5	-20.9	173.7	0	0	0	0	0	114.7	S40	S40-G42 PolarHBondContact O-N 3.21Å; S40-G42 VanDerWaalsContact O-N 3.16Å
43	S	63.6	Low	73.8	Confident	21 Å²	21	64.3 Å²	64.3	15%	0.147	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-92.1	-3.8	176.1	-59.4	0	0	0	0	113.7	S40 N41 K45 R48 L49	S40-S43 CarbonylContact O-C 3.59Å; S40-S43 VanDerWaalsContact O-CA 3.32Å; S40-S43 WeakPolarHBondContact O-CA 3.36Å; S40-S43 WeakPolarHBondContact O-CB 3.37Å; S40-S43 PolarHBondContact O-N 3.26Å; S40-S43 PolarHBondContact OG-OG 3.25Å; N41-S43 PolarHBondContact O-N 3.15Å; S43-K45 PolarHBondContact O-N 3.48Å; S43-R48 PolarHBondContact OG-NH1 3.36Å; S43-R48 VanDerWaalsContact OG-NH1 3.15Å; S43-L49 WeakPolarHBondContact O-CD1 3.42Å
44	M	66.3	Low	74.1	Confident	11 Å²	11	66.7 Å²	66.7	5%	0.054	35%	0.346	C	S	.	.			trans	-69.3	55.5	170.1	-165.8	174.9	77.9	0	0	111	R9 Y15 P30 S40 N41	R9-M44 HydrophobicContact CB-CE 3.83Å; Y15-M44 HydrophobicContact CE1-CG 3.97Å; Y15-M44 HydrophobicContact CE2-CG 3.94Å; Y15-M44 HydrophobicContact CE2-SD 4.37Å; Y15-M44 PolarHBondContact OH-O 3.49Å; P30-M44 HydrophobicContact CG-CB 3.64Å; P30-M44 HydrophobicContact CG-CG 3.64Å; P30-M44 HydrophobicContact CG-SD 4.03Å; S40-M44 PolarHBondContact O-N 3.44Å; N41-M44 WeakPolarHBondContact O-CB 3.44Å; N41-M44 PolarHBondContact O-N 3.12Å; N41-M44 VanDerWaalsContact O-N 3.08Å
45	K	72.2	Confident	74.5	Confident	106 Å²	106	73.9 Å²	73.9	46%	0.461	37%	0.37	S	S	.	.			trans	-112.4	132	168.3	-67.8	-174.4	179.6	-175.1	0	106.7	S43 S47 R48 L49	S43-K45 PolarHBondContact O-N 3.48Å; K45-S47 PolarHBondContact O-N 2.98Å; K45-S47 VanDerWaalsContact O-N 3.08Å; K45-R48 HydrophobicContact CB-CB 4.45Å; K45-R48 HydrophobicContact CB-CG 4.41Å; K45-R48 PolarHBondContact O-N 3.3Å; K45-L49 PolarHBondContact O-N 3.41Å; K45-L49 VanDerWaalsContact O-N 3.08Å
46	P	70.5	Confident	74.8	Confident	48 Å²	48	78.9 Å²	78.9	31%	0.312	38%	0.381	S	S	.	.	H	α-helix	trans	-54.4	-34.6	-179.1	21.6	-33	0	0	0	111.5	L18 R48 L49 K50	L18-P46 HydrophobicContact CD1-CB 4.29Å; P46-R48 PolarHBondContact O-N 2.79Å; P46-L49 PolarHBondContact O-N 2.89Å; P46-K50 WeakPolarHBondContact O-CB 3.17Å; P46-K50 PolarHBondContact O-N 3.26Å
47	S	75.3	Confident	75.2	Confident	91 Å²	91	74.8 Å²	74.8	64%	0.636	36%	0.362	S	S	*	.	H	α-helix	trans	-62.9	-38.9	175.8	-26.2	0	0	0	0	113.4	K45 R51	K45-S47 PolarHBondContact O-N 2.98Å; K45-S47 VanDerWaalsContact O-N 3.08Å; S47-R51 VanDerWaalsContact O-CB 3.27Å; S47-R51 WeakPolarHBondContact O-CB 3.46Å; S47-R51 PolarHBondContact O-N 3.49Å
48	R	78	Confident	74.7	Confident	106 Å²	106	72.4 Å²	72.4	40%	0.4	36%	0.363	S	S	.	.	H	α-helix	trans	-74.3	-39.1	178.6	-75.9	-172	175.1	-171.9	3.2	111.4	S43 K45 P46 R51 H52	S43-R48 PolarHBondContact OG-NH1 3.36Å; S43-R48 VanDerWaalsContact OG-NH1 3.15Å; K45-R48 HydrophobicContact CB-CB 4.45Å; K45-R48 HydrophobicContact CB-CG 4.41Å; K45-R48 PolarHBondContact O-N 3.3Å; P46-R48 PolarHBondContact O-N 2.79Å; R48-R51 PolarHBondContact O-N 3.33Å; R48-H52 PolarHBondContact O-N 2.81Å
49	L	74.7	Confident	74.1	Confident	0 Å²	0	75.2 Å²	75.2	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-67.2	-46.7	176.4	-92.3	62.1	0	0	0	111	Y15 L18 L20 P30 F39 S43 K45 P46 R51 H52 L53	Y15-L49 HydrophobicContact CD1-CD2 3.35Å; Y15-L49 HydrophobicContact CE1-CD2 3.66Å; Y15-L49 HydrophobicContact CG-CD2 4.43Å; L18-L49 HydrophobicContact CD1-CB 4.1Å; L20-L49 HydrophobicContact CB-CD2 4.14Å; L20-L49 HydrophobicContact CD1-CB 3.67Å; L20-L49 HydrophobicContact CD1-CD2 3.41Å; L20-L49 VanDerWaalsContact CD1-CD2 3.41Å; L20-L49 HydrophobicContact CD1-CG 3.55Å; L20-L49 HydrophobicContact CD2-CD2 3.72Å; L20-L49 HydrophobicContact CD2-CG 3.82Å; L20-L49 HydrophobicContact CG-CD2 3.93Å; L20-L49 HydrophobicContact CG-CG 4.29Å; P30-L49 HydrophobicContact CB-CD2 4.32Å; F39-L49 HydrophobicContact CD1-CD1 4.12Å; F39-L49 HydrophobicContact CE1-CD1 4.43Å; F39-L49 HydrophobicContact CG-CD1 4.21Å; S43-L49 WeakPolarHBondContact O-CD1 3.42Å; K45-L49 PolarHBondContact O-N 3.41Å; K45-L49 VanDerWaalsContact O-N 3.08Å; P46-L49 PolarHBondContact O-N 2.89Å; L49-R51 VanDerWaalsContact C-N 3.33Å; L49-R51 PolarHBondContact O-N 2.84Å; L49-H52 WeakPolarHBondContact O-CA 3.43Å; L49-H52 VanDerWaalsContact O-CB 3.31Å; L49-H52 WeakPolarHBondContact O-CB 3.27Å; L49-H52 PolarHBondContact O-N 3.36Å; L49-L53 PolarHBondContact O-N 3.36Å
50	K	75.2	Confident	73.2	Confident	123 Å²	123	76.6 Å²	76.6	54%	0.535	38%	0.383	S	S	.	.	H	α-helix	trans	-58.1	-43.4	172.3	-171.2	172.3	-175.8	173.2	0	112	L18 P46 H52 L53 I54	L18-K50 HydrophobicContact CD2-CB 4.1Å; L18-K50 HydrophobicContact CD2-CG 4.34Å; P46-K50 WeakPolarHBondContact O-CB 3.17Å; P46-K50 PolarHBondContact O-N 3.26Å; K50-H52 VanDerWaalsContact C-N 3.29Å; K50-H52 PolarHBondContact O-N 3.26Å; K50-L53 PolarHBondContact O-N 3.5Å; K50-I54 HydrophobicContact CG-CD1 3.92Å; K50-I54 VanDerWaalsContact O-CG1 3.3Å; K50-I54 WeakPolarHBondContact O-CG1 3.45Å; K50-I54 PolarHBondContact O-N 2.85Å
51	R	82.6	Confident	72.4	Confident	135 Å²	135	75.6 Å²	75.6	51%	0.509	38%	0.376	S	S	.	.	H	α-helix	trans	-61.9	-36.2	174.1	-177.4	175.6	66	179.5	4.3	112.4	S47 R48 L49 R55	S47-R51 VanDerWaalsContact O-CB 3.27Å; S47-R51 WeakPolarHBondContact O-CB 3.46Å; S47-R51 PolarHBondContact O-N 3.49Å; R48-R51 PolarHBondContact O-N 3.33Å; L49-R51 VanDerWaalsContact C-N 3.33Å; L49-R51 PolarHBondContact O-N 2.84Å; R51-R55 VanDerWaalsContact O-CB 3.32Å; R51-R55 WeakPolarHBondContact O-CB 3.13Å; R51-R55 VanDerWaalsContact O-CG 3.31Å; R51-R55 WeakPolarHBondContact O-CG 3.05Å; R51-R55 PolarHBondContact O-N 3.09Å; R51-R55 VanDerWaalsContact O-N 3.09Å
52	H	83.8	Confident	71.5	Confident	13 Å²	13	79.1 Å²	79.1	6%	0.06	39%	0.394	C	S	.	.	H	α-helix	trans	-65.3	-47.4	174.4	166.9	81.5	0	0	0	111.3	C32 C35 F39 R48 L49 K50 R55 R56 H57	C32-H52 WeakPolarHBondContact CB-NE2 3.11Å; C32-H52 PolarHBondContact SG-NE2 2.76Å; C32-H52 VanDerWaalsContact SG-NE2 3.35Å; C35-H52 PolarHBondContact SG-CE1 3.46Å; C35-H52 PolarHBondContact SG-NE2 2.71Å; F39-H52 HydrophobicContact CE1-CB 4.07Å; F39-H52 HydrophobicContact CZ-CB 3.75Å; F39-H52 AromaticContact CZ-CD2 3.57Å; F39-H52 AromaticContact CZ-CE1 3.95Å; F39-H52 AromaticContact CZ-CG 3.42Å; F39-H52 VanDerWaalsContact CZ-CG 3.42Å; F39-H52 AromaticContact CZ-ND1 3.69Å; F39-H52 AromaticContact CZ-NE2 3.88Å; R48-H52 PolarHBondContact O-N 2.81Å; L49-H52 WeakPolarHBondContact O-CA 3.43Å; L49-H52 VanDerWaalsContact O-CB 3.31Å; L49-H52 WeakPolarHBondContact O-CB 3.27Å; L49-H52 PolarHBondContact O-N 3.36Å; K50-H52 VanDerWaalsContact C-N 3.29Å; K50-H52 PolarHBondContact O-N 3.26Å; H52-R55 PolarHBondContact O-N 3.17Å; H52-R56 WeakPolarHBondContact O-CB 3.33Å; H52-R56 PolarHBondContact O-N 3.41Å; H52-H57 AromaticContact NE2-NE2 3.92Å
53	L	75.6	Confident	70.6	Confident	14 Å²	14	79.4 Å²	79.4	7%	0.073	40%	0.397	C	S	.	.	H	α-helix	trans	-58.9	-49.5	176.1	-64.4	173	0	0	0	111.6	L18 L34 L49 K50 R55 R56 H57	L18-L53 HydrophobicContact CB-CD1 3.76Å; L18-L53 HydrophobicContact CD2-CD1 3.56Å; L18-L53 HydrophobicContact CG-CD1 4.24Å; L18-L53 WeakPolarHBondContact O-CD1 3.43Å; L34-L53 HydrophobicContact CD1-CD2 3.72Å; L49-L53 PolarHBondContact O-N 3.36Å; K50-L53 PolarHBondContact O-N 3.5Å; L53-R55 VanDerWaalsContact C-N 3.26Å; L53-R55 PolarHBondContact O-N 3.04Å; L53-R56 PolarHBondContact O-N 3.25Å; L53-H57 CarbonylContact O-C 2.97Å; L53-H57 WeakPolarHBondContact O-CA 3.07Å; L53-H57 WeakPolarHBondContact O-CB 3.38Å; L53-H57 PolarHBondContact O-N 3.25Å; L53-H57 VanDerWaalsContact O-O 3.09Å
54	I	77.6	Confident	69.9	Low	80 Å²	80	86.1 Å²	86.1	41%	0.41	44%	0.438	S	S	.	.	H	α-helix	trans	-58.9	-39.2	178.8	-65.8	162.2	0	0	0	111.5	K50 P58	K50-I54 HydrophobicContact CG-CD1 3.92Å; K50-I54 VanDerWaalsContact O-CG1 3.3Å; K50-I54 WeakPolarHBondContact O-CG1 3.45Å; K50-I54 PolarHBondContact O-N 2.85Å; I54-P58 WeakPolarHBondContact O-CA 3.49Å; I54-P58 WeakPolarHBondContact O-CB 3.09Å
55	R	82.8	Confident	69	Low	194 Å²	194	87.9 Å²	87.9	73%	0.732	45%	0.454	S	S	*	.	H	α-helix	trans	-81.5	-37.5	-176.6	-75.9	-173.6	179.2	-144.3	0	114.5	R51 H52 L53	R51-R55 VanDerWaalsContact O-CB 3.32Å; R51-R55 WeakPolarHBondContact O-CB 3.13Å; R51-R55 VanDerWaalsContact O-CG 3.31Å; R51-R55 WeakPolarHBondContact O-CG 3.05Å; R51-R55 PolarHBondContact O-N 3.09Å; R51-R55 VanDerWaalsContact O-N 3.09Å; H52-R55 PolarHBondContact O-N 3.17Å; L53-R55 VanDerWaalsContact C-N 3.26Å; L53-R55 PolarHBondContact O-N 3.04Å
56	R	81.3	Confident	68	Low	160 Å²	160	87 Å²	87	60%	0.604	46%	0.459	S	S	*	.	H	α-helix	trans	-98.6	-26.1	-175	-69.6	-62.3	-160.4	-175.8	3.9	112.5	H52 L53 P58	H52-R56 WeakPolarHBondContact O-CB 3.33Å; H52-R56 PolarHBondContact O-N 3.41Å; L53-R56 PolarHBondContact O-N 3.25Å; R56-P58 VanDerWaalsContact C-CD 3.41Å
57	H	79.5	Confident	67.1	Low	30 Å²	30	86.7 Å²	86.7	14%	0.139	46%	0.456	C	S	.	.			trans	-132.1	54.9	-176.8	-51.5	-72.4	0	0	0	110.4	L34 H52 L53 N59 M60	L34-H57 WeakPolarHBondContact CB-CE1 3.44Å; L34-H57 WeakPolarHBondContact CB-NE2 3.47Å; L34-H57 HydrophobicContact CD1-CB 4.04Å; H52-H57 AromaticContact NE2-NE2 3.92Å; L53-H57 CarbonylContact O-C 2.97Å; L53-H57 WeakPolarHBondContact O-CA 3.07Å; L53-H57 WeakPolarHBondContact O-CB 3.38Å; L53-H57 PolarHBondContact O-N 3.25Å; L53-H57 VanDerWaalsContact O-O 3.09Å; H57-N59 PolarHBondContact O-N 3.45Å; H57-M60 HydrophobicContact CB-CB 4.37Å; H57-M60 HydrophobicContact CB-CG 4.5Å; H57-M60 HydrophobicContact CB-SD 3.92Å; H57-M60 PolarHBondContact O-N 2.88Å
58	P	66.5	Low	65.9	Low	78 Å²	78	86.3 Å²	86.3	51%	0.506	45%	0.447	S	S	.	.	G	3₁₀ helix	trans	-58.1	-32.4	-177.8	23.6	-33.4	0	0	0	112.3	I54 R56 M60 S61	I54-P58 WeakPolarHBondContact O-CA 3.49Å; I54-P58 WeakPolarHBondContact O-CB 3.09Å; R56-P58 VanDerWaalsContact C-CD 3.41Å; P58-M60 PolarHBondContact O-N 3.08Å; P58-S61 PolarHBondContact O-N 2.97Å; P58-S61 VanDerWaalsContact O-N 3.08Å; P58-S61 PolarHBondContact O-OG 3.44Å
59	N	64.7	Low	64.5	Low	147 Å²	147	87.9 Å²	87.9	79%	0.786	46%	0.459	S	S	*	.	G	3₁₀ helix	trans	-58.4	-16.7	175.8	-162.8	22.1	0	0	0	113.8	H57	H57-N59 PolarHBondContact O-N 3.45Å
60	M	57.6	Low	63.4	Low	54 Å²	54	94.6 Å²	94.6	27%	0.266	49%	0.49	S	S	.	.	G	3₁₀ helix	trans	-112.4	-1.4	-176.9	-61.3	165.8	66.8	0	0	112.6	L34 H57 P58 F71	L34-M60 HydrophobicContact CD1-CE 3.35Å; L34-M60 HydrophobicContact CD1-SD 3.58Å; L34-M60 VanDerWaalsContact CD1-SD 3.58Å; L34-M60 HydrophobicContact CD2-CE 3.55Å; L34-M60 HydrophobicContact CD2-SD 4.03Å; L34-M60 HydrophobicContact CG-CE 4.05Å; L34-M60 HydrophobicContact CG-SD 4.39Å; H57-M60 HydrophobicContact CB-CB 4.37Å; H57-M60 HydrophobicContact CB-CG 4.5Å; H57-M60 HydrophobicContact CB-SD 3.92Å; H57-M60 PolarHBondContact O-N 2.88Å; P58-M60 PolarHBondContact O-N 3.08Å; M60-F71 HydrophobicContact CE-CD2 3.36Å; M60-F71 HydrophobicContact CE-CE2 3.24Å; M60-F71 HydrophobicContact CE-CZ 4.48Å
61	S	56.3	Low	62.5	Low	51 Å²	51	89.3 Å²	89.3	36%	0.357	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.2	-2	177.5	66.3	0	0	0	0	113.7	P58 G63	P58-S61 PolarHBondContact O-N 2.97Å; P58-S61 VanDerWaalsContact O-N 3.08Å; P58-S61 PolarHBondContact O-OG 3.44Å; S61-G63 PolarHBondContact O-N 3.02Å
62	N	49.2	Very low	61.2	Low	153 Å²	153	85.5 Å²	85.5	82%	0.818	45%	0.453	S	S	*	.			trans	-94.7	77.1	-174.5	-166.3	47	0	0	0	111.5
63	G	48.8	Very low	59.8	Low	52 Å²	52	90.6 Å²	90.6	54%	0.536	48%	0.48	S	S	.	.	S	Bend	trans	165.3	124.6	174.2	0	0	0	0	0	108.5	S61 A65	S61-G63 PolarHBondContact O-N 3.02Å; G63-A65 PolarHBondContact O-N 3.25Å
64	T	48.8	Very low	58.9	Low	163 Å²	163	93 Å²	93	100%	1	49%	0.491	S	S	*	.	S	Bend	trans	-69.2	35.3	-176.6	41.7	0	0	0	0	113.8
65	A	49.1	Very low	57.9	Low	47 Å²	47	97.3 Å²	97.3	39%	0.388	51%	0.507	S	S	.	.	S	Bend	trans	-128.5	141.6	-175.5	0	0	0	0	0	109.9	G63 V67 D68	G63-A65 PolarHBondContact O-N 3.25Å; A65-V67 PolarHBondContact O-N 2.95Å; A65-D68 VanDerWaalsContact CB-OD1 3.24Å; A65-D68 WeakPolarHBondContact CB-OD1 3.27Å
66	P	49.4	Very low	56.7	Low	88 Å²	88	93.3 Å²	93.3	57%	0.571	50%	0.496	S	S	*	.			trans	-72.3	87.4	-171.7	30.7	-35	0	0	0	110.6	D68	P66-D68 WeakPolarHBondContact O-CA 3.18Å; P66-D68 PolarHBondContact O-N 3.39Å
67	V	52.2	Low	55.7	Low	42 Å²	42	86.4 Å²	86.4	26%	0.255	47%	0.471	S	S	.	.	S	Bend	trans	26.2	66.2	169.4	-177.5	0	0	0	0	109.7	R17 A65 F71	R17-V67 WeakPolarHBondContact O-CB 3.33Å; R17-V67 WeakPolarHBondContact O-CG2 3.29Å; A65-V67 PolarHBondContact O-N 2.95Å; V67-F71 HydrophobicContact CG1-CB 3.25Å; V67-F71 HydrophobicContact CG1-CD1 4.11Å; V67-F71 HydrophobicContact CG1-CD2 3.29Å; V67-F71 HydrophobicContact CG1-CE2 4.13Å; V67-F71 HydrophobicContact CG1-CG 3.28Å
68	D	50	Low	54.7	Low	82 Å²	82	86.9 Å²	86.9	44%	0.439	48%	0.477	S	S	.	.			trans	-58.5	163	-163.4	-42.5	-68.4	0	0	0	108.4	A65 P66 Q70 F71	A65-D68 VanDerWaalsContact CB-OD1 3.24Å; A65-D68 WeakPolarHBondContact CB-OD1 3.27Å; P66-D68 WeakPolarHBondContact O-CA 3.18Å; P66-D68 PolarHBondContact O-N 3.39Å; D68-Q70 CarbonylContact O-C 3.51Å; D68-Q70 WeakPolarHBondContact O-CA 3.21Å; D68-Q70 PolarHBondContact O-N 3.03Å; D68-F71 PolarHBondContact O-N 3.39Å
69	Q	48.5	Very low	54.5	Low	139 Å²	139	90.5 Å²	90.5	65%	0.65	49%	0.487	S	S	*	.	G	3₁₀ helix	trans	-46.8	-20.4	-178.4	-70.7	169.7	-72.7	0	0	114	F71 W72 L73	Q69-F71 PolarHBondContact O-N 2.72Å; Q69-W72 PolarHBondContact O-N 3.48Å; Q69-L73 WeakPolarHBondContact O-CG 2.94Å; Q69-L73 PolarHBondContact O-N 3.08Å
70	Q	51.8	Low	54.2	Low	141 Å²	141	88.2 Å²	88.2	66%	0.659	47%	0.474	S	S	*	.	G	3₁₀ helix	trans	-45.3	-35.3	163.4	-135.2	81.3	22.2	0	0	115.9	D68 W72 L73 Q74	D68-Q70 CarbonylContact O-C 3.51Å; D68-Q70 WeakPolarHBondContact O-CA 3.21Å; D68-Q70 PolarHBondContact O-N 3.03Å; Q70-W72 PolarHBondContact O-N 2.96Å; Q70-L73 CarbonylContact O-C 3.5Å; Q70-L73 WeakPolarHBondContact O-CA 3.49Å; Q70-L73 PolarHBondContact O-N 2.76Å; Q70-L73 VanDerWaalsContact O-N 3.07Å; Q70-Q74 PolarHBondContact O-N 2.9Å; Q70-Q74 VanDerWaalsContact O-N 3.15Å
71	F	56.9	Low	54.3	Low	12 Å²	12	88 Å²	88	5%	0.053	47%	0.471	C	S	.	.	G	3₁₀ helix	trans	-58.5	-46.4	177.4	170.7	-89.7	0	0	0	111.7	L34 M60 V67 D68 Q69 L73 Q74 I77	L34-F71 HydrophobicContact CD1-CE2 4.21Å; L34-F71 HydrophobicContact CD2-CE2 3.84Å; L34-F71 HydrophobicContact CD2-CZ 4.04Å; L34-F71 HydrophobicContact CG-CE2 4.29Å; L34-F71 HydrophobicContact CG-CZ 4.47Å; M60-F71 HydrophobicContact CE-CD2 3.36Å; M60-F71 HydrophobicContact CE-CE2 3.24Å; M60-F71 HydrophobicContact CE-CZ 4.48Å; V67-F71 HydrophobicContact CG1-CB 3.25Å; V67-F71 HydrophobicContact CG1-CD1 4.11Å; V67-F71 HydrophobicContact CG1-CD2 3.29Å; V67-F71 HydrophobicContact CG1-CE2 4.13Å; V67-F71 HydrophobicContact CG1-CG 3.28Å; D68-F71 PolarHBondContact O-N 3.39Å; Q69-F71 PolarHBondContact O-N 2.72Å; F71-L73 PolarHBondContact O-N 3.48Å; F71-Q74 WeakPolarHBondContact O-CB 3.1Å; F71-Q74 PolarHBondContact O-N 2.77Å; F71-I77 HydrophobicContact CD1-CD1 4.01Å; F71-I77 HydrophobicContact CE1-CD1 3.7Å; F71-I77 HydrophobicContact CZ-CD1 4.12Å; F71-I77 WeakPolarHBondContact O-CD1 3.22Å
72	W	54	Low	54.5	Low	56 Å²	56	89.8 Å²	89.8	21%	0.212	48%	0.481	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-18.9	177.2	-64.5	104.3	0	0	0	112.1	L33 Q69 Q70 Q74 I77 W85 V88	L33-W72 HydrophobicContact CD1-CH2 3.58Å; L33-W72 HydrophobicContact CD1-CZ3 4.16Å; Q69-W72 PolarHBondContact O-N 3.48Å; Q70-W72 PolarHBondContact O-N 2.96Å; W72-Q74 VanDerWaalsContact C-N 3.34Å; W72-I77 HydrophobicContact CE3-CD1 3.98Å; W72-I77 HydrophobicContact CE3-CG2 4.25Å; W72-I77 HydrophobicContact CZ3-CD1 4.42Å; W72-I77 HydrophobicContact CZ3-CG2 4.34Å; W72-W85 HydrophobicContact CB-CH2 4.37Å; W72-W85 HydrophobicContact CB-CZ3 4.11Å; W72-W85 HydrophobicContact CE3-CZ3 4.27Å; W72-W85 WeakPolarHBondContact O-CH2 3.34Å; W72-W85 VanDerWaalsContact O-CZ3 3.27Å; W72-W85 WeakPolarHBondContact O-CZ3 3.2Å; W72-V88 HydrophobicContact CE3-CG1 4.32Å
73	L	54.3	Low	55.2	Low	120 Å²	120	85.1 Å²	85.1	63%	0.628	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-2.3	176.6	-67.3	162.9	0	0	0	113.2	Q69 Q70 F71 K75	Q69-L73 WeakPolarHBondContact O-CG 2.94Å; Q69-L73 PolarHBondContact O-N 3.08Å; Q70-L73 CarbonylContact O-C 3.5Å; Q70-L73 WeakPolarHBondContact O-CA 3.49Å; Q70-L73 PolarHBondContact O-N 2.76Å; Q70-L73 VanDerWaalsContact O-N 3.07Å; F71-L73 PolarHBondContact O-N 3.48Å; L73-K75 PolarHBondContact O-N 3.18Å
74	Q	57.7	Low	55.8	Low	64 Å²	64	86.3 Å²	86.3	30%	0.299	47%	0.466	S	S	.	.	S	Bend	trans	-70.3	126.5	176.1	-142.1	171.1	-45.1	0	0	109.5	Q70 F71 W72 E76 I77 P78	Q70-Q74 PolarHBondContact O-N 2.9Å; Q70-Q74 VanDerWaalsContact O-N 3.15Å; F71-Q74 WeakPolarHBondContact O-CB 3.1Å; F71-Q74 PolarHBondContact O-N 2.77Å; W72-Q74 VanDerWaalsContact C-N 3.34Å; Q74-E76 PolarHBondContact NE2-OE2 3.33Å; Q74-E76 PolarHBondContact O-N 2.82Å; Q74-I77 PolarHBondContact O-N 3Å; Q74-I77 VanDerWaalsContact O-N 3.17Å; Q74-P78 WeakPolarHBondContact O-CD 3.47Å
75	K	56.5	Low	56.6	Low	170 Å²	170	80 Å²	80	74%	0.739	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.7	-24.2	-174.8	-71.6	-178.5	177.6	179	0	114.1	L73 P78 E79	L73-K75 PolarHBondContact O-N 3.18Å; K75-P78 VanDerWaalsContact O-CD 3.28Å; K75-P78 WeakPolarHBondContact O-CD 3.38Å; K75-E79 WeakPolarHBondContact O-CG 3.35Å; K75-E79 PolarHBondContact O-N 3.44Å
76	E	56.7	Low	57.2	Low	111 Å²	111	81.3 Å²	81.3	52%	0.519	42%	0.424	S	S	.	.	H	α-helix	trans	-67.8	-34	-177.7	-67	169.9	84.8	0	0	113.6	Q74 E79 L80	Q74-E76 PolarHBondContact NE2-OE2 3.33Å; Q74-E76 PolarHBondContact O-N 2.82Å; E76-E79 PolarHBondContact O-N 3.17Å; E76-L80 HydrophobicContact CB-CD1 4.29Å; E76-L80 VanDerWaalsContact O-CB 3.32Å; E76-L80 WeakPolarHBondContact O-CB 3.25Å; E76-L80 WeakPolarHBondContact O-CD1 3.3Å; E76-L80 WeakPolarHBondContact O-CG 3.19Å; E76-L80 PolarHBondContact O-N 2.94Å
77	I	60.8	Low	57.8	Low	15 Å²	15	80.1 Å²	80.1	8%	0.077	42%	0.415	C	S	.	.	H	α-helix	trans	-69.4	-46.1	-178.8	-59.2	178.7	0	0	0	112.5	F71 W72 Q74 E79 Y81 W85	F71-I77 HydrophobicContact CD1-CD1 4.01Å; F71-I77 HydrophobicContact CE1-CD1 3.7Å; F71-I77 HydrophobicContact CZ-CD1 4.12Å; F71-I77 WeakPolarHBondContact O-CD1 3.22Å; W72-I77 HydrophobicContact CE3-CD1 3.98Å; W72-I77 HydrophobicContact CE3-CG2 4.25Å; W72-I77 HydrophobicContact CZ3-CD1 4.42Å; W72-I77 HydrophobicContact CZ3-CG2 4.34Å; Q74-I77 PolarHBondContact O-N 3Å; Q74-I77 VanDerWaalsContact O-N 3.17Å; I77-E79 VanDerWaalsContact C-N 3.26Å; I77-E79 PolarHBondContact O-N 3.23Å; I77-Y81 PolarHBondContact O-N 3.39Å; I77-W85 HydrophobicContact CG2-CE3 4.1Å
78	P	58.1	Low	58.3	Low	40 Å²	40	78.5 Å²	78.5	26%	0.26	41%	0.406	S	S	.	.	H	α-helix	trans	-56.5	-37.1	171.1	-19.1	21.5	0	0	0	114.3	Q74 K75 W85	Q74-P78 WeakPolarHBondContact O-CD 3.47Å; K75-P78 VanDerWaalsContact O-CD 3.28Å; K75-P78 WeakPolarHBondContact O-CD 3.38Å; P78-W85 VanDerWaalsContact CB-CD1 3.49Å; P78-W85 HydrophobicContact CB-CD2 4.45Å; P78-W85 HydrophobicContact CB-CG 4.04Å; P78-W85 HydrophobicContact CG-CD2 4.17Å; P78-W85 HydrophobicContact CG-CG 4.28Å; P78-W85 HydrophobicContact CG-CZ2 4.2Å
79	E	62.7	Low	59	Low	153 Å²	153	79.2 Å²	79.2	72%	0.715	41%	0.405	S	S	*	.	H	α-helix	trans	-78.1	-36.9	-176.2	-70.6	-172.5	94.1	0	0	112.3	K75 E76 I77	K75-E79 WeakPolarHBondContact O-CG 3.35Å; K75-E79 PolarHBondContact O-N 3.44Å; E76-E79 PolarHBondContact O-N 3.17Å; I77-E79 VanDerWaalsContact C-N 3.26Å; I77-E79 PolarHBondContact O-N 3.23Å
80	L	58.7	Low	59.7	Low	100 Å²	100	78.6 Å²	78.6	52%	0.524	40%	0.4	S	S	.	.	H	α-helix	trans	-82.3	-35.4	-178.2	-68.9	165.3	0	0	0	113.2	E76	E76-L80 HydrophobicContact CB-CD1 4.29Å; E76-L80 VanDerWaalsContact O-CB 3.32Å; E76-L80 WeakPolarHBondContact O-CB 3.25Å; E76-L80 WeakPolarHBondContact O-CD1 3.3Å; E76-L80 WeakPolarHBondContact O-CG 3.19Å; E76-L80 PolarHBondContact O-N 2.94Å
81	Y	59	Low	60	Low	50 Å²	50	73.2 Å²	73.2	20%	0.196	38%	0.376	C	S	.	.			trans	-132.4	66	-176.9	-52.7	-74.9	0	0	0	112.6	L33 E36 I77 G83 V84 W85	L33-Y81 WeakPolarHBondContact O-CE2 3.29Å; E36-Y81 HydrophobicContact CG-CE1 4.48Å; E36-Y81 WeakPolarHBondContact CG-OH 3.41Å; E36-Y81 PolarHBondContact OE1-OH 2.83Å; I77-Y81 PolarHBondContact O-N 3.39Å; Y81-G83 PolarHBondContact O-N 3.01Å; Y81-G83 VanDerWaalsContact O-N 3.15Å; Y81-V84 PolarHBondContact O-N 2.99Å; Y81-V84 VanDerWaalsContact O-N 3.14Å; Y81-W85 VanDerWaalsContact O-CB 3.27Å; Y81-W85 WeakPolarHBondContact O-CB 3.25Å; Y81-W85 PolarHBondContact O-N 3.11Å
82	P	62.1	Low	60.2	Low	88 Å²	88	75.8 Å²	75.8	57%	0.571	39%	0.389	S	S	*	.	H	α-helix	trans	-57.4	-35.8	-176.2	22	-33.5	0	0	0	112.9	D86	P82-D86 WeakPolarHBondContact O-CB 3.48Å; P82-D86 PolarHBondContact O-N 3.45Å
83	G	62.3	Low	60.4	Low	55 Å²	55	79.4 Å²	79.4	57%	0.567	41%	0.411	S	S	*	.	H	α-helix	trans	-70.4	-39.1	178.8	0	0	0	0	0	114.2	Y81	Y81-G83 PolarHBondContact O-N 3.01Å; Y81-G83 VanDerWaalsContact O-N 3.15Å
84	V	61.4	Low	60.1	Low	77 Å²	77	78.2 Å²	78.2	47%	0.467	41%	0.412	S	S	.	.	H	α-helix	trans	-74.8	-39.5	176.7	-178.1	0	0	0	0	109.7	Y81 D86 V87 V88	Y81-V84 PolarHBondContact O-N 2.99Å; Y81-V84 VanDerWaalsContact O-N 3.14Å; V84-D86 PolarHBondContact O-N 2.89Å; V84-V87 PolarHBondContact O-N 3.32Å; V84-V88 HydrophobicContact CG1-CG2 4.07Å; V84-V88 WeakPolarHBondContact O-CB 3.26Å; V84-V88 WeakPolarHBondContact O-CG2 3.22Å; V84-V88 PolarHBondContact O-N 3.15Å
85	W	66.5	Low	59.8	Low	30 Å²	30	76.9 Å²	76.9	11%	0.114	41%	0.407	C	S	.	.	H	α-helix	trans	-63.9	-38.6	178.1	-176.7	-119.4	0	0	0	112.9	W72 I77 P78 Y81 V87 V88 K89 L92	W72-W85 HydrophobicContact CB-CH2 4.37Å; W72-W85 HydrophobicContact CB-CZ3 4.11Å; W72-W85 HydrophobicContact CE3-CZ3 4.27Å; W72-W85 WeakPolarHBondContact O-CH2 3.34Å; W72-W85 VanDerWaalsContact O-CZ3 3.27Å; W72-W85 WeakPolarHBondContact O-CZ3 3.2Å; I77-W85 HydrophobicContact CG2-CE3 4.1Å; P78-W85 VanDerWaalsContact CB-CD1 3.49Å; P78-W85 HydrophobicContact CB-CD2 4.45Å; P78-W85 HydrophobicContact CB-CG 4.04Å; P78-W85 HydrophobicContact CG-CD2 4.17Å; P78-W85 HydrophobicContact CG-CG 4.28Å; P78-W85 HydrophobicContact CG-CZ2 4.2Å; Y81-W85 VanDerWaalsContact O-CB 3.27Å; Y81-W85 WeakPolarHBondContact O-CB 3.25Å; Y81-W85 PolarHBondContact O-N 3.11Å; W85-V87 VanDerWaalsContact C-N 3.29Å; W85-V87 PolarHBondContact O-N 2.75Å; W85-V88 HydrophobicContact CE3-CB 4.16Å; W85-V88 HydrophobicContact CE3-CG1 4.01Å; W85-V88 HydrophobicContact CZ3-CG1 3.86Å; W85-V88 PolarHBondContact O-N 3Å; W85-K89 WeakPolarHBondContact O-CB 3.31Å; W85-K89 PolarHBondContact O-N 3.36Å; W85-L92 HydrophobicContact CH2-CD1 4.25Å; W85-L92 HydrophobicContact CZ3-CD1 4.29Å
86	D	61.8	Low	59.9	Low	75 Å²	75	74.9 Å²	74.9	40%	0.401	41%	0.411	S	S	.	.	H	α-helix	trans	-60.7	-39.9	175.6	-175.5	63.3	0	0	0	111.8	P82 V84 K90	P82-D86 WeakPolarHBondContact O-CB 3.48Å; P82-D86 PolarHBondContact O-N 3.45Å; V84-D86 PolarHBondContact O-N 2.89Å; D86-K90 WeakPolarHBondContact O-CB 3.46Å; D86-K90 WeakPolarHBondContact O-CD 3.27Å; D86-K90 VanDerWaalsContact O-CG 3.26Å; D86-K90 WeakPolarHBondContact O-CG 3.49Å; D86-K90 PolarHBondContact O-N 2.85Å; D86-K90 VanDerWaalsContact O-N 3.09Å; D86-K90 IonicContact OD1-NZ 2.68Å; D86-K90 WeakPolarHBondContact OD2-CE 3.32Å; D86-K90 IonicContact OD2-NZ 3.79Å; D86-K90 PolarHBondContact OD2-NZ 3.26Å
87	V	62.6	Low	59.9	Low	63 Å²	63	71.7 Å²	71.7	38%	0.382	40%	0.401	S	S	.	.	H	α-helix	trans	-69.3	-48	175.3	-179.9	0	0	0	0	111	V84 W85 K89 K90 L91	V84-V87 PolarHBondContact O-N 3.32Å; W85-V87 VanDerWaalsContact C-N 3.29Å; W85-V87 PolarHBondContact O-N 2.75Å; V87-K89 PolarHBondContact O-N 3Å; V87-K90 PolarHBondContact O-N 3.2Å; V87-L91 HydrophobicContact CG1-CD1 4.03Å; V87-L91 VanDerWaalsContact O-CG 3.25Å; V87-L91 WeakPolarHBondContact O-CG 3.33Å; V87-L91 PolarHBondContact O-N 3.39Å
88	V	62.3	Low	59.9	Low	8 Å²	8	76.2 Å²	76.2	5%	0.048	43%	0.43	C	S	.	.	H	α-helix	trans	-60.9	-43.1	178.7	172.1	0	0	0	0	111.2	W72 V84 W85 L91 L92 F105	W72-V88 HydrophobicContact CE3-CG1 4.32Å; V84-V88 HydrophobicContact CG1-CG2 4.07Å; V84-V88 WeakPolarHBondContact O-CB 3.26Å; V84-V88 WeakPolarHBondContact O-CG2 3.22Å; V84-V88 PolarHBondContact O-N 3.15Å; W85-V88 HydrophobicContact CE3-CB 4.16Å; W85-V88 HydrophobicContact CE3-CG1 4.01Å; W85-V88 HydrophobicContact CZ3-CG1 3.86Å; W85-V88 PolarHBondContact O-N 3Å; V88-L91 CarbonylContact O-C 3.58Å; V88-L91 WeakPolarHBondContact O-CB 3.4Å; V88-L91 PolarHBondContact O-N 2.9Å; V88-L92 HydrophobicContact CG1-CD1 3.57Å; V88-L92 HydrophobicContact CG1-CG 4.25Å; V88-L92 WeakPolarHBondContact O-CB 3.44Å; V88-L92 WeakPolarHBondContact O-CG 3.26Å; V88-L92 PolarHBondContact O-N 3.49Å; V88-F105 HydrophobicContact CG2-CE2 4.44Å; V88-F105 HydrophobicContact CG2-CZ 3.72Å
89	K	64.1	Low	60.1	Low	97 Å²	97	77.7 Å²	77.7	42%	0.422	44%	0.441	S	S	.	.	H	α-helix	trans	-65.6	-44.6	179.2	179.9	-179.2	-92.4	-178.5	0	111.2	W85 V87 L91 L92 I93	W85-K89 WeakPolarHBondContact O-CB 3.31Å; W85-K89 PolarHBondContact O-N 3.36Å; V87-K89 PolarHBondContact O-N 3Å; K89-L91 PolarHBondContact O-N 2.73Å; K89-L92 PolarHBondContact O-N 2.8Å; K89-I93 HydrophobicContact CD-CD1 4.45Å; K89-I93 HydrophobicContact CG-CD1 3.74Å; K89-I93 HydrophobicContact CG-CG1 4.43Å; K89-I93 WeakPolarHBondContact O-CB 3.32Å; K89-I93 WeakPolarHBondContact O-CD1 3.31Å; K89-I93 VanDerWaalsContact O-CG1 3.23Å; K89-I93 WeakPolarHBondContact O-CG1 3.34Å; K89-I93 PolarHBondContact O-N 3.04Å
90	K	64.3	Low	59.9	Low	126 Å²	126	72.9 Å²	72.9	55%	0.548	42%	0.42	S	S	.	.	H	α-helix	trans	-59.6	-34.5	173.5	-77.1	169.7	-179	164.1	0	111.9	D86 V87	D86-K90 WeakPolarHBondContact O-CB 3.46Å; D86-K90 WeakPolarHBondContact O-CD 3.27Å; D86-K90 VanDerWaalsContact O-CG 3.26Å; D86-K90 WeakPolarHBondContact O-CG 3.49Å; D86-K90 PolarHBondContact O-N 2.85Å; D86-K90 VanDerWaalsContact O-N 3.09Å; D86-K90 IonicContact OD1-NZ 2.68Å; D86-K90 WeakPolarHBondContact OD2-CE 3.32Å; D86-K90 IonicContact OD2-NZ 3.79Å; D86-K90 PolarHBondContact OD2-NZ 3.26Å; V87-K90 PolarHBondContact O-N 3.2Å
91	L	57.4	Low	60.1	Low	28 Å²	28	69.4 Å²	69.4	15%	0.147	40%	0.403	C	S	.	.	H	α-helix	trans	-75.2	-42	175.9	-69.1	171.7	0	0	0	113	V87 V88 K89 I93 C94 L95 A104 F105	V87-L91 HydrophobicContact CG1-CD1 4.03Å; V87-L91 VanDerWaalsContact O-CG 3.25Å; V87-L91 WeakPolarHBondContact O-CG 3.33Å; V87-L91 PolarHBondContact O-N 3.39Å; V88-L91 CarbonylContact O-C 3.58Å; V88-L91 WeakPolarHBondContact O-CB 3.4Å; V88-L91 PolarHBondContact O-N 2.9Å; K89-L91 PolarHBondContact O-N 2.73Å; L91-I93 PolarHBondContact O-N 3.38Å; L91-C94 PolarHBondContact O-N 3.48Å; L91-L95 HydrophobicContact CD2-CD1 4.25Å; L91-L95 VanDerWaalsContact O-CB 3.28Å; L91-L95 WeakPolarHBondContact O-CB 3.24Å; L91-L95 WeakPolarHBondContact O-CG 3.49Å; L91-L95 PolarHBondContact O-N 3.09Å; L91-L95 VanDerWaalsContact O-N 3.16Å; L91-A104 HydrophobicContact CD1-CB 4.15Å; L91-A104 HydrophobicContact CD2-CB 3.29Å; L91-A104 HydrophobicContact CG-CB 4.3Å; L91-F105 HydrophobicContact CD1-CD2 4.14Å; L91-F105 HydrophobicContact CD1-CE2 3.81Å; L91-F105 HydrophobicContact CD1-CZ 4.13Å
92	L	61.1	Low	60.1	Low	65 Å²	65	70.1 Å²	70.1	34%	0.34	41%	0.408	S	S	.	.	H	α-helix	trans	-64.5	-36.2	177.5	-82	162.2	0	0	0	112.7	W85 V88 K89	W85-L92 HydrophobicContact CH2-CD1 4.25Å; W85-L92 HydrophobicContact CZ3-CD1 4.29Å; V88-L92 HydrophobicContact CG1-CD1 3.57Å; V88-L92 HydrophobicContact CG1-CG 4.25Å; V88-L92 WeakPolarHBondContact O-CB 3.44Å; V88-L92 WeakPolarHBondContact O-CG 3.26Å; V88-L92 PolarHBondContact O-N 3.49Å; K89-L92 PolarHBondContact O-N 2.8Å
93	I	57.3	Low	60.3	Low	132 Å²	132	69.1 Å²	69.1	68%	0.677	40%	0.403	S	S	*	.	H	α-helix	trans	-70.3	-35.5	179.5	-69.4	165	0	0	0	111.6	K89 L91	K89-I93 HydrophobicContact CD-CD1 4.45Å; K89-I93 HydrophobicContact CG-CD1 3.74Å; K89-I93 HydrophobicContact CG-CG1 4.43Å; K89-I93 WeakPolarHBondContact O-CB 3.32Å; K89-I93 WeakPolarHBondContact O-CD1 3.31Å; K89-I93 VanDerWaalsContact O-CG1 3.23Å; K89-I93 WeakPolarHBondContact O-CG1 3.34Å; K89-I93 PolarHBondContact O-N 3.04Å; L91-I93 PolarHBondContact O-N 3.38Å
94	C	49.2	Very low	60.4	Low	96 Å²	96	67.3 Å²	67.3	65%	0.649	38%	0.382	S	S	*	.	H	α-helix	trans	-85.9	-17.2	-178	-70.6	0	0	0	0	113.4	L91	L91-C94 PolarHBondContact O-N 3.48Å
95	L	51.2	Low	60.6	Low	36 Å²	36	66.5 Å²	66.5	19%	0.188	37%	0.372	C	S	.	.			trans	-135.8	91.6	-164.7	-55.3	170.5	0	0	0	110.6	L91 S97 L100 V101 A104	L91-L95 HydrophobicContact CD2-CD1 4.25Å; L91-L95 VanDerWaalsContact O-CB 3.28Å; L91-L95 WeakPolarHBondContact O-CB 3.24Å; L91-L95 WeakPolarHBondContact O-CG 3.49Å; L91-L95 PolarHBondContact O-N 3.09Å; L91-L95 VanDerWaalsContact O-N 3.16Å; L95-S97 PolarHBondContact O-N 2.78Å; L95-L100 HydrophobicContact CB-CB 3.95Å; L95-L100 HydrophobicContact CD1-CB 3.81Å; L95-L100 HydrophobicContact CD2-CB 3.6Å; L95-L100 HydrophobicContact CD2-CD1 3.64Å; L95-L100 HydrophobicContact CD2-CG 4.2Å; L95-L100 HydrophobicContact CG-CB 3.96Å; L95-V101 HydrophobicContact CB-CG2 4.32Å; L95-A104 HydrophobicContact CD1-CB 4.15Å
96	P	57.5	Low	60.7	Low	127 Å²	127	67.4 Å²	67.4	83%	0.825	38%	0.383	S	S	*	.	S	Bend	trans	-67.8	-14.2	175.8	25.7	-32.1	0	0	0	112.8
97	S	57.9	Low	60.7	Low	44 Å²	44	67.9 Å²	67.9	31%	0.308	39%	0.385	S	S	.	.	S	Bend	trans	-100.5	128.9	178.3	65.9	0	0	0	0	112	L95 S99 L100	L95-S97 PolarHBondContact O-N 2.78Å; S97-S99 PolarHBondContact O-N 2.81Å; S97-S99 VanDerWaalsContact O-N 3.13Å; S97-L100 PolarHBondContact O-N 3.42Å; S97-L100 VanDerWaalsContact O-N 3.09Å; S97-L100 WeakPolarHBondContact OG-CD1 3.2Å; S97-L100 VanDerWaalsContact OG-CG 3.28Å; S97-L100 WeakPolarHBondContact OG-CG 3.37Å
98	T	61.3	Low	61	Low	110 Å²	110	67.6 Å²	67.6	68%	0.675	38%	0.383	S	S	*	.	H	α-helix	trans	-57.7	-26.4	178.7	52.9	0	0	0	0	113.1	E102	T98-E102 PolarHBondContact O-N 3.3Å
99	S	61	Low	61	Low	72 Å²	72	70.6 Å²	70.6	50%	0.503	40%	0.402	S	S	.	.	H	α-helix	trans	-68.3	-32.8	177.9	52.9	0	0	0	0	113.2	S97 E102 C103	S97-S99 PolarHBondContact O-N 2.81Å; S97-S99 VanDerWaalsContact O-N 3.13Å; S99-E102 WeakPolarHBondContact O-CB 3.28Å; S99-E102 PolarHBondContact O-N 2.77Å; S99-C103 PolarHBondContact O-N 3.15Å; S99-C103 VanDerWaalsContact O-N 3.17Å
100	L	59.8	Low	61	Low	52 Å²	52	68.5 Å²	68.5	27%	0.272	40%	0.395	S	S	.	.	H	α-helix	trans	-80.7	-28.5	-179	-63.7	172.7	0	0	0	111.5	L95 S97 E102 C103 A104	L95-L100 HydrophobicContact CB-CB 3.95Å; L95-L100 HydrophobicContact CD1-CB 3.81Å; L95-L100 HydrophobicContact CD2-CB 3.6Å; L95-L100 HydrophobicContact CD2-CD1 3.64Å; L95-L100 HydrophobicContact CD2-CG 4.2Å; L95-L100 HydrophobicContact CG-CB 3.96Å; S97-L100 PolarHBondContact O-N 3.42Å; S97-L100 VanDerWaalsContact O-N 3.09Å; S97-L100 WeakPolarHBondContact OG-CD1 3.2Å; S97-L100 VanDerWaalsContact OG-CG 3.28Å; S97-L100 WeakPolarHBondContact OG-CG 3.37Å; L100-E102 VanDerWaalsContact C-N 3.3Å; L100-E102 PolarHBondContact O-N 3.19Å; L100-C103 PolarHBondContact O-N 3.08Å; L100-A104 WeakPolarHBondContact O-CB 3.42Å; L100-A104 PolarHBondContact O-N 3.19Å
101	V	61.4	Low	61	Low	26 Å²	26	67 Å²	67	16%	0.158	39%	0.393	C	S	.	.	H	α-helix	trans	-57.9	-45.7	169.1	176.9	0	0	0	0	109.7	L95 A104 F105	L95-V101 HydrophobicContact CB-CG2 4.32Å; V101-A104 PolarHBondContact O-N 2.94Å; V101-F105 HydrophobicContact CG1-CD2 3.7Å; V101-F105 HydrophobicContact CG1-CE2 3.76Å; V101-F105 VanDerWaalsContact O-CD2 3.29Å; V101-F105 WeakPolarHBondContact O-CD2 3.33Å; V101-F105 PolarHBondContact O-N 3.2Å
102	E	60.3	Low	61.1	Low	65 Å²	65	69.7 Å²	69.7	30%	0.304	41%	0.41	S	S	.	.	H	α-helix	trans	-59.7	-46.4	173.8	-62	-60.3	122.4	0	0	112.7	L16 T98 S99 L100 A104 F105 S106	L16-E102 WeakPolarHBondContact CD1-OE1 3.28Å; L16-E102 WeakPolarHBondContact CD1-OE2 3.3Å; T98-E102 PolarHBondContact O-N 3.3Å; S99-E102 WeakPolarHBondContact O-CB 3.28Å; S99-E102 PolarHBondContact O-N 2.77Å; L100-E102 VanDerWaalsContact C-N 3.3Å; L100-E102 PolarHBondContact O-N 3.19Å; E102-A104 VanDerWaalsContact C-N 3.29Å; E102-A104 PolarHBondContact O-N 3.35Å; E102-F105 PolarHBondContact O-N 3.45Å; E102-S106 WeakPolarHBondContact O-CB 3.42Å; E102-S106 PolarHBondContact O-N 3.17Å
103	C	66.3	Low	61	Low	68 Å²	68	71.2 Å²	71.2	46%	0.459	42%	0.422	S	S	.	.	H	α-helix	trans	-60.3	-41.5	177.3	-75.6	0	0	0	0	111.2	S99 L100 S106 I107	S99-C103 PolarHBondContact O-N 3.15Å; S99-C103 VanDerWaalsContact O-N 3.17Å; L100-C103 PolarHBondContact O-N 3.08Å; C103-S106 PolarHBondContact O-N 3.34Å; C103-I107 WeakPolarHBondContact O-CB 3.38Å; C103-I107 WeakPolarHBondContact O-CD1 3.32Å; C103-I107 WeakPolarHBondContact O-CG1 3.21Å; C103-I107 PolarHBondContact O-N 3.16Å
104	A	64.4	Low	60.9	Low	16 Å²	16	68 Å²	68	13%	0.132	40%	0.404	C	S	.	.	H	α-helix	trans	-69	-42.4	179	0	0	0	0	0	112.2	L91 L95 L100 V101 E102 S106 I107 V108	L91-A104 HydrophobicContact CD1-CB 4.15Å; L91-A104 HydrophobicContact CD2-CB 3.29Å; L91-A104 HydrophobicContact CG-CB 4.3Å; L95-A104 HydrophobicContact CD1-CB 4.15Å; L100-A104 WeakPolarHBondContact O-CB 3.42Å; L100-A104 PolarHBondContact O-N 3.19Å; V101-A104 PolarHBondContact O-N 2.94Å; E102-A104 VanDerWaalsContact C-N 3.29Å; E102-A104 PolarHBondContact O-N 3.35Å; A104-S106 VanDerWaalsContact C-N 3.33Å; A104-S106 PolarHBondContact O-N 2.81Å; A104-I107 PolarHBondContact O-N 2.76Å; A104-V108 WeakPolarHBondContact O-CB 3.25Å; A104-V108 WeakPolarHBondContact O-CG2 3.15Å; A104-V108 PolarHBondContact O-N 3.38Å
105	F	65.3	Low	61	Low	61 Å²	61	71.6 Å²	71.6	27%	0.268	41%	0.409	S	S	.	.	H	α-helix	trans	-63.1	-38.6	172.2	-88.3	-76.8	0	0	0	112	V88 L91 V101 E102 V108 T109	V88-F105 HydrophobicContact CG2-CE2 4.44Å; V88-F105 HydrophobicContact CG2-CZ 3.72Å; L91-F105 HydrophobicContact CD1-CD2 4.14Å; L91-F105 HydrophobicContact CD1-CE2 3.81Å; L91-F105 HydrophobicContact CD1-CZ 4.13Å; V101-F105 HydrophobicContact CG1-CD2 3.7Å; V101-F105 HydrophobicContact CG1-CE2 3.76Å; V101-F105 VanDerWaalsContact O-CD2 3.29Å; V101-F105 WeakPolarHBondContact O-CD2 3.33Å; V101-F105 PolarHBondContact O-N 3.2Å; E102-F105 PolarHBondContact O-N 3.45Å; F105-V108 PolarHBondContact O-N 3.39Å; F105-T109 VanDerWaalsContact O-CB 3.3Å; F105-T109 WeakPolarHBondContact O-CB 3.27Å; F105-T109 WeakPolarHBondContact O-CG2 3.48Å; F105-T109 PolarHBondContact O-N 3.45Å; F105-T109 PolarHBondContact O-OG1 2.85Å
106	S	67.9	Low	60.9	Low	49 Å²	49	81.5 Å²	81.5	34%	0.343	44%	0.444	S	S	.	.	H	α-helix	trans	-64.8	-40.3	173.7	-176.7	0	0	0	0	111.9	E102 C103 A104 T109 D110	E102-S106 WeakPolarHBondContact O-CB 3.42Å; E102-S106 PolarHBondContact O-N 3.17Å; C103-S106 PolarHBondContact O-N 3.34Å; A104-S106 VanDerWaalsContact C-N 3.33Å; A104-S106 PolarHBondContact O-N 2.81Å; S106-T109 WeakPolarHBondContact CA-OG1 3.38Å; S106-T109 PolarHBondContact O-OG1 3.14Å; S106-D110 VanDerWaalsContact O-CB 3.25Å; S106-D110 WeakPolarHBondContact O-CB 3.48Å; S106-D110 PolarHBondContact O-N 3.06Å
107	I	63.2	Low	60.4	Low	84 Å²	84	78.3 Å²	78.3	43%	0.431	42%	0.424	S	S	.	.	H	α-helix	trans	-69.4	-43.3	177.1	-69.4	162.3	0	0	0	110.7	C103 A104 D110 L111	C103-I107 WeakPolarHBondContact O-CB 3.38Å; C103-I107 WeakPolarHBondContact O-CD1 3.32Å; C103-I107 WeakPolarHBondContact O-CG1 3.21Å; C103-I107 PolarHBondContact O-N 3.16Å; A104-I107 PolarHBondContact O-N 2.76Å; I107-D110 PolarHBondContact O-N 3.26Å; I107-L111 WeakPolarHBondContact O-CB 3.21Å; I107-L111 PolarHBondContact O-N 2.96Å
108	V	67.6	Low	59.9	Low	58 Å²	58	85.2 Å²	85.2	35%	0.352	45%	0.451	S	S	.	.	H	α-helix	trans	-64.8	-43.4	178	170.3	0	0	0	0	110.4	A104 F105 L111 V112	A104-V108 WeakPolarHBondContact O-CB 3.25Å; A104-V108 WeakPolarHBondContact O-CG2 3.15Å; A104-V108 PolarHBondContact O-N 3.38Å; F105-V108 PolarHBondContact O-N 3.39Å; V108-L111 PolarHBondContact O-N 3.49Å; V108-V112 HydrophobicContact CG1-CG2 4.25Å; V108-V112 VanDerWaalsContact O-CB 3.25Å; V108-V112 WeakPolarHBondContact O-CB 3.45Å; V108-V112 WeakPolarHBondContact O-CG2 3.25Å; V108-V112 PolarHBondContact O-N 3.38Å
109	T	63.4	Low	59.4	Low	71 Å²	71	87.4 Å²	87.4	44%	0.436	46%	0.458	S	S	.	.	H	α-helix	trans	-66.4	-40.2	175.6	53.6	0	0	0	0	111.8	F105 S106 T113	F105-T109 VanDerWaalsContact O-CB 3.3Å; F105-T109 WeakPolarHBondContact O-CB 3.27Å; F105-T109 WeakPolarHBondContact O-CG2 3.48Å; F105-T109 PolarHBondContact O-N 3.45Å; F105-T109 PolarHBondContact O-OG1 2.85Å; S106-T109 WeakPolarHBondContact CA-OG1 3.38Å; S106-T109 PolarHBondContact O-OG1 3.14Å; T109-T113 VanDerWaalsContact O-CB 3.25Å; T109-T113 WeakPolarHBondContact O-CB 3.45Å; T109-T113 WeakPolarHBondContact O-CG2 3.46Å; T109-T113 PolarHBondContact O-N 3.15Å; T109-T113 PolarHBondContact O-OG1 2.62Å
110	D	64	Low	58.9	Low	53 Å²	53	90.3 Å²	90.3	28%	0.283	46%	0.464	S	S	.	.	H	α-helix	trans	-61.6	-50.8	172.9	-155.6	-78.2	0	0	0	110.1	S106 I107 V112 T113 Q114 R130	S106-D110 VanDerWaalsContact O-CB 3.25Å; S106-D110 WeakPolarHBondContact O-CB 3.48Å; S106-D110 PolarHBondContact O-N 3.06Å; I107-D110 PolarHBondContact O-N 3.26Å; D110-V112 PolarHBondContact O-N 2.96Å; D110-T113 WeakPolarHBondContact CA-OG1 2.88Å; D110-T113 PolarHBondContact O-N 3.08Å; D110-T113 PolarHBondContact O-OG1 2.89Å; D110-T113 VanDerWaalsContact O-OG1 3.08Å; D110-Q114 VanDerWaalsContact O-CB 3.24Å; D110-Q114 WeakPolarHBondContact O-CB 3.27Å; D110-Q114 PolarHBondContact O-N 2.88Å; D110-R130 IonicContact OD2-NH1 3.72Å
111	L	62.6	Low	58.4	Low	95 Å²	95	91.1 Å²	91.1	50%	0.497	47%	0.468	S	S	.	.	H	α-helix	trans	-59.6	-41.8	179.9	-159.3	83.7	0	0	0	112.8	I107 V108 K115	I107-L111 WeakPolarHBondContact O-CB 3.21Å; I107-L111 PolarHBondContact O-N 2.96Å; V108-L111 PolarHBondContact O-N 3.49Å; L111-K115 WeakPolarHBondContact O-CB 3.24Å; L111-K115 PolarHBondContact O-N 3.49Å
112	V	61.4	Low	57.9	Low	84 Å²	84	96.8 Å²	96.8	51%	0.509	50%	0.502	S	S	.	.	H	α-helix	trans	-73.6	-36.4	179	171.6	0	0	0	0	111.4	V108 D110	V108-V112 HydrophobicContact CG1-CG2 4.25Å; V108-V112 VanDerWaalsContact O-CB 3.25Å; V108-V112 WeakPolarHBondContact O-CB 3.45Å; V108-V112 WeakPolarHBondContact O-CG2 3.25Å; V108-V112 PolarHBondContact O-N 3.38Å; D110-V112 PolarHBondContact O-N 2.96Å
113	T	58.5	Low	57.3	Low	97 Å²	97	104.5 Å²	104.5	60%	0.595	53%	0.529	S	S	*	.	H	α-helix	trans	-78.5	-32.1	178	53.9	0	0	0	0	112.9	T109 D110	T109-T113 VanDerWaalsContact O-CB 3.25Å; T109-T113 WeakPolarHBondContact O-CB 3.45Å; T109-T113 WeakPolarHBondContact O-CG2 3.46Å; T109-T113 PolarHBondContact O-N 3.15Å; T109-T113 PolarHBondContact O-OG1 2.62Å; D110-T113 WeakPolarHBondContact CA-OG1 2.88Å; D110-T113 PolarHBondContact O-N 3.08Å; D110-T113 PolarHBondContact O-OG1 2.89Å; D110-T113 VanDerWaalsContact O-OG1 3.08Å
114	Q	54.8	Low	56.5	Low	63 Å²	63	110.3 Å²	110.3	29%	0.294	54%	0.541	S	S	.	.	H	α-helix	trans	-75.3	-26.2	177.2	-114.2	-176.6	14.7	0	0	113.2	D110 R116 S117 I121	D110-Q114 VanDerWaalsContact O-CB 3.24Å; D110-Q114 WeakPolarHBondContact O-CB 3.27Å; D110-Q114 PolarHBondContact O-N 2.88Å; Q114-R116 PolarHBondContact O-N 3.44Å; Q114-S117 PolarHBondContact O-N 2.68Å; Q114-I121 HydrophobicContact CB-CD1 3.48Å; Q114-I121 VanDerWaalsContact CB-CD1 3.48Å; Q114-I121 HydrophobicContact CB-CG1 4.27Å; Q114-I121 VanDerWaalsContact CD-CG1 3.47Å; Q114-I121 HydrophobicContact CG-CD1 3.56Å; Q114-I121 HydrophobicContact CG-CG1 3.78Å; Q114-I121 WeakPolarHBondContact O-CD1 3.3Å
115	K	52.1	Low	55.8	Low	173 Å²	173	112.2 Å²	112.2	75%	0.752	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.2	-4.9	-177.4	-121.5	178.7	177.6	-179.3	0	115.2	L111	L111-K115 WeakPolarHBondContact O-CB 3.24Å; L111-K115 PolarHBondContact O-N 3.49Å
116	R	47.9	Very low	55.2	Low	244 Å²	244	114.8 Å²	114.8	92%	0.921	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.6	-3	171.4	-75.6	-164.3	177.3	-177.9	1.1	115.4	Q114	Q114-R116 PolarHBondContact O-N 3.44Å
117	S	48.5	Very low	54.3	Low	59 Å²	59	117.8 Å²	117.8	41%	0.413	59%	0.586	S	S	.	*			trans	-114.9	78.1	167	75	0	0	0	0	110.3	Q114 L119	Q114-S117 PolarHBondContact O-N 2.68Å; S117-L119 PolarHBondContact O-N 2.77Å
118	Q	47.3	Very low	53.5	Low	189 Å²	189	124.5 Å²	124.5	88%	0.883	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.8	16	-174.8	-142	-163.8	63	0	0	115
119	L	50.6	Low	52.6	Low	156 Å²	156	126.9 Å²	126.9	82%	0.817	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.3	-2.1	-170.7	-82.1	162	0	0	0	116.1	S117	S117-L119 PolarHBondContact O-N 2.77Å
120	Q	50	Low	52	Low	133 Å²	133	130.5 Å²	130.5	62%	0.621	62%	0.622	S	S	*	*	S	Bend	trans	-129.4	-8.7	-171.6	-71.4	-73.3	-28.8	0	0	116.3
121	I	49.8	Very low	51.3	Low	69 Å²	69	132.6 Å²	132.6	35%	0.354	64%	0.637	S	S	.	*	S	Bend	trans	-82.8	-28.1	-170.4	-55.9	167	0	0	0	112.3	Q114 R123	Q114-I121 HydrophobicContact CB-CD1 3.48Å; Q114-I121 VanDerWaalsContact CB-CD1 3.48Å; Q114-I121 HydrophobicContact CB-CG1 4.27Å; Q114-I121 VanDerWaalsContact CD-CG1 3.47Å; Q114-I121 HydrophobicContact CG-CD1 3.56Å; Q114-I121 HydrophobicContact CG-CG1 3.78Å; Q114-I121 WeakPolarHBondContact O-CD1 3.3Å; I121-R123 VanDerWaalsContact C-N 3.32Å; I121-R123 PolarHBondContact O-N 3.2Å
122	V	49.7	Very low	50.6	Low	146 Å²	146	133 Å²	133	89%	0.885	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.4	-19.9	-177.8	174.7	0	0	0	0	112.7
123	R	48.8	Very low	50	Low	227 Å²	227	135.9 Å²	135.9	86%	0.857	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.7	-7.2	-171.2	-75.1	-165.7	174.2	-160.3	-0.7	116.2	I121	I121-R123 VanDerWaalsContact C-N 3.32Å; I121-R123 PolarHBondContact O-N 3.2Å
124	R	49.8	Very low	49.5	Very low	189 Å²	189	137 Å²	137	71%	0.713	66%	0.656	S	S	*	*	S	Bend	trans	-112.3	1.1	-167.9	-107.1	-172.1	-173.8	-147.7	2.3	117.4	H126	R124-H126 PolarHBondContact O-N 3.32Å; R124-H126 PolarHBondContact O-ND1 2.94Å
125	G	48.2	Very low	49.1	Very low	57 Å²	57	141.6 Å²	141.6	59%	0.588	68%	0.678	S	S	*	*			trans	57.9	-1.9	172.2	0	0	0	0	0	117.2	L127 R128	G125-L127 VanDerWaalsContact C-N 3.34Å; G125-L127 PolarHBondContact O-N 2.88Å; G125-R128 PolarHBondContact O-N 3.28Å
126	H	52.9	Low	48.7	Very low	114 Å²	114	138.8 Å²	138.8	53%	0.528	68%	0.677	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78	-15	-167.4	-86.3	93.4	0	0	0	113.8	R124 L129	R124-H126 PolarHBondContact O-N 3.32Å; R124-H126 PolarHBondContact O-ND1 2.94Å; H126-L129 PolarHBondContact O-N 3.02Å
127	L	48.8	Very low	48.5	Very low	112 Å²	112	133.8 Å²	133.8	59%	0.586	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.7	-28.4	178.5	-149.8	72.6	0	0	0	112.1	G125	G125-L127 VanDerWaalsContact C-N 3.34Å; G125-L127 PolarHBondContact O-N 2.88Å
128	R	46.9	Very low	48.5	Very low	225 Å²	225	136 Å²	136	85%	0.849	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.3	-15.1	175.8	-95.1	177.8	71.6	-178.2	2.1	114.1	G125 T132	G125-R128 PolarHBondContact O-N 3.28Å; R128-T132 PolarHBondContact O-OG1 2.61Å
129	L	48.8	Very low	48.7	Very low	108 Å²	108	133.5 Å²	133.5	57%	0.565	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.9	-20.2	-179.1	-74	167.6	0	0	0	113.5	H126 T132	H126-L129 PolarHBondContact O-N 3.02Å; L129-T132 PolarHBondContact O-OG1 3.09Å
130	R	51.4	Low	48.2	Very low	148 Å²	148	132.9 Å²	132.9	56%	0.558	72%	0.718	S	S	*	*	S	Bend	trans	-85.6	-12.7	179.6	-66.2	-174.2	82.3	-172.5	2.4	114	D110	D110-R130 IonicContact OD2-NH1 3.72Å
131	V	48.1	Very low	48.1	Very low	97 Å²	97	132.9 Å²	132.9	59%	0.588	72%	0.723	S	S	*	*	S	Bend	trans	-92.5	-18.3	177.6	179.8	0	0	0	0	112
132	T	49	Very low	48	Very low	102 Å²	102	136.2 Å²	136.2	63%	0.626	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.1	-4.6	-176.2	25	0	0	0	0	115.1	R128 L129 I134	R128-T132 PolarHBondContact O-OG1 2.61Å; L129-T132 PolarHBondContact O-OG1 3.09Å; T132-I134 PolarHBondContact O-N 2.7Å
133	L	48.8	Very low	47.9	Very low	146 Å²	146	135.7 Å²	135.7	76%	0.764	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.9	8.6	175.1	-92.9	157.9	0	0	0	113.8	E135	L133-E135 VanDerWaalsContact C-N 3.27Å; L133-E135 PolarHBondContact O-N 2.79Å; L133-E135 VanDerWaalsContact O-N 3.17Å
134	I	48.4	Very low	47.9	Very low	119 Å²	119	130.3 Å²	130.3	61%	0.61	73%	0.727	S	S	*	*			trans	-83.3	80.6	165.9	-54.2	171.4	0	0	0	106.1	T132	T132-I134 PolarHBondContact O-N 2.7Å
135	E	44.8	Very low	47.8	Very low	161 Å²	161	126.6 Å²	126.6	75%	0.752	73%	0.728	S	S	*	*			trans	-64.5	130.3	166.3	-65.5	-164.3	121.8	0	0	108.2	L133 T137	L133-E135 VanDerWaalsContact C-N 3.27Å; L133-E135 PolarHBondContact O-N 2.79Å; L133-E135 VanDerWaalsContact O-N 3.17Å; E135-T137 PolarHBondContact O-N 3.43Å
136	P	44.6	Very low	47.7	Very low	114 Å²	114	131.3 Å²	131.3	74%	0.74	74%	0.737	S	S	*	*			trans	-69.2	108.3	170.5	29	-29	0	0	0	106.5	S138	P136-S138 PolarHBondContact O-N 2.96Å
137	T	43.2	Very low	47.4	Very low	139 Å²	139	132.5 Å²	132.5	85%	0.853	75%	0.752	S	S	*	*			trans	-63.5	83.2	159	44.8	0	0	0	0	107.7	E135 T139	E135-T137 PolarHBondContact O-N 3.43Å; T137-T139 PolarHBondContact O-N 2.81Å
138	S	48.4	Very low	47.3	Very low	106 Å²	106	134.1 Å²	134.1	74%	0.741	77%	0.765	S	S	*	*			trans	-83.9	98.6	161.4	59	0	0	0	0	107.5	P136 G140	P136-S138 PolarHBondContact O-N 2.96Å; S138-G140 PolarHBondContact O-N 3.01Å
139	T	52	Low	47.3	Very low	136 Å²	136	126.5 Å²	126.5	83%	0.834	76%	0.758	S	S	*	*			trans	-50.4	124.6	161.1	-56.4	0	0	0	0	109.2	T137	T137-T139 PolarHBondContact O-N 2.81Å
140	G	40.1	Very low	47.2	Very low	142 Å²	142	128.2 Å²	128.2	100%	1.464	78%	0.776	S	S	*	*			trans	-81.4	0	161.7	0	0	0	0	0	111.9	S138	S138-G140 PolarHBondContact O-N 3.01Å

Retrieved 140 of 140 residues in 215.9 ms (Link to these results)

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