A0A087WTA9_HUMAN Loading...

Serine peptidase inhibitor Kazal type 2

AlphaFold DB , UniProt , Accession A0A087WTA9, Species HUMAN (Homo sapiens, Human), Gene SPINK2, Length 134 aa.

						>A0A087WTA9_HUMAN|A0A087WTA9|SPINK2
MALSVLRLALLLLAVTFAGSARSGPGERGPPEKSGFGSQTGGGPCPAPGGLGDGTRAPVTGGSPEDLPGKVVIILKSFEMDPADGAVYRKEDGETTFTGRLDKLHFPFFSFPVFLYMRFVNTHFLRAGMEDSHV
					

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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	53.9	Low	68.3	Low	209 Å²	209	110.4 Å²	110.4	100%	1.03	60%	0.602	S	S	*	*				0	-42.8	0	-61.3	-165.6	-172	0	0	113.1	L3 S4	M1-L3 PolarHBondContact O-N 3.14Å; M1-S4 PolarHBondContact O-N 3.37Å; M1-S4 PolarHBondContact O-OG 3.48Å
2	A	56.2	Low	68.9	Low	86 Å²	86	109.9 Å²	109.9	71%	0.711	60%	0.597	S	S	*	*	H	α-helix	trans	-62.9	-37.1	-179.6	0	0	0	0	0	114.6	S4 V5 L6	A2-S4 PolarHBondContact O-N 2.81Å; A2-V5 PolarHBondContact O-N 2.95Å; A2-L6 PolarHBondContact O-N 3.23Å; A2-L6 VanDerWaalsContact O-N 3.1Å
3	L	58.9	Low	69.3	Low	127 Å²	127	109.9 Å²	109.9	67%	0.665	60%	0.596	S	S	*	*	H	α-helix	trans	-65.1	-35.8	179.7	-85.5	153.4	0	0	0	113.7	M1 R7	M1-L3 PolarHBondContact O-N 3.14Å; L3-R7 WeakPolarHBondContact O-CG 2.96Å; L3-R7 PolarHBondContact O-N 3.18Å
4	S	60.2	Low	69.4	Low	75 Å²	75	106.1 Å²	106.1	52%	0.524	59%	0.587	S	S	.	*	H	α-helix	trans	-72.2	-35.2	179.4	49.5	0	0	0	0	111.7	M1 A2 R7 L8	M1-S4 PolarHBondContact O-N 3.37Å; M1-S4 PolarHBondContact O-OG 3.48Å; A2-S4 PolarHBondContact O-N 2.81Å; S4-R7 PolarHBondContact O-N 2.77Å; S4-L8 WeakPolarHBondContact O-CB 2.95Å; S4-L8 PolarHBondContact O-N 3.32Å
5	V	73.6	Confident	69.5	Low	83 Å²	83	106.1 Å²	106.1	50%	0.503	59%	0.591	S	S	.	*	H	α-helix	trans	-68.6	-42.6	175.8	-179.8	0	0	0	0	110.9	A2 R7 L8 A9	A2-V5 PolarHBondContact O-N 2.95Å; V5-R7 VanDerWaalsContact C-N 3.34Å; V5-R7 PolarHBondContact O-N 2.77Å; V5-L8 PolarHBondContact O-N 2.66Å; V5-A9 PolarHBondContact O-N 3.1Å
6	L	70.4	Confident	69.2	Low	90 Å²	90	105.6 Å²	105.6	47%	0.471	59%	0.591	S	S	.	*	H	α-helix	trans	-60.8	-43.4	174.8	-179.7	62.8	0	0	0	111.7	A2 A9 L10	A2-L6 PolarHBondContact O-N 3.23Å; A2-L6 VanDerWaalsContact O-N 3.1Å; L6-A9 PolarHBondContact O-N 3.14Å; L6-L10 HydrophobicContact CD1-CD1 4.49Å; L6-L10 HydrophobicContact CG-CD1 4.28Å; L6-L10 WeakPolarHBondContact O-CG 3.46Å; L6-L10 PolarHBondContact O-N 2.82Å
7	R	70.7	Confident	68.4	Low	178 Å²	178	108.8 Å²	108.8	67%	0.672	60%	0.597	S	S	*	*	H	α-helix	trans	-63	-42.4	175.8	-75.8	-178.2	179.9	-165.6	0.5	112.1	L3 S4 V5 L10 L11	L3-R7 WeakPolarHBondContact O-CG 2.96Å; L3-R7 PolarHBondContact O-N 3.18Å; S4-R7 PolarHBondContact O-N 2.77Å; V5-R7 VanDerWaalsContact C-N 3.34Å; V5-R7 PolarHBondContact O-N 2.77Å; R7-L10 PolarHBondContact O-N 3.4Å; R7-L11 WeakPolarHBondContact O-CB 3.2Å; R7-L11 VanDerWaalsContact O-CG 3.29Å; R7-L11 WeakPolarHBondContact O-CG 3.37Å; R7-L11 PolarHBondContact O-N 2.84Å
8	L	71.6	Confident	67.5	Low	107 Å²	107	106.9 Å²	106.9	56%	0.56	60%	0.599	S	S	*	*	H	α-helix	trans	-61.3	-44.4	176.2	-168.4	81.9	0	0	0	111.3	S4 V5 L10 L11 L12	S4-L8 WeakPolarHBondContact O-CB 2.95Å; S4-L8 PolarHBondContact O-N 3.32Å; V5-L8 PolarHBondContact O-N 2.66Å; L8-L10 PolarHBondContact O-N 3.4Å; L8-L11 PolarHBondContact O-N 3.43Å; L8-L12 HydrophobicContact CG-CD1 4.35Å; L8-L12 WeakPolarHBondContact O-CG 3.23Å; L8-L12 PolarHBondContact O-N 3.2Å
9	A	77	Confident	66.6	Low	42 Å²	42	104 Å²	104	35%	0.347	60%	0.595	S	S	.	*	H	α-helix	trans	-61.9	-42.5	178	0	0	0	0	0	112.3	V5 L6 L12 L13	V5-A9 PolarHBondContact O-N 3.1Å; L6-A9 PolarHBondContact O-N 3.14Å; A9-L12 PolarHBondContact O-N 2.98Å; A9-L13 WeakPolarHBondContact O-CB 3.33Å; A9-L13 PolarHBondContact O-N 3.44Å
10	L	77.7	Confident	65.6	Low	101 Å²	101	103.4 Å²	103.4	53%	0.529	60%	0.597	S	S	.	*	H	α-helix	trans	-66.3	-37.7	176.4	-69.1	172.7	0	0	0	112.3	L6 R7 L8 L13 A14	L6-L10 HydrophobicContact CD1-CD1 4.49Å; L6-L10 HydrophobicContact CG-CD1 4.28Å; L6-L10 WeakPolarHBondContact O-CG 3.46Å; L6-L10 PolarHBondContact O-N 2.82Å; R7-L10 PolarHBondContact O-N 3.4Å; L8-L10 PolarHBondContact O-N 3.4Å; L10-L13 PolarHBondContact O-N 3.43Å; L10-A14 WeakPolarHBondContact O-CB 3.36Å; L10-A14 PolarHBondContact O-N 2.97Å
11	L	80.6	Confident	64.6	Low	116 Å²	116	102.2 Å²	102.2	61%	0.607	60%	0.6	S	S	*	*	H	α-helix	trans	-66.1	-42.8	176	-74	168.7	0	0	0	111.8	R7 L8 L13 A14 V15	R7-L11 WeakPolarHBondContact O-CB 3.2Å; R7-L11 VanDerWaalsContact O-CG 3.29Å; R7-L11 WeakPolarHBondContact O-CG 3.37Å; R7-L11 PolarHBondContact O-N 2.84Å; L8-L11 PolarHBondContact O-N 3.43Å; L11-L13 VanDerWaalsContact C-N 3.34Å; L11-L13 PolarHBondContact O-N 3.1Å; L11-A14 PolarHBondContact O-N 2.89Å; L11-V15 WeakPolarHBondContact O-CG2 2.91Å; L11-V15 PolarHBondContact O-N 2.58Å
12	L	76	Confident	64.4	Low	105 Å²	105	103.7 Å²	103.7	55%	0.55	59%	0.594	S	S	.	*	H	α-helix	trans	-63.7	-40.7	175.8	-69.8	172	0	0	0	111.5	L8 A9 A14 V15 T16	L8-L12 HydrophobicContact CG-CD1 4.35Å; L8-L12 WeakPolarHBondContact O-CG 3.23Å; L8-L12 PolarHBondContact O-N 3.2Å; A9-L12 PolarHBondContact O-N 2.98Å; L12-A14 PolarHBondContact O-N 3.29Å; L12-V15 PolarHBondContact O-N 3.27Å; L12-T16 WeakPolarHBondContact O-CB 3.29Å; L12-T16 PolarHBondContact O-N 3.47Å; L12-T16 PolarHBondContact O-OG1 3.02Å
13	L	73.9	Confident	64	Low	110 Å²	110	105.1 Å²	105.1	58%	0.576	60%	0.599	S	S	*	*	H	α-helix	trans	-60.8	-45	174.8	-173.4	67.3	0	0	0	111.3	A9 L10 L11 T16 F17	A9-L13 WeakPolarHBondContact O-CB 3.33Å; A9-L13 PolarHBondContact O-N 3.44Å; L10-L13 PolarHBondContact O-N 3.43Å; L11-L13 VanDerWaalsContact C-N 3.34Å; L11-L13 PolarHBondContact O-N 3.1Å; L13-T16 PolarHBondContact O-N 3.37Å; L13-F17 WeakPolarHBondContact O-CB 3.35Å; L13-F17 PolarHBondContact O-N 3.36Å
14	A	70.3	Confident	63.2	Low	57 Å²	57	102.3 Å²	102.3	47%	0.471	60%	0.601	S	S	.	*	H	α-helix	trans	-64.2	-42.2	178	0	0	0	0	0	112.6	L10 L11 L12 T16 F17 A18	L10-A14 WeakPolarHBondContact O-CB 3.36Å; L10-A14 PolarHBondContact O-N 2.97Å; L11-A14 PolarHBondContact O-N 2.89Å; L12-A14 PolarHBondContact O-N 3.29Å; A14-T16 VanDerWaalsContact C-N 3.32Å; A14-T16 PolarHBondContact O-N 3.49Å; A14-F17 PolarHBondContact O-N 2.94Å; A14-A18 VanDerWaalsContact O-CB 3.28Å; A14-A18 WeakPolarHBondContact O-CB 3.32Å; A14-A18 PolarHBondContact O-N 2.94Å
15	V	71.6	Confident	62.3	Low	106 Å²	106	104.8 Å²	104.8	64%	0.642	62%	0.615	S	S	*	*	H	α-helix	trans	-64.2	-38.4	176.1	171.3	0	0	0	0	111.3	L11 L12 G19	L11-V15 WeakPolarHBondContact O-CG2 2.91Å; L11-V15 PolarHBondContact O-N 2.58Å; L12-V15 PolarHBondContact O-N 3.27Å; V15-G19 PolarHBondContact O-N 2.97Å
16	T	63.9	Low	61.3	Low	97 Å²	97	104.5 Å²	104.5	60%	0.595	63%	0.629	S	S	*	*	H	α-helix	trans	-67.6	-42.9	177.5	-48.2	0	0	0	0	111.2	L12 L13 A14 G19 S20	L12-T16 WeakPolarHBondContact O-CB 3.29Å; L12-T16 PolarHBondContact O-N 3.47Å; L12-T16 PolarHBondContact O-OG1 3.02Å; L13-T16 PolarHBondContact O-N 3.37Å; A14-T16 VanDerWaalsContact C-N 3.32Å; A14-T16 PolarHBondContact O-N 3.49Å; T16-G19 PolarHBondContact O-N 3.26Å; T16-S20 WeakPolarHBondContact O-CB 3.36Å; T16-S20 PolarHBondContact O-N 2.97Å
17	F	55.6	Low	59.9	Low	160 Å²	160	109.7 Å²	109.7	70%	0.702	65%	0.651	S	S	*	*	H	α-helix	trans	-69.3	-37.9	179.2	-145.8	-92.7	0	0	0	112.2	L13 A14 G19 S20 A21	L13-F17 WeakPolarHBondContact O-CB 3.35Å; L13-F17 PolarHBondContact O-N 3.36Å; A14-F17 PolarHBondContact O-N 2.94Å; F17-G19 VanDerWaalsContact C-N 3.34Å; F17-S20 PolarHBondContact O-N 3.46Å; F17-A21 PolarHBondContact O-N 3.46Å
18	A	53.8	Low	59	Low	75 Å²	75	113 Å²	113	62%	0.62	66%	0.663	S	S	*	*	H	α-helix	trans	-67.9	-32.1	174.2	0	0	0	0	0	112.7	A14	A14-A18 VanDerWaalsContact O-CB 3.28Å; A14-A18 WeakPolarHBondContact O-CB 3.32Å; A14-A18 PolarHBondContact O-N 2.94Å
19	G	50	Low	57.9	Low	52 Å²	52	110.4 Å²	110.4	54%	0.536	66%	0.663	S	S	.	*	H	α-helix	trans	-75.7	-30.2	172.1	0	0	0	0	0	113.8	V15 T16 F17 A21	V15-G19 PolarHBondContact O-N 2.97Å; T16-G19 PolarHBondContact O-N 3.26Å; F17-G19 VanDerWaalsContact C-N 3.34Å; G19-A21 VanDerWaalsContact C-N 3.3Å; G19-A21 PolarHBondContact O-N 3.07Å
20	S	45.2	Very low	56.4	Low	91 Å²	91	113.5 Å²	113.5	64%	0.636	68%	0.679	S	S	*	*	H	α-helix	trans	-78.6	-10.7	-179.1	-156.2	0	0	0	0	113.9	T16 F17 R22	T16-S20 WeakPolarHBondContact O-CB 3.36Å; T16-S20 PolarHBondContact O-N 2.97Å; F17-S20 PolarHBondContact O-N 3.46Å; S20-R22 PolarHBondContact O-N 3.1Å
21	A	45.7	Very low	55.2	Low	79 Å²	79	115 Å²	115	65%	0.653	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.1	7.7	174.7	0	0	0	0	0	114.1	F17 G19	F17-A21 PolarHBondContact O-N 3.46Å; G19-A21 VanDerWaalsContact C-N 3.3Å; G19-A21 PolarHBondContact O-N 3.07Å
22	R	48.6	Very low	53.4	Low	241 Å²	241	118.5 Å²	118.5	91%	0.909	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.6	15.2	172.5	-83.8	-161.5	179.7	-155.8	1.6	114.8	S20	S20-R22 PolarHBondContact O-N 3.1Å
23	S	47.8	Very low	51.9	Low	116 Å²	116	122.5 Å²	122.5	81%	0.811	72%	0.721	S	S	*	*	S	Bend	trans	-135.2	89.1	172.8	-164.4	0	0	0	0	112
24	G	42.7	Very low	50.5	Low	68 Å²	68	122.7 Å²	122.7	70%	0.701	73%	0.732	S	S	*	*			trans	113.4	131.6	166.7	0	0	0	0	0	112.8
25	P	42.6	Very low	48.8	Very low	126 Å²	126	123.9 Å²	123.9	82%	0.818	75%	0.749	S	S	*	*			cis	-124.9	166.1	33.5	35.6	-18.6	0	0	0	113.7	E27	P25-E27 PolarHBondContact O-N 3.46Å
26	G	51.1	Low	47.4	Very low	78 Å²	78	129.6 Å²	129.6	80%	0.804	77%	0.766	S	S	*	*			trans	-46.3	124.2	-178	0	0	0	0	0	114	R28	G26-R28 PolarHBondContact O-N 2.69Å
27	E	42.2	Very low	46	Very low	198 Å²	198	128.4 Å²	128.4	93%	0.925	77%	0.773	S	S	*	*			trans	-58.2	124.8	159.4	-94.7	-165.6	113.5	0	0	108.5	P25 G29	P25-E27 PolarHBondContact O-N 3.46Å; E27-G29 VanDerWaalsContact C-N 3.35Å; E27-G29 PolarHBondContact O-N 3.32Å
28	R	50.4	Low	45.3	Very low	247 Å²	247	126.4 Å²	126.4	93%	0.932	78%	0.779	S	S	*	*			trans	-52.1	92.2	168.4	179.9	-175.3	-92.3	166.8	-10.8	109.5	G26	G26-R28 PolarHBondContact O-N 2.69Å
29	G	48.7	Very low	45.3	Very low	54 Å²	54	131.7 Å²	131.7	56%	0.557	79%	0.791	S	S	*	*			trans	-67.1	147	159.1	0	0	0	0	0	110	E27	E27-G29 VanDerWaalsContact C-N 3.35Å; E27-G29 PolarHBondContact O-N 3.32Å
30	P	46.8	Very low	44.8	Very low	106 Å²	106	136.2 Å²	136.2	69%	0.688	81%	0.808	S	S	*	*			trans	-64.6	148.8	-180	28.1	-32.5	0	0	0	110.5	E32	P30-E32 PolarHBondContact O-N 2.96Å
31	P	51.4	Low	44.3	Very low	132 Å²	132	135.7 Å²	135.7	86%	0.857	82%	0.817	S	S	*	*			trans	-72.3	99.6	178	29.5	-31.6	0	0	0	109.1
32	E	44.1	Very low	43.7	Very low	190 Å²	190	135.9 Å²	135.9	89%	0.888	83%	0.827	S	S	*	*			trans	-77.8	129.9	168.2	-62.8	-159.9	143.9	0	0	110	P30	P30-E32 PolarHBondContact O-N 2.96Å
33	K	43.2	Very low	43	Very low	189 Å²	189	128.1 Å²	128.1	82%	0.822	82%	0.822	S	S	*	*			trans	-90.5	139.3	-168.2	-167.1	-176.4	-177.3	-171	0	109.3
34	S	44.9	Very low	42.9	Very low	115 Å²	115	128.8 Å²	128.8	80%	0.804	82%	0.824	S	S	*	*			trans	60.3	121.8	151.1	62.5	0	0	0	0	120.4
35	G	35.1	Very low	43	Very low	81 Å²	81	131.3 Å²	131.3	84%	0.835	83%	0.829	S	S	*	*			trans	-170.4	105.6	158.3	0	0	0	0	0	112.5
36	F	42.5	Very low	43.2	Very low	226 Å²	226	131.2 Å²	131.2	99%	0.991	83%	0.828	S	S	*	*			trans	-73.3	149.5	-179.7	-123.1	-101.7	0	0	0	113.1
37	G	33.6	Very low	42.9	Very low	72 Å²	72	131.8 Å²	131.8	74%	0.742	83%	0.825	S	S	*	*			trans	117.9	148.4	154	0	0	0	0	0	114.9
38	S	41.3	Very low	43.2	Very low	118 Å²	118	128.8 Å²	128.8	83%	0.825	82%	0.823	S	S	*	*			cis	-169.6	143.1	-12.1	-179.1	0	0	0	0	105.8
39	Q	53.6	Low	42.3	Very low	187 Å²	187	121 Å²	121	87%	0.874	82%	0.82	S	S	*	*			trans	-76.9	136.4	179	-67.1	-171.1	-25.3	0	0	112.9
40	T	38.9	Very low	41.5	Very low	147 Å²	147	122 Å²	122	90%	0.902	83%	0.83	S	S	*	*			trans	-178.6	138.3	152.1	-3	0	0	0	0	107.8
41	G	34.5	Very low	41.3	Very low	79 Å²	79	125.3 Å²	125.3	81%	0.814	84%	0.841	S	S	*	*			cis	165.3	154.3	2.7	0	0	0	0	0	108.6
42	G	32.9	Very low	40.6	Very low	83 Å²	83	122.9 Å²	122.9	86%	0.856	84%	0.84	S	S	*	*			trans	100	116.8	152.5	0	0	0	0	0	120.1
43	G	34.9	Very low	40.5	Very low	79 Å²	79	121.8 Å²	121.8	81%	0.814	84%	0.84	S	S	*	*			trans	-76.1	-163.7	161.1	0	0	0	0	0	113.1
44	P	46.1	Very low	40.4	Very low	130 Å²	130	115.8 Å²	115.8	84%	0.844	83%	0.832	S	S	*	*			cis	-140.8	179.6	24.1	38.9	-16.8	0	0	0	117.9
45	C	44.6	Very low	39.9	Very low	121 Å²	121	117.6 Å²	117.6	82%	0.818	84%	0.839	S	S	*	*			trans	-49.2	161.9	166.1	-78.8	0	0	0	0	115.4
46	P	47.5	Very low	40.2	Very low	124 Å²	124	125.1 Å²	125.1	81%	0.805	84%	0.842	S	S	*	*				-153.7	169.1	54	43.2	-21.1	0	0	0	119.5
47	A	44	Very low	39.8	Very low	89 Å²	89	118.9 Å²	118.9	74%	0.736	83%	0.832	S	S	*	*			trans	-81.9	168.7	153.6	0	0	0	0	0	109.3
48	P	47.8	Very low	40	Very low	136 Å²	136	120.6 Å²	120.6	88%	0.883	83%	0.83	S	S	*	*			cis	-148.6	172.1	28.4	39.4	-16.4	0	0	0	117.1
49	G	32.7	Very low	40.5	Very low	84 Å²	84	122.2 Å²	122.2	87%	0.866	84%	0.835	S	S	*	*			trans	150.9	137	164.8	0	0	0	0	0	112.1
50	G	31.5	Very low	40	Very low	75 Å²	75	119.2 Å²	119.2	77%	0.773	83%	0.829	S	S	*	*			cis	-172.1	145.9	-0.4	0	0	0	0	0	109.3
51	L	42.3	Very low	40	Very low	175 Å²	175	115.6 Å²	115.6	92%	0.916	82%	0.821	S	S	*	*			trans	23.7	116.3	149.1	-149.8	70.1	0	0	0	119.9
52	G	37.4	Very low	39.9	Very low	81 Å²	81	115.8 Å²	115.8	84%	0.835	82%	0.823	S	S	*	*			trans	-153.4	80.8	163.8	0	0	0	0	0	110
53	D	42.3	Very low	40.2	Very low	166 Å²	166	115.4 Å²	115.4	89%	0.888	81%	0.807	S	S	*	*			trans	-70.9	143.2	177	-142.5	-6.9	0	0	0	110.4
54	G	39.7	Very low	40.8	Very low	64 Å²	64	117 Å²	117	66%	0.66	80%	0.803	S	S	*	*			trans	153.1	87.5	165.9	0	0	0	0	0	118
55	T	35.7	Very low	40.6	Very low	152 Å²	152	118 Å²	118	93%	0.933	80%	0.797	S	S	*	*			trans	108.8	122.6	151.4	-45.9	0	0	0	0	116.3
56	R	40.7	Very low	40.8	Very low	240 Å²	240	119.6 Å²	119.6	91%	0.906	80%	0.797	S	S	*	*			trans	-93.1	141.8	-170.5	-160.4	177.6	-172.9	165.5	1.8	110.9
57	A	33.7	Very low	40.7	Very low	95 Å²	95	119.3 Å²	119.3	79%	0.785	79%	0.788	S	S	*	*			trans	97.6	144.9	156.2	0	0	0	0	0	118.6
58	P	38	Very low	40.5	Very low	108 Å²	108	121.7 Å²	121.7	70%	0.701	80%	0.796	S	S	*	*			cis	-110.5	149.2	-6.5	36	-23.3	0	0	0	113.4	T60	P58-T60 PolarHBondContact O-N 3Å
59	V	51.3	Low	40.3	Very low	152 Å²	152	118.6 Å²	118.6	92%	0.921	79%	0.789	S	S	*	*			trans	-71.9	104.2	160.4	176.4	0	0	0	0	107.1
60	T	42.6	Very low	40.7	Very low	124 Å²	124	122.1 Å²	122.1	76%	0.761	78%	0.78	S	S	*	*			trans	-138	104.6	158.6	-9.1	0	0	0	0	108.3	P58	P58-T60 PolarHBondContact O-N 3Å
61	G	40.6	Very low	41.1	Very low	70 Å²	70	124.3 Å²	124.3	72%	0.722	78%	0.779	S	S	*	*			trans	61.4	108.9	150.1	0	0	0	0	0	116.9	S63	G61-S63 PolarHBondContact O-N 2.98Å
62	G	31.7	Very low	41	Very low	84 Å²	84	121.8 Å²	121.8	87%	0.866	77%	0.77	S	S	*	*			trans	-41.6	128.4	176.7	0	0	0	0	0	114.1
63	S	38.6	Very low	41.4	Very low	75 Å²	75	123.8 Å²	123.8	52%	0.524	76%	0.76	S	S	.	*			trans	-60.4	133.6	165.3	175.9	0	0	0	0	109.6	G61 E65	G61-S63 PolarHBondContact O-N 2.98Å; S63-E65 WeakPolarHBondContact CB-OE1 3.49Å; S63-E65 PolarHBondContact O-N 3.47Å; S63-E65 PolarHBondContact OG-OE1 2.98Å
64	P	47.5	Very low	41.6	Very low	112 Å²	112	123 Å²	123	73%	0.727	76%	0.755	S	S	*	*			trans	-84.7	62.3	176.7	36.9	-31.9	0	0	0	108.8	D66	P64-D66 PolarHBondContact O-N 3.43Å; P64-D66 VanDerWaalsContact O-N 3.08Å
65	E	42.1	Very low	41.9	Very low	152 Å²	152	126.6 Å²	126.6	71%	0.71	76%	0.758	S	S	*	*			trans	-82.6	72.3	162.6	37.3	-133.3	139.1	0	0	109	S63	S63-E65 WeakPolarHBondContact CB-OE1 3.49Å; S63-E65 PolarHBondContact O-N 3.47Å; S63-E65 PolarHBondContact OG-OE1 2.98Å
66	D	48.4	Very low	41.9	Very low	154 Å²	154	127.5 Å²	127.5	82%	0.824	75%	0.749	S	S	*	*	S	Bend	trans	172.5	82.3	144.8	-95.1	-41.5	0	0	0	108.2	P64	P64-D66 PolarHBondContact O-N 3.43Å; P64-D66 VanDerWaalsContact O-N 3.08Å
67	L	45.1	Very low	42.1	Very low	117 Å²	117	120.6 Å²	120.6	61%	0.613	74%	0.737	S	S	*	*			trans	177.3	117.7	149.3	-93.9	163.6	0	0	0	107.5	G69	L67-G69 PolarHBondContact O-N 3.49Å
68	P	41.8	Very low	42.3	Very low	139 Å²	139	124.7 Å²	124.7	90%	0.903	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.1	105	173.7	27.4	-31	0	0	0	109
69	G	42.1	Very low	42.4	Very low	71 Å²	71	127.4 Å²	127.4	73%	0.732	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	102.6	55.3	165.5	0	0	0	0	0	116.6	L67	L67-G69 PolarHBondContact O-N 3.49Å
70	K	42.5	Very low	41.5	Very low	159 Å²	159	128.7 Å²	128.7	69%	0.691	74%	0.739	S	S	*	*			trans	-95.7	94.6	154.8	-94	178.6	178.8	172	0	109.8	V72	K70-V72 PolarHBondContact O-N 3.44Å
71	V	39.3	Very low	41.1	Very low	121 Å²	121	128.6 Å²	128.6	73%	0.733	73%	0.734	S	S	*	*			trans	-80.2	101.4	165.7	-173.9	0	0	0	0	107.4	I73	V71-I73 HydrophobicContact CG1-CD1 4.08Å; V71-I73 HydrophobicContact CG1-CG1 3.5Å; V71-I73 PolarHBondContact O-N 3.18Å
72	V	39.1	Very low	41.4	Very low	122 Å²	122	131.2 Å²	131.2	74%	0.739	74%	0.738	S	S	*	*			trans	-82.9	98.4	169.2	178.7	0	0	0	0	107.5	K70 I74	K70-V72 PolarHBondContact O-N 3.44Å; V72-I74 HydrophobicContact CG1-CG1 4.26Å; V72-I74 PolarHBondContact O-N 2.92Å
73	I	46.2	Very low	41.9	Very low	123 Å²	123	131 Å²	131	63%	0.631	73%	0.728	S	S	*	*			trans	-89.5	102	173.8	-50.2	179	0	0	0	107.5	V71 L75	V71-I73 HydrophobicContact CG1-CD1 4.08Å; V71-I73 HydrophobicContact CG1-CG1 3.5Å; V71-I73 PolarHBondContact O-N 3.18Å; I73-L75 VanDerWaalsContact C-N 3.32Å; I73-L75 HydrophobicContact CG2-CD1 4.32Å; I73-L75 HydrophobicContact CG2-CG 3.94Å; I73-L75 PolarHBondContact O-N 2.96Å
74	I	47.8	Very low	42.2	Very low	149 Å²	149	135.5 Å²	135.5	76%	0.764	75%	0.746	S	S	*	*			trans	-76.3	91.9	165.2	-56.6	177.3	0	0	0	106.6	V72 K76	V72-I74 HydrophobicContact CG1-CG1 4.26Å; V72-I74 PolarHBondContact O-N 2.92Å; I74-K76 PolarHBondContact O-N 2.81Å
75	L	45.6	Very low	42.2	Very low	140 Å²	140	134 Å²	134	73%	0.733	75%	0.751	S	S	*	*			trans	-69.3	95.1	169.8	-87	146	0	0	0	108.5	I73 S77	I73-L75 VanDerWaalsContact C-N 3.32Å; I73-L75 HydrophobicContact CG2-CD1 4.32Å; I73-L75 HydrophobicContact CG2-CG 3.94Å; I73-L75 PolarHBondContact O-N 2.96Å; L75-S77 VanDerWaalsContact C-N 3.25Å; L75-S77 PolarHBondContact O-N 3.35Å; L75-S77 VanDerWaalsContact O-N 3.07Å
76	K	34.9	Very low	42	Very low	171 Å²	171	130 Å²	130	74%	0.743	74%	0.744	S	S	*	*			trans	-77.1	86	161.7	-164.2	176.3	-177.1	-179.9	0	107.6	I74 F78	I74-K76 PolarHBondContact O-N 2.81Å; K76-F78 PolarHBondContact O-N 3.31Å; K76-F78 VanDerWaalsContact O-N 3.1Å
77	S	44.4	Very low	42	Very low	94 Å²	94	129.3 Å²	129.3	66%	0.657	75%	0.745	S	S	*	*			trans	-62.3	105	168.8	-45.9	0	0	0	0	108.1	L75 E79	L75-S77 VanDerWaalsContact C-N 3.25Å; L75-S77 PolarHBondContact O-N 3.35Å; L75-S77 VanDerWaalsContact O-N 3.07Å; S77-E79 PolarHBondContact O-N 3.08Å; S77-E79 VanDerWaalsContact O-N 3.13Å
78	F	38.1	Very low	41.7	Very low	181 Å²	181	133.6 Å²	133.6	79%	0.794	76%	0.755	S	S	*	*			trans	-76.9	90.5	154.8	-102.4	-85.3	0	0	0	106.1	K76 M80	K76-F78 PolarHBondContact O-N 3.31Å; K76-F78 VanDerWaalsContact O-N 3.1Å; F78-M80 PolarHBondContact O-N 3.09Å
79	E	39.9	Very low	41.7	Very low	165 Å²	165	137 Å²	137	77%	0.771	75%	0.75	S	S	*	*			trans	-67.3	112	163.8	-171.4	166.2	-162.2	0	0	107.1	S77	S77-E79 PolarHBondContact O-N 3.08Å; S77-E79 VanDerWaalsContact O-N 3.13Å
80	M	33.6	Very low	41.8	Very low	180 Å²	180	142.4 Å²	142.4	89%	0.887	75%	0.753	S	S	*	*			trans	-110.6	95.7	157.9	-162.8	77.5	159.3	0	0	105.7	F78	F78-M80 PolarHBondContact O-N 3.09Å
81	D	34.1	Very low	41.7	Very low	122 Å²	122	142.9 Å²	142.9	65%	0.652	76%	0.758	S	S	*	*			trans	-57.8	125.5	167	-161.2	-9.8	0	0	0	108.6	A83	D81-A83 VanDerWaalsContact C-N 3.3Å; D81-A83 PolarHBondContact O-N 3.31Å; D81-A83 VanDerWaalsContact O-N 3.09Å
82	P	46.1	Very low	42.3	Very low	125 Å²	125	144 Å²	144	81%	0.812	76%	0.76	S	S	*	*	S	Bend	trans	-88.2	69	-176.2	35.9	-33	0	0	0	110.1
83	A	43.8	Very low	42.5	Very low	79 Å²	79	141.7 Å²	141.7	65%	0.653	76%	0.761	S	S	*	*			trans	-161.6	80.5	170.1	0	0	0	0	0	111.5	D81	D81-A83 VanDerWaalsContact C-N 3.3Å; D81-A83 PolarHBondContact O-N 3.31Å; D81-A83 VanDerWaalsContact O-N 3.09Å
84	D	43.2	Very low	42.6	Very low	169 Å²	169	144.4 Å²	144.4	90%	0.904	77%	0.771	S	S	*	*				175.3	144.1	113	-124.2	-28.1	0	0	0	110.7	A86	D84-A86 PolarHBondContact O-N 3.49Å
85	G	48.5	Very low	42.1	Very low	81 Å²	81	143.9 Å²	143.9	84%	0.835	78%	0.775	S	S	*	*			trans	-69.3	83.8	-169.3	0	0	0	0	0	115
86	A	37.9	Very low	42	Very low	68 Å²	68	142.7 Å²	142.7	56%	0.562	77%	0.773	S	S	*	*			trans	-104.7	101.2	165.5	0	0	0	0	0	110.9	D84 Y88	D84-A86 PolarHBondContact O-N 3.49Å; A86-Y88 HydrophobicContact CB-CD2 4.06Å; A86-Y88 HydrophobicContact CB-CE2 3.62Å; A86-Y88 PolarHBondContact O-N 3.07Å; A86-Y88 VanDerWaalsContact O-N 3.14Å
87	V	48.6	Very low	42.1	Very low	139 Å²	139	143.9 Å²	143.9	84%	0.842	78%	0.778	S	S	*	*			trans	-59.5	108.7	169.7	175.9	0	0	0	0	108.7
88	Y	37.4	Very low	41.9	Very low	208 Å²	208	145.3 Å²	145.3	82%	0.816	78%	0.783	S	S	*	*			trans	-115.4	116.3	162.3	-71.8	-77.6	0	0	0	110.2	A86	A86-Y88 HydrophobicContact CB-CD2 4.06Å; A86-Y88 HydrophobicContact CB-CE2 3.62Å; A86-Y88 PolarHBondContact O-N 3.07Å; A86-Y88 VanDerWaalsContact O-N 3.14Å
89	R	42.3	Very low	42	Very low	209 Å²	209	138.3 Å²	138.3	79%	0.789	76%	0.763	S	S	*	*			trans	-44	124.5	-178.7	-178	-178.8	165	98.3	2.7	111.6	E91	R89-E91 PolarHBondContact O-N 3.02Å
90	K	44.8	Very low	42.1	Very low	185 Å²	185	140.8 Å²	140.8	80%	0.804	77%	0.765	S	S	*	*			trans	-70	108.1	168.5	-151.4	-176.2	-173.5	-170.9	0	106.8
91	E	40.7	Very low	42.7	Very low	169 Å²	169	139.7 Å²	139.7	79%	0.79	76%	0.762	S	S	*	*			trans	-78.2	123.5	163.5	-84.8	-175.1	144.2	0	0	108	R89	R89-E91 PolarHBondContact O-N 3.02Å
92	D	52.3	Low	42.9	Very low	146 Å²	146	138.4 Å²	138.4	78%	0.781	76%	0.755	S	S	*	*			trans	-73.4	132.4	-171.7	-48.9	-58.4	0	0	0	110.1
93	G	43.1	Very low	42.9	Very low	73 Å²	73	142 Å²	142	75%	0.753	76%	0.758	S	S	*	*			trans	178.4	53.8	-176.7	0	0	0	0	0	112.1	T95	G93-T95 PolarHBondContact O-N 3.07Å
94	E	47.1	Very low	43	Very low	180 Å²	180	143.8 Å²	143.8	84%	0.841	76%	0.756	S	S	*	*			trans	-20.6	114	169.8	-56.6	168	179.2	0	0	115.6
95	T	37.8	Very low	43.2	Very low	138 Å²	138	142 Å²	142	85%	0.847	74%	0.742	S	S	*	*				-141.9	101.9	114	43.7	0	0	0	0	108.5	G93 F97	G93-T95 PolarHBondContact O-N 3.07Å; T95-F97 PolarHBondContact O-N 3.01Å
96	T	44.5	Very low	43	Very low	114 Å²	114	146.7 Å²	146.7	70%	0.699	74%	0.74	S	S	*	*			trans	-46.6	99.3	163.5	13.9	0	0	0	0	110.3	T98	T96-T98 HydrophobicContact CG2-CG2 3.95Å; T96-T98 PolarHBondContact O-N 3.13Å; T96-T98 VanDerWaalsContact O-N 3.14Å
97	F	35.5	Very low	43.4	Very low	196 Å²	196	146.4 Å²	146.4	86%	0.86	73%	0.732	S	S	*	*			trans	-81.6	76.9	148.5	-158.3	-99.9	0	0	0	107.3	T95 G99	T95-F97 PolarHBondContact O-N 3.01Å; F97-G99 PolarHBondContact O-N 2.9Å
98	T	41.4	Very low	43.1	Very low	124 Å²	124	145.9 Å²	145.9	76%	0.761	72%	0.719	S	S	*	*			trans	-65.9	62.2	161.8	27.7	0	0	0	0	109.2	T96 R100	T96-T98 HydrophobicContact CG2-CG2 3.95Å; T96-T98 PolarHBondContact O-N 3.13Å; T96-T98 VanDerWaalsContact O-N 3.14Å; T98-R100 PolarHBondContact O-N 3.35Å
99	G	38.8	Very low	43.7	Very low	35 Å²	35	143.5 Å²	143.5	36%	0.361	71%	0.713	S	S	.	*			trans	-89.7	95.9	163.4	0	0	0	0	0	107.1	F97 L101	F97-G99 PolarHBondContact O-N 2.9Å; G99-L101 PolarHBondContact O-N 3.39Å
100	R	43	Very low	44.2	Very low	217 Å²	217	136.2 Å²	136.2	82%	0.819	69%	0.694	S	S	*	*			trans	-51.8	96.7	163.4	-176.7	-178.7	172	130.5	-2.9	106.6	T98 D102	T98-R100 PolarHBondContact O-N 3.35Å; R100-D102 IonicContact NE-OD1 3.18Å; R100-D102 PolarHBondContact NE-OD1 3.48Å; R100-D102 PolarHBondContact O-N 3.38Å
101	L	45.1	Very low	44.5	Very low	157 Å²	157	132.6 Å²	132.6	82%	0.822	68%	0.678	S	S	*	*			trans	-69.6	83.9	173.3	-88.3	167.3	0	0	0	106	G99 K103	G99-L101 PolarHBondContact O-N 3.39Å; L101-K103 PolarHBondContact O-N 2.97Å; L101-K103 VanDerWaalsContact O-N 3.1Å
102	D	40.3	Very low	45.2	Very low	95 Å²	95	128.3 Å²	128.3	51%	0.508	67%	0.665	S	S	.	*			trans	-53.9	121.5	172.5	-76	-45	0	0	0	107	R100 L104 H105	R100-D102 IonicContact NE-OD1 3.18Å; R100-D102 PolarHBondContact NE-OD1 3.48Å; R100-D102 PolarHBondContact O-N 3.38Å; D102-L104 PolarHBondContact O-N 3.49Å; D102-H105 PolarHBondContact O-N 3.43Å
103	K	44.7	Very low	45.5	Very low	199 Å²	199	125.3 Å²	125.3	87%	0.865	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-46.3	3.3	-177	-96	162.7	167.6	171.1	0	116.6	L101 P107	L101-K103 PolarHBondContact O-N 2.97Å; L101-K103 VanDerWaalsContact O-N 3.1Å; K103-P107 WeakPolarHBondContact O-CD 3.44Å
104	L	46.8	Very low	46.1	Very low	117 Å²	117	127.9 Å²	127.9	61%	0.613	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92	-24.9	-177.4	-79.8	144.1	0	0	0	113.2	D102 P107 F108	D102-L104 PolarHBondContact O-N 3.49Å; L104-P107 WeakPolarHBondContact O-CD 3.41Å; L104-P107 VanDerWaalsContact O-CG 3.23Å; L104-P107 WeakPolarHBondContact O-CG 3.47Å; L104-F108 HydrophobicContact CD2-CE2 4.2Å; L104-F108 WeakPolarHBondContact O-CD2 3.28Å
105	H	46.9	Very low	46.7	Very low	131 Å²	131	123.7 Å²	123.7	61%	0.606	63%	0.625	S	S	*	*	H	α-helix	trans	-79.4	-24.6	-176.1	-139.9	-135.9	0	0	0	114.2	D102	D102-H105 PolarHBondContact O-N 3.43Å
106	F	43.4	Very low	47.5	Very low	181 Å²	181	125 Å²	125	79%	0.794	62%	0.616	S	S	*	*	H	α-helix	trans	-68.3	-39.7	177	-150	-97.9	0	0	0	114.6	S110	F106-S110 PolarHBondContact O-N 3.24Å; F106-S110 PolarHBondContact O-OG 3.44Å
107	P	46.8	Very low	48	Very low	61 Å²	61	125.5 Å²	125.5	40%	0.396	61%	0.612	S	S	.	*	H	α-helix	trans	-72.4	-31.5	174.9	24.9	-34.2	0	0	0	113.7	K103 L104 F109 S110 F111	K103-P107 WeakPolarHBondContact O-CD 3.44Å; L104-P107 WeakPolarHBondContact O-CD 3.41Å; L104-P107 VanDerWaalsContact O-CG 3.23Å; L104-P107 WeakPolarHBondContact O-CG 3.47Å; P107-F109 PolarHBondContact O-N 3.37Å; P107-S110 WeakPolarHBondContact CA-OG 3.32Å; P107-S110 PolarHBondContact O-N 3.32Å; P107-S110 PolarHBondContact O-OG 2.9Å; P107-F111 WeakPolarHBondContact O-CB 3.14Å; P107-F111 PolarHBondContact O-N 3.33Å
108	F	43.6	Very low	48.8	Very low	129 Å²	129	124.2 Å²	124.2	57%	0.566	60%	0.601	S	S	*	*	H	α-helix	trans	-72.5	-29.2	-177.1	-74.9	-66.8	0	0	0	113.7	L104 P112	L104-F108 HydrophobicContact CD2-CE2 4.2Å; L104-F108 WeakPolarHBondContact O-CD2 3.28Å; F108-P112 WeakPolarHBondContact O-CD 3.33Å; F108-P112 WeakPolarHBondContact O-CG 3.44Å
109	F	49.3	Very low	49.1	Very low	158 Å²	158	124.6 Å²	124.6	69%	0.693	59%	0.593	S	S	*	*	H	α-helix	trans	-82.1	-30.6	174.5	-122.1	-90.6	0	0	0	112.4	P107 V113	P107-F109 PolarHBondContact O-N 3.37Å; F109-V113 WeakPolarHBondContact O-CG2 3.3Å
110	S	53.2	Low	49.8	Very low	56 Å²	56	125.3 Å²	125.3	39%	0.392	59%	0.59	S	S	.	*	H	α-helix	trans	-80.2	-31.8	179.7	53.8	0	0	0	0	113.4	F106 P107 V113 F114	F106-S110 PolarHBondContact O-N 3.24Å; F106-S110 PolarHBondContact O-OG 3.44Å; P107-S110 WeakPolarHBondContact CA-OG 3.32Å; P107-S110 PolarHBondContact O-N 3.32Å; P107-S110 PolarHBondContact O-OG 2.9Å; S110-V113 PolarHBondContact O-N 3.35Å; S110-F114 WeakPolarHBondContact O-CB 3.37Å; S110-F114 PolarHBondContact O-N 2.95Å
111	F	51	Low	50	Low	108 Å²	108	119.5 Å²	119.5	47%	0.474	58%	0.575	S	S	.	*	H	α-helix	trans	-65.9	-44.5	-175.4	-150.2	-98.1	0	0	0	114.4	P107 F114 L115	P107-F111 WeakPolarHBondContact O-CB 3.14Å; P107-F111 PolarHBondContact O-N 3.33Å; F111-F114 PolarHBondContact O-N 2.87Å; F111-L115 HydrophobicContact CD1-CD1 3.66Å; F111-L115 HydrophobicContact CD1-CG 4.27Å; F111-L115 HydrophobicContact CE1-CD1 3.63Å; F111-L115 HydrophobicContact CE1-CG 4.24Å; F111-L115 WeakPolarHBondContact O-CB 3.28Å; F111-L115 WeakPolarHBondContact O-CG 3.45Å; F111-L115 PolarHBondContact O-N 3.44Å
112	P	54.6	Low	50.1	Low	79 Å²	79	115.7 Å²	115.7	51%	0.513	56%	0.558	S	S	.	*	H	α-helix	trans	-65.9	-40.3	175.9	-17.8	30.9	0	0	0	111.7	F108 Y116	F108-P112 WeakPolarHBondContact O-CD 3.33Å; F108-P112 WeakPolarHBondContact O-CG 3.44Å; P112-Y116 VanDerWaalsContact O-CB 3.28Å; P112-Y116 WeakPolarHBondContact O-CB 3.36Å; P112-Y116 PolarHBondContact O-N 2.9Å
113	V	59.2	Low	50.4	Low	83 Å²	83	116.1 Å²	116.1	50%	0.503	56%	0.557	S	S	.	*	H	α-helix	trans	-67.8	-39.3	178.4	177.8	0	0	0	0	111.2	F109 S110 Y116 M117	F109-V113 WeakPolarHBondContact O-CG2 3.3Å; S110-V113 PolarHBondContact O-N 3.35Å; V113-Y116 PolarHBondContact O-N 2.91Å; V113-M117 WeakPolarHBondContact O-CB 3.27Å; V113-M117 WeakPolarHBondContact O-CG 3.48Å; V113-M117 PolarHBondContact O-N 3.16Å
114	F	56.3	Low	50.4	Low	128 Å²	128	114.1 Å²	114.1	56%	0.561	55%	0.549	S	S	*	.	H	α-helix	trans	-68.5	-42	177.2	-173.4	-96.2	0	0	0	112.2	S110 F111 R118	S110-F114 WeakPolarHBondContact O-CB 3.37Å; S110-F114 PolarHBondContact O-N 2.95Å; F111-F114 PolarHBondContact O-N 2.87Å; F114-R118 VanDerWaalsContact O-CB 3.31Å; F114-R118 WeakPolarHBondContact O-CB 3.4Å; F114-R118 PolarHBondContact O-N 2.91Å
115	L	57.8	Low	50.3	Low	92 Å²	92	114.2 Å²	114.2	48%	0.482	55%	0.549	S	S	.	.	H	α-helix	trans	-63.6	-42.7	173.2	-77.9	171.6	0	0	0	111.6	F111 R118 F119	F111-L115 HydrophobicContact CD1-CD1 3.66Å; F111-L115 HydrophobicContact CD1-CG 4.27Å; F111-L115 HydrophobicContact CE1-CD1 3.63Å; F111-L115 HydrophobicContact CE1-CG 4.24Å; F111-L115 WeakPolarHBondContact O-CB 3.28Å; F111-L115 WeakPolarHBondContact O-CG 3.45Å; F111-L115 PolarHBondContact O-N 3.44Å; L115-R118 PolarHBondContact O-N 3.45Å; L115-F119 VanDerWaalsContact O-CB 3.3Å; L115-F119 WeakPolarHBondContact O-CB 3.31Å; L115-F119 PolarHBondContact O-N 2.94Å
116	Y	55.9	Low	50.1	Low	166 Å²	166	116.6 Å²	116.6	65%	0.651	55%	0.553	S	S	*	*	H	α-helix	trans	-62.2	-48.6	176.7	-173.4	-98.2	0	0	0	111.6	P112 V113 R118 F119 V120	P112-Y116 VanDerWaalsContact O-CB 3.28Å; P112-Y116 WeakPolarHBondContact O-CB 3.36Å; P112-Y116 PolarHBondContact O-N 2.9Å; V113-Y116 PolarHBondContact O-N 2.91Å; Y116-R118 VanDerWaalsContact C-N 3.34Å; Y116-R118 PolarHBondContact O-N 3.33Å; Y116-F119 PolarHBondContact O-N 3.35Å; Y116-V120 HydrophobicContact CD1-CG2 4.12Å; Y116-V120 HydrophobicContact CD2-CG2 4.38Å; Y116-V120 HydrophobicContact CE1-CG2 3.81Å; Y116-V120 HydrophobicContact CE2-CG2 4.08Å; Y116-V120 HydrophobicContact CG-CG2 4.4Å; Y116-V120 WeakPolarHBondContact O-CB 3.48Å; Y116-V120 VanDerWaalsContact O-CG2 3.26Å; Y116-V120 WeakPolarHBondContact O-CG2 3.32Å; Y116-V120 PolarHBondContact O-N 3.26Å
117	M	55.7	Low	50.2	Low	124 Å²	124	110.8 Å²	110.8	61%	0.611	54%	0.538	S	S	*	.	H	α-helix	trans	-59.1	-43.7	175.3	-83.2	-67.4	-174.9	0	0	111.9	V113 N121	V113-M117 WeakPolarHBondContact O-CB 3.27Å; V113-M117 WeakPolarHBondContact O-CG 3.48Å; V113-M117 PolarHBondContact O-N 3.16Å; M117-N121 WeakPolarHBondContact O-CB 3.45Å; M117-N121 PolarHBondContact O-N 3.27Å
118	R	51.4	Low	50.2	Low	169 Å²	169	110.6 Å²	110.6	64%	0.638	55%	0.548	S	S	*	.	H	α-helix	trans	-68.4	-38.4	-179.1	-165.2	176.3	176.6	158.2	0.7	112.3	F114 L115 Y116 T122	F114-R118 VanDerWaalsContact O-CB 3.31Å; F114-R118 WeakPolarHBondContact O-CB 3.4Å; F114-R118 PolarHBondContact O-N 2.91Å; L115-R118 PolarHBondContact O-N 3.45Å; Y116-R118 VanDerWaalsContact C-N 3.34Å; Y116-R118 PolarHBondContact O-N 3.33Å; R118-T122 PolarHBondContact O-N 3.31Å; R118-T122 PolarHBondContact O-OG1 3.08Å
119	F	48.4	Very low	50.2	Low	132 Å²	132	112.4 Å²	112.4	58%	0.579	56%	0.56	S	S	*	*	H	α-helix	trans	-70.9	-45.6	178.6	-162.7	-98.1	0	0	0	111.8	L115 Y116 N121 T122 H123	L115-F119 VanDerWaalsContact O-CB 3.3Å; L115-F119 WeakPolarHBondContact O-CB 3.31Å; L115-F119 PolarHBondContact O-N 2.94Å; Y116-F119 PolarHBondContact O-N 3.35Å; F119-N121 VanDerWaalsContact C-N 3.33Å; F119-N121 PolarHBondContact O-N 3.2Å; F119-T122 WeakPolarHBondContact CA-OG1 3.44Å; F119-T122 PolarHBondContact O-N 2.62Å; F119-T122 PolarHBondContact O-OG1 3Å; F119-H123 AromaticContact CD1-CD2 3.68Å; F119-H123 AromaticContact CD1-NE2 4Å; F119-H123 AromaticContact CE1-CD2 3.45Å; F119-H123 VanDerWaalsContact CE1-CD2 3.45Å; F119-H123 WeakPolarHBondContact CE1-CD2 3.08Å; F119-H123 AromaticContact CE1-NE2 3.27Å; F119-H123 VanDerWaalsContact CE1-NE2 3.27Å; F119-H123 WeakPolarHBondContact CE1-NE2 3.39Å; F119-H123 AromaticContact CZ-CD2 3.88Å; F119-H123 AromaticContact CZ-NE2 3.32Å; F119-H123 VanDerWaalsContact CZ-NE2 3.32Å; F119-H123 WeakPolarHBondContact CZ-NE2 3.26Å; F119-H123 PolarHBondContact O-CD2 2.89Å; F119-H123 VanDerWaalsContact O-CD2 3.31Å; F119-H123 PolarHBondContact O-N 3.4Å; F119-H123 VanDerWaalsContact O-N 3.08Å
120	V	52.2	Low	50.1	Low	50 Å²	50	112.1 Å²	112.1	30%	0.303	56%	0.56	S	S	.	*	H	α-helix	trans	-63	-41.3	175.3	174.4	0	0	0	0	110.9	Y116 H123 F124	Y116-V120 HydrophobicContact CD1-CG2 4.12Å; Y116-V120 HydrophobicContact CD2-CG2 4.38Å; Y116-V120 HydrophobicContact CE1-CG2 3.81Å; Y116-V120 HydrophobicContact CE2-CG2 4.08Å; Y116-V120 HydrophobicContact CG-CG2 4.4Å; Y116-V120 WeakPolarHBondContact O-CB 3.48Å; Y116-V120 VanDerWaalsContact O-CG2 3.26Å; Y116-V120 WeakPolarHBondContact O-CG2 3.32Å; Y116-V120 PolarHBondContact O-N 3.26Å; V120-H123 PolarHBondContact O-N 3.41Å; V120-F124 HydrophobicContact CG1-CD2 4.06Å; V120-F124 HydrophobicContact CG1-CE2 4.33Å; V120-F124 PolarHBondContact O-N 2.98Å
121	N	47	Very low	49.9	Very low	94 Å²	94	116.5 Å²	116.5	50%	0.503	58%	0.58	S	S	.	*	H	α-helix	trans	-69.7	-34	179.3	-156.2	-31.4	0	0	0	112.2	M117 F119 F124 L125	M117-N121 WeakPolarHBondContact O-CB 3.45Å; M117-N121 PolarHBondContact O-N 3.27Å; F119-N121 VanDerWaalsContact C-N 3.33Å; F119-N121 PolarHBondContact O-N 3.2Å; N121-F124 PolarHBondContact O-N 3.31Å; N121-L125 WeakPolarHBondContact O-CB 3.39Å; N121-L125 VanDerWaalsContact O-CG 3.27Å; N121-L125 WeakPolarHBondContact O-CG 3.27Å; N121-L125 PolarHBondContact O-N 3.03Å; N121-L125 WeakPolarHBondContact OD1-CD1 3.47Å
122	T	47.1	Very low	49.9	Very low	78 Å²	78	116 Å²	116	48%	0.479	59%	0.589	S	S	.	*	H	α-helix	trans	-69	-34.1	172.7	21.4	0	0	0	0	113.1	R118 F119 R126	R118-T122 PolarHBondContact O-N 3.31Å; R118-T122 PolarHBondContact O-OG1 3.08Å; F119-T122 WeakPolarHBondContact CA-OG1 3.44Å; F119-T122 PolarHBondContact O-N 2.62Å; F119-T122 PolarHBondContact O-OG1 3Å; T122-R126 WeakPolarHBondContact O-CB 3.37Å; T122-R126 PolarHBondContact O-N 2.9Å
123	H	46.9	Very low	49.6	Very low	104 Å²	104	121.3 Å²	121.3	48%	0.481	61%	0.607	S	S	.	*	H	α-helix	trans	-70.3	-35.9	173.6	-85.2	-79.7	0	0	0	112.8	F119 V120 A127	F119-H123 AromaticContact CD1-CD2 3.68Å; F119-H123 AromaticContact CD1-NE2 4Å; F119-H123 AromaticContact CE1-CD2 3.45Å; F119-H123 VanDerWaalsContact CE1-CD2 3.45Å; F119-H123 WeakPolarHBondContact CE1-CD2 3.08Å; F119-H123 AromaticContact CE1-NE2 3.27Å; F119-H123 VanDerWaalsContact CE1-NE2 3.27Å; F119-H123 WeakPolarHBondContact CE1-NE2 3.39Å; F119-H123 AromaticContact CZ-CD2 3.88Å; F119-H123 AromaticContact CZ-NE2 3.32Å; F119-H123 VanDerWaalsContact CZ-NE2 3.32Å; F119-H123 WeakPolarHBondContact CZ-NE2 3.26Å; F119-H123 PolarHBondContact O-CD2 2.89Å; F119-H123 VanDerWaalsContact O-CD2 3.31Å; F119-H123 PolarHBondContact O-N 3.4Å; F119-H123 VanDerWaalsContact O-N 3.08Å; V120-H123 PolarHBondContact O-N 3.41Å; H123-A127 PolarHBondContact O-N 3Å
124	F	45.4	Very low	48.8	Very low	157 Å²	157	127.8 Å²	127.8	69%	0.689	65%	0.646	S	S	*	*	H	α-helix	trans	-70.8	-37.7	173.5	-97	-90.9	0	0	0	113.1	V120 N121 R126 G128	V120-F124 HydrophobicContact CG1-CD2 4.06Å; V120-F124 HydrophobicContact CG1-CE2 4.33Å; V120-F124 PolarHBondContact O-N 2.98Å; N121-F124 PolarHBondContact O-N 3.31Å; F124-R126 VanDerWaalsContact C-N 3.35Å; F124-G128 PolarHBondContact O-N 3.25Å
125	L	45	Very low	48.4	Very low	119 Å²	119	127.8 Å²	127.8	62%	0.623	65%	0.65	S	S	*	*	H	α-helix	trans	-70.7	-29.5	175.4	-73.2	168.6	0	0	0	112.7	N121	N121-L125 WeakPolarHBondContact O-CB 3.39Å; N121-L125 VanDerWaalsContact O-CG 3.27Å; N121-L125 WeakPolarHBondContact O-CG 3.27Å; N121-L125 PolarHBondContact O-N 3.03Å; N121-L125 WeakPolarHBondContact OD1-CD1 3.47Å
126	R	42.3	Very low	47.9	Very low	181 Å²	181	129.6 Å²	129.6	68%	0.683	66%	0.659	S	S	*	*	H	α-helix	trans	-72.7	-38.4	175.2	-165.5	174.6	-156.1	-178.9	5.6	112.4	T122 F124 G128 M129	T122-R126 WeakPolarHBondContact O-CB 3.37Å; T122-R126 PolarHBondContact O-N 2.9Å; F124-R126 VanDerWaalsContact C-N 3.35Å; R126-G128 VanDerWaalsContact C-N 3.27Å; R126-G128 PolarHBondContact O-N 3.49Å; R126-M129 PolarHBondContact O-N 3.44Å
127	A	44.9	Very low	47.4	Very low	58 Å²	58	127.6 Å²	127.6	48%	0.479	66%	0.66	S	S	.	*	H	α-helix	trans	-69.6	-23.8	175.7	0	0	0	0	0	113	H123	H123-A127 PolarHBondContact O-N 3Å
128	G	46.4	Very low	47	Very low	58 Å²	58	127.8 Å²	127.8	60%	0.598	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.2	-6.2	178.6	0	0	0	0	0	115.8	F124 R126	F124-G128 PolarHBondContact O-N 3.25Å; R126-G128 VanDerWaalsContact C-N 3.27Å; R126-G128 PolarHBondContact O-N 3.49Å
129	M	44.5	Very low	46.7	Very low	166 Å²	166	125.3 Å²	125.3	82%	0.818	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.4	-1.3	-177.6	-150.6	166.5	85.2	0	0	113.6	R126	R126-M129 PolarHBondContact O-N 3.44Å
130	E	47.2	Very low	46.6	Very low	152 Å²	152	124.8 Å²	124.8	71%	0.71	67%	0.67	S	S	*	*	S	Bend	trans	-97.5	-13.1	-178.6	-59.7	-177.6	140.8	0	0	112.5
131	D	48.2	Very low	46.2	Very low	149 Å²	149	130.1 Å²	130.1	80%	0.797	70%	0.696	S	S	*	*	S	Bend	trans	-107.2	43.8	-178.5	-83.3	-29.4	0	0	0	113.5
132	S	51	Low	46.1	Very low	97 Å²	97	132.9 Å²	132.9	68%	0.678	71%	0.711	S	S	*	*			trans	-131.4	37.2	172.9	-69.8	0	0	0	0	114
133	H	49.1	Very low	46	Very low	190 Å²	190	137.5 Å²	137.5	88%	0.88	73%	0.73	S	S	*	*			trans	-138.8	71.6	164.2	-80.3	-72.1	0	0	0	111.4
134	V	41.4	Very low	45.9	Very low	219 Å²	219	140.5 Å²	140.5	100%	1.327	75%	0.753	S	S	*	*			trans	-145	0	146.1	-179.3	0	0	0	0	108.3

Retrieved 134 of 134 residues in 63.2 ms (Link to these results)

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