A0A077ZGN7_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZGN7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 174 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	41.1	Very low	40.5	Very low	230 Å²	230	158.4 Å²	158.4	100%	1.133	84%	0.838	S	S	*	*				0	67.4	0	-63.7	177.7	-177.8	0	0	105.7
2	E	41.1	Very low	40.4	Very low	176 Å²	176	157.8 Å²	157.8	82%	0.822	84%	0.836	S	S	*	*				87.1	83.7	88.7	-76.3	-175.8	148.2	0	0	109.9
3	F	43.4	Very low	40.5	Very low	215 Å²	215	157.4 Å²	157.4	94%	0.943	83%	0.827	S	S	*	*			trans	-79.5	118	153.4	-98.3	-103.5	0	0	0	106.2
4	D	42.4	Very low	40.8	Very low	155 Å²	155	155.2 Å²	155.2	83%	0.829	82%	0.816	S	S	*	*			trans	-149.6	147.4	176	-138.8	-38.6	0	0	0	111.7
5	G	41.3	Very low	40.7	Very low	69 Å²	69	154.1 Å²	154.1	71%	0.711	81%	0.805	S	S	*	*			trans	93.7	96.2	175.1	0	0	0	0	0	114.3
6	G	39	Very low	41.2	Very low	68 Å²	68	154.7 Å²	154.7	70%	0.701	80%	0.802	S	S	*	*			cis	104.8	120.3	21.9	0	0	0	0	0	110.8
7	Q	43.3	Very low	41.1	Very low	191 Å²	191	154.5 Å²	154.5	89%	0.893	79%	0.793	S	S	*	*			trans	74.3	139.9	157.5	-49.5	-178.5	-20	0	0	115.9
8	T	38.5	Very low	40.7	Very low	121 Å²	121	152.9 Å²	152.9	74%	0.742	80%	0.797	S	S	*	*			cis	-163.5	138.5	32.1	-37	0	0	0	0	109.9
9	E	38.2	Very low	40.7	Very low	180 Å²	180	154.2 Å²	154.2	84%	0.841	80%	0.795	S	S	*	*			trans	-61.5	145.7	159.5	-67.6	168	101	0	0	111.3
10	K	43.2	Very low	40.4	Very low	195 Å²	195	150 Å²	150	85%	0.848	79%	0.791	S	S	*	*			trans	-179.3	104.6	137.8	-99.2	159.5	-170.2	-179	0	111.8
11	N	33.6	Very low	40.4	Very low	142 Å²	142	152 Å²	152	76%	0.759	80%	0.799	S	S	*	*				20.9	118	122.8	-123.8	-13.5	0	0	0	116.7
12	N	39.7	Very low	40.1	Very low	152 Å²	152	150.2 Å²	150.2	81%	0.813	79%	0.787	S	S	*	*			trans	-148.2	98	138.3	-125.5	5.7	0	0	0	110.3	D14	N12-D14 PolarHBondContact O-N 3.39Å
13	Q	41.5	Very low	39.8	Very low	152 Å²	152	145.2 Å²	145.2	71%	0.71	78%	0.783	S	S	*	*			trans	-62.7	108	154.8	-80.4	177.5	-23.6	0	0	107.8	Q15	Q13-Q15 PolarHBondContact O-N 3.5Å
14	D	44.9	Very low	39.5	Very low	127 Å²	127	141.4 Å²	141.4	68%	0.679	78%	0.777	S	S	*	*			trans	-84.6	92.8	166.2	-122.2	-47	0	0	0	109.5	N12 H16	N12-D14 PolarHBondContact O-N 3.39Å; D14-H16 PolarHBondContact O-N 3.3Å; D14-H16 IonicContact OD1-CD2 2.56Å; D14-H16 IonicContact OD1-NE2 2.66Å
15	Q	39.5	Very low	39.4	Very low	139 Å²	139	140.7 Å²	140.7	65%	0.65	78%	0.778	S	S	*	*			trans	-71.2	93.9	163.6	-73.7	-175	14.4	0	0	109.4	Q13 K17	Q13-Q15 PolarHBondContact O-N 3.5Å; Q15-K17 PolarHBondContact O-N 3.48Å
16	H	49	Very low	39	Very low	163 Å²	163	145.7 Å²	145.7	76%	0.755	78%	0.783	S	S	*	*			trans	-92.5	85.6	159	-90.5	-67.5	0	0	0	110.9	D14 C18	D14-H16 PolarHBondContact O-N 3.3Å; D14-H16 IonicContact OD1-CD2 2.56Å; D14-H16 IonicContact OD1-NE2 2.66Å; H16-C18 PolarHBondContact O-N 3.41Å
17	K	38.4	Very low	39.1	Very low	151 Å²	151	147.2 Å²	147.2	66%	0.657	79%	0.789	S	S	*	*			trans	-62.2	103.1	155.8	-95.4	172.6	174.8	160.3	0	108.7	Q15 K19	Q15-K17 PolarHBondContact O-N 3.48Å; K17-K19 PolarHBondContact O-N 2.85Å
18	C	34.4	Very low	38.7	Very low	127 Å²	127	143 Å²	143	86%	0.858	78%	0.781	S	S	*	*			trans	-88.9	87.5	156.2	-71.8	0	0	0	0	108.2	H16	H16-C18 PolarHBondContact O-N 3.41Å
19	K	40.4	Very low	38.7	Very low	177 Å²	177	141.9 Å²	141.9	77%	0.77	78%	0.784	S	S	*	*			trans	-80.4	126.7	165.2	-86.5	-176	169.6	-173.3	0	108.7	K17	K17-K19 PolarHBondContact O-N 2.85Å
20	G	35	Very low	39.1	Very low	69 Å²	69	138.8 Å²	138.8	71%	0.711	78%	0.782	S	S	*	*			trans	80.4	107.7	154.5	0	0	0	0	0	115.7
21	M	41.1	Very low	38.9	Very low	193 Å²	193	137.9 Å²	137.9	95%	0.951	78%	0.781	S	S	*	*				-158.7	116.5	117.1	-90.8	-167.7	94.9	0	0	107.5	G23	M21-G23 PolarHBondContact O-N 2.94Å
22	H	34.8	Very low	39.2	Very low	193 Å²	193	138.4 Å²	138.4	89%	0.894	78%	0.784	S	S	*	*			trans	-65	123.3	171.1	-87.8	-110.7	0	0	0	109.2
23	G	33.4	Very low	39.2	Very low	70 Å²	70	135.8 Å²	135.8	72%	0.722	78%	0.775	S	S	*	*			trans	-133.5	101	162.9	0	0	0	0	0	107.7	M21 V25	M21-G23 PolarHBondContact O-N 2.94Å; G23-V25 PolarHBondContact O-N 2.78Å
24	T	37	Very low	39.1	Very low	136 Å²	136	137.9 Å²	137.9	83%	0.834	78%	0.782	S	S	*	*			trans	-72.1	116.7	177.2	-34.8	0	0	0	0	108.3
25	V	41.4	Very low	39.3	Very low	139 Å²	139	138.2 Å²	138.2	84%	0.842	79%	0.789	S	S	*	*			trans	-123.5	115.2	162.1	-175	0	0	0	0	108.1	G23 A27	G23-V25 PolarHBondContact O-N 2.78Å; V25-A27 PolarHBondContact O-N 3.28Å
26	Q	32.9	Very low	39.3	Very low	174 Å²	174	141 Å²	141	81%	0.813	80%	0.802	S	S	*	*			trans	-76.5	108.3	-176.8	-151.4	178.3	-19.2	0	0	108.3
27	A	40.9	Very low	39.3	Very low	101 Å²	101	144.2 Å²	144.2	84%	0.835	81%	0.807	S	S	*	*			trans	-98.4	98.3	166.2	0	0	0	0	0	107.8	V25 A29	V25-A27 PolarHBondContact O-N 3.28Å; A27-A29 PolarHBondContact O-N 2.85Å
28	S	35.9	Very low	39.4	Very low	102 Å²	102	143 Å²	143	71%	0.713	82%	0.815	S	S	*	*			trans	-64.7	116.9	178.9	-50.6	0	0	0	0	110.3	S30	S28-S30 PolarHBondContact O-N 3.36Å
29	A	36.8	Very low	39.8	Very low	97 Å²	97	144.6 Å²	144.6	80%	0.802	81%	0.813	S	S	*	*			trans	-69.5	114.6	161.9	0	0	0	0	0	108.6	A27 Q31	A27-A29 PolarHBondContact O-N 2.85Å; A29-Q31 PolarHBondContact O-N 2.8Å
30	S	46.4	Very low	39.7	Very low	116 Å²	116	141.7 Å²	141.7	81%	0.811	82%	0.815	S	S	*	*			trans	-89	91.5	166.5	174.4	0	0	0	0	108.3	S28	S28-S30 PolarHBondContact O-N 3.36Å
31	Q	40.6	Very low	39.9	Very low	175 Å²	175	147.3 Å²	147.3	82%	0.818	82%	0.822	S	S	*	*			trans	-83.5	126.5	152.7	-77.1	-179.5	-25.4	0	0	106.8	A29	A29-Q31 PolarHBondContact O-N 2.8Å
32	N	38.4	Very low	39.8	Very low	153 Å²	153	141 Å²	141	82%	0.818	81%	0.807	S	S	*	*			trans	-139.4	101.8	156.3	-121.5	-6.5	0	0	0	110.3
33	P	41	Very low	40.1	Very low	97 Å²	97	140.7 Å²	140.7	63%	0.63	81%	0.806	S	S	*	*			trans	-84.4	152.1	161.4	35.3	-28	0	0	0	109.1
34	F	39.3	Very low	40.2	Very low	196 Å²	196	146.8 Å²	146.8	86%	0.86	82%	0.816	S	S	*	*			trans	71.5	108.9	178.6	-75.8	-99.8	0	0	0	117.3
35	T	48.3	Very low	40.4	Very low	135 Å²	135	149.2 Å²	149.2	83%	0.828	82%	0.818	S	S	*	*				-171.9	103.2	113.5	21.9	0	0	0	0	110.3	R37	T35-R37 PolarHBondContact O-N 2.79Å
36	Q	40	Very low	40.5	Very low	196 Å²	196	151.4 Å²	151.4	92%	0.916	82%	0.819	S	S	*	*			trans	-61.6	125.6	160.4	-66.4	175	-6	0	0	109
37	R	49.2	Very low	40.9	Very low	232 Å²	232	151.2 Å²	151.2	88%	0.875	82%	0.818	S	S	*	*			trans	-145.6	148.8	153.7	-76.6	-162	176.7	-164.2	-1.2	110.5	T35	T35-R37 PolarHBondContact O-N 2.79Å
38	P	40.9	Very low	41.2	Very low	125 Å²	125	151.9 Å²	151.9	81%	0.812	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-83.5	148.8	-154.9	-4	23.2	0	0	0	113	S40	P38-S40 PolarHBondContact O-N 3.42Å
39	I	42.6	Very low	41.5	Very low	161 Å²	161	156.8 Å²	156.8	83%	0.826	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-68.8	117.8	176.9	-55.7	168	0	0	0	108.9
40	S	38.9	Very low	41.9	Very low	115 Å²	115	158.2 Å²	158.2	80%	0.804	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-96.8	122.1	164.3	-169.1	0	0	0	0	108.1	P38 G42	P38-S40 PolarHBondContact O-N 3.42Å; S40-G42 PolarHBondContact O-N 3.17Å
41	H	39.1	Very low	41.7	Very low	187 Å²	187	157.1 Å²	157.1	87%	0.866	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-63.6	118.5	174.9	-81.9	-81.2	0	0	0	110.4
42	G	38.4	Very low	41.9	Very low	62 Å²	62	154.7 Å²	154.7	64%	0.639	80%	0.797	S	S	*	*			trans	-165.6	104.4	172.7	0	0	0	0	0	109.1	S40	S40-G42 PolarHBondContact O-N 3.17Å
43	E	40.8	Very low	42.4	Very low	185 Å²	185	149.8 Å²	149.8	86%	0.864	78%	0.782	S	S	*	*			trans	70.5	95.7	147.7	-54.2	179.7	144.5	0	0	117.5	E45	E43-E45 PolarHBondContact O-N 3.39Å
44	Q	34.9	Very low	43.2	Very low	199 Å²	199	151.4 Å²	151.4	93%	0.93	79%	0.793	S	S	*	*			trans	38.4	84.7	135.1	-65.3	179.4	-5.8	0	0	117.1
45	E	42.7	Very low	44.5	Very low	186 Å²	186	149.7 Å²	149.7	87%	0.869	79%	0.785	S	S	*	*			trans	-115.8	109	146	-76.2	-173.8	144.7	0	0	107.7	E43 E47	E43-E45 PolarHBondContact O-N 3.39Å; E45-E47 VanDerWaalsContact C-N 3.33Å; E45-E47 PolarHBondContact O-N 3.03Å
46	E	43.5	Very low	45.5	Very low	186 Å²	186	154 Å²	154	87%	0.869	79%	0.786	S	S	*	*			trans	-60.8	96.6	168.5	-147.6	173.9	179.4	0	0	106.6	V48	E46-V48 PolarHBondContact O-N 2.98Å
47	E	41.2	Very low	47.5	Very low	169 Å²	169	148.3 Å²	148.3	79%	0.79	77%	0.766	S	S	*	*			trans	-60.7	91.3	169.7	-94.1	-173.8	155.2	0	0	108	E45 Y49	E45-E47 VanDerWaalsContact C-N 3.33Å; E45-E47 PolarHBondContact O-N 3.03Å; E47-Y49 PolarHBondContact O-N 3.45Å
48	V	46.7	Very low	49.3	Very low	115 Å²	115	139.2 Å²	139.2	70%	0.697	74%	0.737	S	S	*	*			trans	-62.6	94.9	164.3	-179	0	0	0	0	106.2	E46 N50	E46-V48 PolarHBondContact O-N 2.98Å; V48-N50 VanDerWaalsContact C-N 3.26Å; V48-N50 PolarHBondContact O-N 3.42Å
49	Y	41.1	Very low	51.6	Low	206 Å²	206	139 Å²	139	81%	0.808	73%	0.727	S	S	*	*			trans	-57.2	93.6	167.3	-117.3	-97.3	0	0	0	107.9	E47 A51	E47-Y49 PolarHBondContact O-N 3.45Å; Y49-A51 PolarHBondContact O-N 3.24Å
50	N	46.6	Very low	53.9	Low	126 Å²	126	134.9 Å²	134.9	67%	0.674	70%	0.704	S	S	*	*			trans	-74.3	80.5	174.5	-127.4	-16	0	0	0	107.1	V48 Q52	V48-N50 VanDerWaalsContact C-N 3.26Å; V48-N50 PolarHBondContact O-N 3.42Å; N50-Q52 PolarHBondContact O-N 3.37Å
51	A	41.9	Very low	56.1	Low	94 Å²	94	132.1 Å²	132.1	78%	0.777	69%	0.688	S	S	*	*			trans	-71.4	56.7	173.1	0	0	0	0	0	110.5	Y49 G53	Y49-A51 PolarHBondContact O-N 3.24Å; A51-G53 VanDerWaalsContact C-N 3.33Å; A51-G53 PolarHBondContact O-N 3.38Å; A51-G53 VanDerWaalsContact O-N 3.17Å
52	Q	44.3	Very low	58.4	Low	124 Å²	124	124.6 Å²	124.6	58%	0.579	66%	0.656	S	S	*	*			trans	-83	87	165.8	-77.7	-177.4	17.8	0	0	107.6	N50	N50-Q52 PolarHBondContact O-N 3.37Å
53	G	49.6	Very low	60.6	Low	50 Å²	50	129.4 Å²	129.4	52%	0.515	65%	0.654	S	S	.	*	P	Polyproline II helix	trans	-51.5	163.6	155.9	0	0	0	0	0	110.3	A51 K55	A51-G53 VanDerWaalsContact C-N 3.33Å; A51-G53 PolarHBondContact O-N 3.38Å; A51-G53 VanDerWaalsContact O-N 3.17Å; G53-K55 PolarHBondContact O-N 3.23Å
54	P	56.7	Low	62.5	Low	130 Å²	130	121.1 Å²	121.1	84%	0.844	62%	0.616	S	S	*	*	P	Polyproline II helix	trans	-50.4	118.7	-176.7	20.9	-32.1	0	0	0	109.6	R56	P54-R56 PolarHBondContact O-N 2.82Å
55	K	66.3	Low	64.6	Low	160 Å²	160	115.1 Å²	115.1	70%	0.696	59%	0.59	S	S	*	*	P	Polyproline II helix	trans	-56	117.4	179	-74.4	-177.2	-178.6	175.5	0	107	G53	G53-K55 PolarHBondContact O-N 3.23Å
56	R	70.8	Confident	66.2	Low	227 Å²	227	109.5 Å²	109.5	86%	0.857	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-60.7	138.8	176.6	-68	-174.6	-179.1	-176	1	107.7	P54 C58	P54-R56 PolarHBondContact O-N 2.82Å; R56-C58 PolarHBondContact O-N 2.79Å
57	P	81.7	Confident	67.8	Low	75 Å²	75	108 Å²	108	49%	0.487	56%	0.555	S	S	.	*	P	Polyproline II helix	trans	-59.5	139.8	174.4	27.5	-34.2	0	0	0	109	A111	P57-A111 CarbonylContact C-O 3.47Å; P57-A111 WeakPolarHBondContact CA-O 3.39Å
58	C	87.2	Confident	69.7	Low	41 Å²	41	101 Å²	101	28%	0.277	52%	0.522	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	141.9	167.8	-60.2	0	0	0	0	108.3	R56 T110 A111 I117	R56-C58 PolarHBondContact O-N 2.79Å; C58-T110 WeakPolarHBondContact O-CA 2.86Å; C58-T110 PolarHBondContact O-OG1 3Å; C58-T110 VanDerWaalsContact O-OG1 3.07Å; C58-A111 PolarHBondContact N-O 3.43Å; C58-A111 PolarHBondContact O-N 3.11Å; C58-A111 VanDerWaalsContact O-N 3.08Å; C58-I117 HydrophobicContact CB-CD1 3.63Å
59	M	89.4	Confident	71.2	Confident	120 Å²	120	96.2 Å²	96.2	59%	0.591	49%	0.492	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137	135.3	178.4	-65.7	-177.3	70.2	0	0	109.7	I108 L109	M59-I108 HydrophobicContact CE-CG2 3.66Å; M59-L109 CarbonylContact C-O 3.55Å; M59-L109 VanDerWaalsContact CA-O 3.28Å; M59-L109 WeakPolarHBondContact CA-O 2.9Å
60	E	89.2	Confident	72.8	Confident	76 Å²	76	94.1 Å²	94.1	36%	0.355	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	136.4	176.1	-164.3	177.5	167.2	0	0	111.8	L109 I117 K121	E60-L109 PolarHBondContact N-O 3.23Å; E60-L109 PolarHBondContact O-N 3.02Å; E60-I117 HydrophobicContact CB-CD1 4.31Å; E60-I117 HydrophobicContact CB-CG2 3.98Å; E60-I117 WeakPolarHBondContact OE2-CG2 3.39Å; E60-K121 VanDerWaalsContact CD-CE 3.49Å; E60-K121 WeakPolarHBondContact OE1-CE 3.46Å; E60-K121 IonicContact OE1-NZ 2.82Å; E60-K121 PolarHBondContact OE1-NZ 3.4Å; E60-K121 WeakPolarHBondContact OE2-CE 3.27Å; E60-K121 IonicContact OE2-NZ 3.29Å; E60-K121 PolarHBondContact OE2-NZ 3.23Å
61	A	87.1	Confident	74.2	Confident	57 Å²	57	90 Å²	90	47%	0.471	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	124.2	177.3	0	0	0	0	0	111	L106 L107	A61-L106 HydrophobicContact CB-CD1 3.93Å; A61-L106 HydrophobicContact CB-CD2 3.94Å; A61-L106 HydrophobicContact CB-CG 4.03Å; A61-L107 WeakPolarHBondContact CA-O 3.5Å
62	V	87	Confident	75.9	Confident	29 Å²	29	85.5 Å²	85.5	18%	0.176	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	129.9	-178.9	-176.6	0	0	0	0	109.2	V64 L107 L109 K121	V62-V64 HydrophobicContact CG1-CG1 4.25Å; V62-L107 PolarHBondContact N-O 3.39Å; V62-L107 PolarHBondContact O-N 3Å; V62-L109 HydrophobicContact CG2-CD1 3.69Å; V62-L109 HydrophobicContact CG2-CG 4.09Å; V62-K121 HydrophobicContact CG2-CG 4.33Å
63	R	84	Confident	77.2	Confident	162 Å²	162	81.6 Å²	81.6	61%	0.611	41%	0.414	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.1	129.8	171.1	-66.6	-175.1	-178.9	-150.1	0.2	109.4	A100 L106	R63-A100 HydrophobicContact CG-CB 4.5Å; R63-L106 HydrophobicContact CG-CD1 4.24Å
64	V	81.1	Confident	78.1	Confident	11 Å²	11	80.8 Å²	80.8	7%	0.067	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	148.8	176.9	-66.5	0	0	0	0	109.7	V62 F68 L69 D104 A105 L107 M124	V62-V64 HydrophobicContact CG1-CG1 4.25Å; V64-F68 HydrophobicContact CB-CD1 4.1Å; V64-F68 HydrophobicContact CG1-CD1 4.02Å; V64-F68 HydrophobicContact CG1-CE1 4.35Å; V64-L69 HydrophobicContact CG2-CB 4.14Å; V64-L69 HydrophobicContact CG2-CD1 4.36Å; V64-D104 WeakPolarHBondContact O-CA 3.47Å; V64-A105 HydrophobicContact CG2-CB 4.39Å; V64-A105 PolarHBondContact N-O 2.66Å; V64-A105 PolarHBondContact O-N 2.78Å; V64-L107 HydrophobicContact CG1-CB 4.45Å; V64-L107 HydrophobicContact CG2-CB 4.14Å; V64-M124 HydrophobicContact CG1-CE 3.65Å
65	N	79.5	Confident	77.9	Confident	73 Å²	73	80.8 Å²	80.8	39%	0.39	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	153.8	173.8	75.1	15.2	0	0	0	110.7	K67 F68 L69 N103	N65-K67 VanDerWaalsContact C-N 3.26Å; N65-K67 PolarHBondContact O-N 3.07Å; N65-F68 PolarHBondContact O-N 2.87Å; N65-F68 WeakPolarHBondContact OD1-CA 2.95Å; N65-F68 WeakPolarHBondContact OD1-CB 3.13Å; N65-F68 PolarHBondContact OD1-N 3.2Å; N65-L69 PolarHBondContact O-N 3.4Å; N65-N103 CarbonylContact C-O 3.57Å; N65-N103 WeakPolarHBondContact CA-O 3.45Å
66	E	74.6	Confident	77.6	Confident	68 Å²	68	75.2 Å²	75.2	32%	0.318	40%	0.396	S	S	.	.	H	α-helix	trans	-62.6	-34.4	-176.9	-165.6	-173.9	163.4	0	0	112.1	F68 L69 R70 N103	E66-F68 PolarHBondContact O-N 2.77Å; E66-L69 PolarHBondContact O-N 3.47Å; E66-R70 WeakPolarHBondContact O-CG 3.42Å; E66-R70 PolarHBondContact O-N 3.22Å; E66-R70 IonicContact OE1-CZ 3.39Å; E66-R70 IonicContact OE1-NE 3.66Å; E66-R70 PolarHBondContact OE1-NE 3.33Å; E66-R70 IonicContact OE1-NH2 2.68Å; E66-R70 PolarHBondContact OE1-NH2 3.08Å; E66-N103 PolarHBondContact N-O 3.29Å
67	K	78.3	Confident	77.3	Confident	154 Å²	154	69.7 Å²	69.7	67%	0.67	38%	0.379	S	S	*	.	H	α-helix	trans	-60	-45.2	176.8	-175.2	-175.8	175.9	-168.5	0	111.5	N65 R70 A71	N65-K67 VanDerWaalsContact C-N 3.26Å; N65-K67 PolarHBondContact O-N 3.07Å; K67-R70 PolarHBondContact O-N 2.98Å; K67-A71 PolarHBondContact O-N 3.33Å; K67-A71 VanDerWaalsContact O-N 3.1Å
68	F	80.2	Confident	76.9	Confident	24 Å²	24	68.6 Å²	68.6	11%	0.105	37%	0.369	C	S	.	.	H	α-helix	trans	-71.6	-41.8	179	-175.2	-119.4	0	0	0	110.5	V64 N65 E66 R70 A71 L72 M124 L127 T128	V64-F68 HydrophobicContact CB-CD1 4.1Å; V64-F68 HydrophobicContact CG1-CD1 4.02Å; V64-F68 HydrophobicContact CG1-CE1 4.35Å; N65-F68 PolarHBondContact O-N 2.87Å; N65-F68 WeakPolarHBondContact OD1-CA 2.95Å; N65-F68 WeakPolarHBondContact OD1-CB 3.13Å; N65-F68 PolarHBondContact OD1-N 3.2Å; E66-F68 PolarHBondContact O-N 2.77Å; F68-R70 VanDerWaalsContact C-N 3.29Å; F68-R70 PolarHBondContact O-N 3.26Å; F68-A71 WeakPolarHBondContact O-CA 3.28Å; F68-A71 WeakPolarHBondContact O-CB 3.16Å; F68-A71 PolarHBondContact O-N 3.49Å; F68-L72 HydrophobicContact CD1-CD1 3.71Å; F68-L72 HydrophobicContact CD1-CG 4.23Å; F68-L72 HydrophobicContact CE1-CD1 3.49Å; F68-L72 VanDerWaalsContact CE1-CD1 3.49Å; F68-L72 HydrophobicContact CE1-CD2 4.17Å; F68-L72 HydrophobicContact CE1-CG 4.03Å; F68-L72 HydrophobicContact CE2-CD2 4.16Å; F68-L72 HydrophobicContact CE2-CG 4.38Å; F68-L72 HydrophobicContact CG-CD1 4.42Å; F68-L72 HydrophobicContact CZ-CD1 4.03Å; F68-L72 HydrophobicContact CZ-CD2 3.8Å; F68-L72 HydrophobicContact CZ-CG 4.1Å; F68-L72 WeakPolarHBondContact O-CG 3.13Å; F68-L72 PolarHBondContact O-N 3.32Å; F68-M124 HydrophobicContact CE1-CB 4.13Å; F68-M124 HydrophobicContact CE1-CE 3.74Å; F68-M124 HydrophobicContact CE1-CG 4.34Å; F68-M124 HydrophobicContact CZ-CB 4.06Å; F68-M124 HydrophobicContact CZ-CG 4.34Å; F68-M124 WeakPolarHBondContact CZ-O 3.21Å; F68-L127 HydrophobicContact CE2-CB 3.79Å; F68-L127 HydrophobicContact CE2-CD1 4.49Å; F68-L127 HydrophobicContact CZ-CB 4.02Å; F68-L127 HydrophobicContact CZ-CD1 4.32Å; F68-T128 WeakPolarHBondContact CE2-OG1 3.35Å; F68-T128 WeakPolarHBondContact CZ-OG1 3.28Å
69	L	78.2	Confident	76.3	Confident	14 Å²	14	66.8 Å²	66.8	7%	0.073	36%	0.356	C	S	.	.	H	α-helix	trans	-55.8	-45.7	173.3	-177.7	68.2	0	0	0	111.4	V64 N65 E66 A71 L72 T73 C93 A105 L107	V64-L69 HydrophobicContact CG2-CB 4.14Å; V64-L69 HydrophobicContact CG2-CD1 4.36Å; N65-L69 PolarHBondContact O-N 3.4Å; E66-L69 PolarHBondContact O-N 3.47Å; L69-A71 VanDerWaalsContact C-N 3.29Å; L69-A71 PolarHBondContact O-N 2.89Å; L69-L72 PolarHBondContact O-N 3.3Å; L69-T73 HydrophobicContact CD1-CG2 3.89Å; L69-T73 HydrophobicContact CG-CG2 4.36Å; L69-T73 WeakPolarHBondContact O-CB 3.48Å; L69-T73 PolarHBondContact O-N 3.4Å; L69-T73 PolarHBondContact O-OG1 2.94Å; L69-C93 HydrophobicContact CD1-CB 4.21Å; L69-A105 HydrophobicContact CB-CB 4.45Å; L69-A105 HydrophobicContact CD2-CB 3.43Å; L69-A105 VanDerWaalsContact CD2-CB 3.43Å; L69-A105 HydrophobicContact CG-CB 4.45Å; L69-L107 HydrophobicContact CD1-CD1 4.18Å
70	R	76.1	Confident	75.9	Confident	161 Å²	161	62.8 Å²	62.8	61%	0.608	34%	0.336	S	S	*	.	H	α-helix	trans	-62.9	-34.8	175.8	-71.3	-177.8	-161.7	-170.4	8.1	112.4	E66 K67 F68 G74	E66-R70 WeakPolarHBondContact O-CG 3.42Å; E66-R70 PolarHBondContact O-N 3.22Å; E66-R70 IonicContact OE1-CZ 3.39Å; E66-R70 IonicContact OE1-NE 3.66Å; E66-R70 PolarHBondContact OE1-NE 3.33Å; E66-R70 IonicContact OE1-NH2 2.68Å; E66-R70 PolarHBondContact OE1-NH2 3.08Å; K67-R70 PolarHBondContact O-N 2.98Å; F68-R70 VanDerWaalsContact C-N 3.29Å; F68-R70 PolarHBondContact O-N 3.26Å; R70-G74 WeakPolarHBondContact O-CA 3.48Å; R70-G74 PolarHBondContact O-N 3.4Å
71	A	75.2	Confident	75.3	Confident	39 Å²	39	64.6 Å²	64.6	32%	0.322	34%	0.343	S	S	.	.	H	α-helix	trans	-66	-42.8	173.4	0	0	0	0	0	111.6	K67 F68 L69 I79	K67-A71 PolarHBondContact O-N 3.33Å; K67-A71 VanDerWaalsContact O-N 3.1Å; F68-A71 WeakPolarHBondContact O-CA 3.28Å; F68-A71 WeakPolarHBondContact O-CB 3.16Å; F68-A71 PolarHBondContact O-N 3.49Å; L69-A71 VanDerWaalsContact C-N 3.29Å; L69-A71 PolarHBondContact O-N 2.89Å; A71-I79 HydrophobicContact CB-CD1 4.44Å; A71-I79 WeakPolarHBondContact O-CD1 3.45Å
72	L	77	Confident	74.9	Confident	1 Å²	1	62.2 Å²	62.2	1%	0.005	32%	0.322	C	S	.	.	H	α-helix	trans	-63.7	-45.4	177.7	-65.2	174.2	0	0	0	112.7	F68 L69 I79 I83 M91 L107 M124 L127	F68-L72 HydrophobicContact CD1-CD1 3.71Å; F68-L72 HydrophobicContact CD1-CG 4.23Å; F68-L72 HydrophobicContact CE1-CD1 3.49Å; F68-L72 VanDerWaalsContact CE1-CD1 3.49Å; F68-L72 HydrophobicContact CE1-CD2 4.17Å; F68-L72 HydrophobicContact CE1-CG 4.03Å; F68-L72 HydrophobicContact CE2-CD2 4.16Å; F68-L72 HydrophobicContact CE2-CG 4.38Å; F68-L72 HydrophobicContact CG-CD1 4.42Å; F68-L72 HydrophobicContact CZ-CD1 4.03Å; F68-L72 HydrophobicContact CZ-CD2 3.8Å; F68-L72 HydrophobicContact CZ-CG 4.1Å; F68-L72 WeakPolarHBondContact O-CG 3.13Å; F68-L72 PolarHBondContact O-N 3.32Å; L69-L72 PolarHBondContact O-N 3.3Å; L72-I79 HydrophobicContact CD2-CB 4.16Å; L72-I79 HydrophobicContact CD2-CD1 4.21Å; L72-I79 HydrophobicContact CD2-CG2 3.64Å; L72-I83 HydrophobicContact CD2-CD1 3.88Å; L72-M91 HydrophobicContact CB-CE 4.07Å; L72-M91 HydrophobicContact CD1-CE 3.43Å; L72-M91 VanDerWaalsContact CD1-CE 3.43Å; L72-M91 HydrophobicContact CD2-CE 4Å; L72-M91 HydrophobicContact CG-CE 4.02Å; L72-L107 HydrophobicContact CD1-CD2 4.27Å; L72-M124 HydrophobicContact CD1-CE 4.22Å; L72-L127 HydrophobicContact CD2-CD1 4.16Å
73	T	72	Confident	74.8	Confident	42 Å²	42	60.8 Å²	60.8	26%	0.258	31%	0.314	S	S	.	.	H	α-helix	trans	-101.4	-2.5	-170.2	59.6	0	0	0	0	114.4	L69 C93	L69-T73 HydrophobicContact CD1-CG2 3.89Å; L69-T73 HydrophobicContact CG-CG2 4.36Å; L69-T73 WeakPolarHBondContact O-CB 3.48Å; L69-T73 PolarHBondContact O-N 3.4Å; L69-T73 PolarHBondContact O-OG1 2.94Å; T73-C93 HydrophobicContact CG2-CB 4.08Å; T73-C93 WeakPolarHBondContact CG2-SG 3.4Å
74	G	68.2	Low	74.9	Confident	33 Å²	33	56.2 Å²	56.2	34%	0.34	30%	0.299	S	S	.	.	S	Bend	trans	-58.2	175.4	-176	0	0	0	0	0	113.7	R70 G76 K77	R70-G74 WeakPolarHBondContact O-CA 3.48Å; R70-G74 PolarHBondContact O-N 3.4Å; G74-G76 PolarHBondContact O-N 2.67Å; G74-K77 PolarHBondContact O-N 2.86Å
75	S	53.1	Low	75	Confident	130 Å²	130	59.1 Å²	59.1	91%	0.909	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.2	105.3	-174.4	47	0	0	0	0	112.1
76	G	59.5	Low	75	Confident	42 Å²	42	56.7 Å²	56.7	43%	0.433	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	120.6	-21.1	179.7	0	0	0	0	0	115.4	G74 N78	G74-G76 PolarHBondContact O-N 2.67Å; G76-N78 PolarHBondContact O-N 2.92Å; G76-N78 VanDerWaalsContact O-N 3.12Å; G76-N78 PolarHBondContact O-OD1 3.21Å
77	K	65.9	Low	75.5	Confident	112 Å²	112	53.7 Å²	53.7	49%	0.487	28%	0.282	S	S	.	.			trans	49.2	33	-174.1	-60.4	-175.2	170	-158.7	0	112.8	G74 E80 K81	G74-K77 PolarHBondContact O-N 2.86Å; K77-E80 WeakPolarHBondContact CD-OE2 3.21Å; K77-K81 WeakPolarHBondContact O-CG 3.39Å; K77-K81 PolarHBondContact O-N 2.89Å
78	N	72.3	Confident	75.9	Confident	51 Å²	51	48.3 Å²	48.3	27%	0.273	27%	0.27	S	S	.	.	H	α-helix	trans	-68.5	-40.1	-171.6	-71.5	-23.6	0	0	0	111.2	G76 V82 P139	G76-N78 PolarHBondContact O-N 2.92Å; G76-N78 VanDerWaalsContact O-N 3.12Å; G76-N78 PolarHBondContact O-OD1 3.21Å; N78-V82 WeakPolarHBondContact O-CG2 3.46Å; N78-V82 PolarHBondContact O-N 3.33Å; N78-V82 VanDerWaalsContact O-N 3.07Å; N78-P139 HydrophobicContact CB-CG 4.35Å; N78-P139 VanDerWaalsContact OD1-CG 3.31Å; N78-P139 WeakPolarHBondContact OD1-CG 3.38Å
79	I	74.9	Confident	76.4	Confident	4 Å²	4	47.1 Å²	47.1	2%	0.021	27%	0.265	C	S	.	.	H	α-helix	trans	-70.9	-44.7	-179.2	-45.2	-179.4	0	0	0	111.5	A71 L72 K81 V82 I83 L127 T134 I137	A71-I79 HydrophobicContact CB-CD1 4.44Å; A71-I79 WeakPolarHBondContact O-CD1 3.45Å; L72-I79 HydrophobicContact CD2-CB 4.16Å; L72-I79 HydrophobicContact CD2-CD1 4.21Å; L72-I79 HydrophobicContact CD2-CG2 3.64Å; I79-K81 VanDerWaalsContact C-N 3.25Å; I79-K81 PolarHBondContact O-N 3.31Å; I79-V82 WeakPolarHBondContact O-CA 3.21Å; I79-V82 WeakPolarHBondContact O-CB 3.37Å; I79-V82 PolarHBondContact O-N 3.44Å; I79-I83 HydrophobicContact CG2-CD1 3.83Å; I79-I83 HydrophobicContact CG2-CG1 4.21Å; I79-I83 WeakPolarHBondContact O-CG1 3.22Å; I79-I83 PolarHBondContact O-N 2.93Å; I79-L127 HydrophobicContact CG2-CD1 3.51Å; I79-T134 VanDerWaalsContact CD1-CB 3.45Å; I79-T134 HydrophobicContact CD1-CG2 2.99Å; I79-T134 HydrophobicContact CG1-CG2 3.47Å; I79-T134 VanDerWaalsContact CG1-CG2 3.47Å; I79-I137 HydrophobicContact CG1-CD1 4.44Å
80	E	80.3	Confident	76.9	Confident	36 Å²	36	53.7 Å²	53.7	17%	0.168	29%	0.289	C	S	.	.	H	α-helix	trans	-51.2	-48.9	176.3	178.5	-175.8	168.5	0	0	110.7	K77 V82 I83 E84 M91	K77-E80 WeakPolarHBondContact CD-OE2 3.21Å; E80-V82 VanDerWaalsContact C-N 3.34Å; E80-V82 PolarHBondContact O-N 3.4Å; E80-I83 PolarHBondContact O-N 2.9Å; E80-E84 WeakPolarHBondContact O-CB 3.49Å; E80-E84 PolarHBondContact O-N 3.01Å; E80-M91 HydrophobicContact CB-SD 4.31Å; E80-M91 HydrophobicContact CG-CB 4.18Å; E80-M91 HydrophobicContact CG-SD 4.21Å
81	K	78	Confident	77.4	Confident	113 Å²	113	46.2 Å²	46.2	49%	0.491	26%	0.261	S	S	.	.	H	α-helix	trans	-64.4	-36.8	177.2	-70.5	175.5	-179.2	171.9	0	113	K77 I79 Y85	K77-K81 WeakPolarHBondContact O-CG 3.39Å; K77-K81 PolarHBondContact O-N 2.89Å; I79-K81 VanDerWaalsContact C-N 3.25Å; I79-K81 PolarHBondContact O-N 3.31Å; K81-Y85 WeakPolarHBondContact O-CB 3.34Å; K81-Y85 PolarHBondContact O-N 3.27Å
82	V	78.7	Confident	77.6	Confident	7 Å²	7	48.8 Å²	48.8	4%	0.042	27%	0.269	C	S	.	.	H	α-helix	trans	-66.9	-45	177.1	168.2	0	0	0	0	110.2	N78 I79 E80 Y85 F86 F123 I137	N78-V82 WeakPolarHBondContact O-CG2 3.46Å; N78-V82 PolarHBondContact O-N 3.33Å; N78-V82 VanDerWaalsContact O-N 3.07Å; I79-V82 WeakPolarHBondContact O-CA 3.21Å; I79-V82 WeakPolarHBondContact O-CB 3.37Å; I79-V82 PolarHBondContact O-N 3.44Å; E80-V82 VanDerWaalsContact C-N 3.34Å; E80-V82 PolarHBondContact O-N 3.4Å; V82-Y85 PolarHBondContact O-N 2.85Å; V82-F86 HydrophobicContact CG1-CD2 3.76Å; V82-F86 HydrophobicContact CG1-CE2 3.96Å; V82-F86 WeakPolarHBondContact O-CD2 3.21Å; V82-F86 PolarHBondContact O-N 3.09Å; V82-F123 HydrophobicContact CG1-CE1 4.29Å; V82-F123 HydrophobicContact CG1-CZ 3.85Å; V82-I137 HydrophobicContact CG2-CG2 3.85Å
83	I	84.2	Confident	77.2	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-59.9	-50.1	175.3	-68.9	168.4	0	0	0	109.9	L72 I79 E80 Y85 F86 T87 M91 A120 F123 M124 L127	L72-I83 HydrophobicContact CD2-CD1 3.88Å; I79-I83 HydrophobicContact CG2-CD1 3.83Å; I79-I83 HydrophobicContact CG2-CG1 4.21Å; I79-I83 WeakPolarHBondContact O-CG1 3.22Å; I79-I83 PolarHBondContact O-N 2.93Å; E80-I83 PolarHBondContact O-N 2.9Å; I83-Y85 VanDerWaalsContact C-N 3.26Å; I83-Y85 PolarHBondContact O-N 2.64Å; I83-F86 PolarHBondContact O-N 3.4Å; I83-T87 WeakPolarHBondContact O-CB 3.4Å; I83-T87 WeakPolarHBondContact O-CG2 3.48Å; I83-T87 PolarHBondContact O-N 2.82Å; I83-T87 PolarHBondContact O-OG1 3.34Å; I83-M91 HydrophobicContact CB-SD 3.91Å; I83-M91 HydrophobicContact CD1-CE 3.95Å; I83-M91 HydrophobicContact CD1-SD 3.51Å; I83-M91 VanDerWaalsContact CD1-SD 3.51Å; I83-M91 HydrophobicContact CG1-SD 4.29Å; I83-M91 HydrophobicContact CG2-CG 4.43Å; I83-M91 HydrophobicContact CG2-SD 3.89Å; I83-A120 HydrophobicContact CG2-CB 4.11Å; I83-F123 HydrophobicContact CD1-CD1 4.23Å; I83-F123 HydrophobicContact CG1-CD1 3.53Å; I83-F123 HydrophobicContact CG1-CE1 3.69Å; I83-M124 HydrophobicContact CD1-CG 3.95Å; I83-L127 HydrophobicContact CD1-CD1 4.07Å
84	E	86.7	Confident	76.6	Confident	66 Å²	66	52.3 Å²	52.3	31%	0.308	29%	0.286	S	S	.	.	H	α-helix	trans	-56.5	-43.3	176.8	-175.7	179.9	-170.1	0	0	111.3	E80 G88 T89 R90	E80-E84 WeakPolarHBondContact O-CB 3.49Å; E80-E84 PolarHBondContact O-N 3.01Å; E84-G88 VanDerWaalsContact O-CA 3.22Å; E84-G88 WeakPolarHBondContact O-CA 3.41Å; E84-G88 PolarHBondContact O-N 3.31Å; E84-T89 WeakPolarHBondContact CA-O 3.3Å; E84-R90 HydrophobicContact CG-CG 3.97Å; E84-R90 VanDerWaalsContact OE1-CG 3.27Å; E84-R90 WeakPolarHBondContact OE1-CG 3.22Å; E84-R90 IonicContact OE1-CZ 3.8Å; E84-R90 IonicContact OE1-NE 3.96Å; E84-R90 PolarHBondContact OE1-NE 3.24Å; E84-R90 IonicContact OE1-NH2 3.7Å
85	Y	81.7	Confident	75.9	Confident	71 Å²	71	55.5 Å²	55.5	28%	0.278	30%	0.299	S	S	.	.	H	α-helix	trans	-67.3	-38.1	-177.1	-175.4	-112.5	0	0	0	114.6	K81 V82 I83 R143 K146	K81-Y85 WeakPolarHBondContact O-CB 3.34Å; K81-Y85 PolarHBondContact O-N 3.27Å; V82-Y85 PolarHBondContact O-N 2.85Å; I83-Y85 VanDerWaalsContact C-N 3.26Å; I83-Y85 PolarHBondContact O-N 2.64Å; Y85-R143 PolarHBondContact OH-O 3.31Å; Y85-K146 HydrophobicContact CD1-CD 4.02Å; Y85-K146 HydrophobicContact CD2-CD 4.49Å; Y85-K146 HydrophobicContact CE1-CB 3.56Å; Y85-K146 HydrophobicContact CE1-CD 3.26Å; Y85-K146 HydrophobicContact CE1-CG 4.02Å; Y85-K146 HydrophobicContact CE2-CD 3.79Å; Y85-K146 PolarHBondContact O-NZ 3.37Å; Y85-K146 WeakPolarHBondContact OH-CB 3.4Å; Y85-K146 VanDerWaalsContact OH-CD 3.28Å; Y85-K146 WeakPolarHBondContact OH-CD 3.41Å
86	F	79.8	Confident	75.7	Confident	22 Å²	22	55.5 Å²	55.5	10%	0.096	29%	0.289	C	S	.	.	H	α-helix	trans	-84.9	-34.9	-178.8	-80.6	-68.4	0	0	0	113.1	V82 I83 Y163	V82-F86 HydrophobicContact CG1-CD2 3.76Å; V82-F86 HydrophobicContact CG1-CE2 3.96Å; V82-F86 WeakPolarHBondContact O-CD2 3.21Å; V82-F86 PolarHBondContact O-N 3.09Å; I83-F86 PolarHBondContact O-N 3.4Å; F86-Y163 HydrophobicContact CD2-CE1 4.48Å; F86-Y163 HydrophobicContact CE1-CD1 4.28Å; F86-Y163 HydrophobicContact CE1-CD2 4.48Å; F86-Y163 AromaticContact CE1-CE1 3.94Å; F86-Y163 HydrophobicContact CE1-CE1 3.94Å; F86-Y163 HydrophobicContact CE1-CE2 4.17Å; F86-Y163 AromaticContact CE1-CZ 3.92Å; F86-Y163 HydrophobicContact CE2-CD1 4.28Å; F86-Y163 AromaticContact CE2-CE1 3.46Å; F86-Y163 HydrophobicContact CE2-CE1 3.46Å; F86-Y163 VanDerWaalsContact CE2-CE1 3.46Å; F86-Y163 AromaticContact CE2-CZ 3.82Å; F86-Y163 AromaticContact CZ-CD1 3.94Å; F86-Y163 HydrophobicContact CZ-CD1 3.94Å; F86-Y163 HydrophobicContact CZ-CD2 4.45Å; F86-Y163 AromaticContact CZ-CE1 3.19Å; F86-Y163 HydrophobicContact CZ-CE1 3.19Å; F86-Y163 AromaticContact CZ-CE2 3.81Å; F86-Y163 HydrophobicContact CZ-CE2 3.81Å; F86-Y163 AromaticContact CZ-CZ 3.14Å; F86-Y163 VanDerWaalsContact CZ-OH 3.22Å; F86-Y163 WeakPolarHBondContact CZ-OH 3.05Å
87	T	86.4	Confident	75	Confident	5 Å²	5	57.4 Å²	57.4	3%	0.031	31%	0.308	C	S	.	.	H	α-helix	trans	-107.3	-17.7	-169.3	70.6	0	0	0	0	112.6	I83 T89 N116 V119 A120	I83-T87 WeakPolarHBondContact O-CB 3.4Å; I83-T87 WeakPolarHBondContact O-CG2 3.48Å; I83-T87 PolarHBondContact O-N 2.82Å; I83-T87 PolarHBondContact O-OG1 3.34Å; T87-T89 PolarHBondContact O-N 3.11Å; T87-T89 WeakPolarHBondContact OG1-CB 3.15Å; T87-T89 PolarHBondContact OG1-N 3.39Å; T87-T89 VanDerWaalsContact OG1-N 3.11Å; T87-T89 PolarHBondContact OG1-OG1 3.13Å; T87-N116 WeakPolarHBondContact O-CB 3.19Å; T87-N116 PolarHBondContact O-ND2 2.88Å; T87-V119 HydrophobicContact CG2-CB 4.44Å; T87-V119 HydrophobicContact CG2-CG1 3.83Å; T87-A120 HydrophobicContact CG2-CB 4.15Å
88	G	86.5	Confident	74.2	Confident	41 Å²	41	55 Å²	55	42%	0.423	30%	0.3	S	S	.	.			trans	69.8	12.9	-168.7	0	0	0	0	0	112.9	E84	E84-G88 VanDerWaalsContact O-CA 3.22Å; E84-G88 WeakPolarHBondContact O-CA 3.41Å; E84-G88 PolarHBondContact O-N 3.31Å
89	T	89.6	Confident	73.1	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	32%	0.319	C	S	.	.			trans	-101.8	120	-178.9	-59.4	0	0	0	0	110.3	E84 T87 L109 T110 A111 N116 I117 A120	E84-T89 WeakPolarHBondContact CA-O 3.3Å; T87-T89 PolarHBondContact O-N 3.11Å; T87-T89 WeakPolarHBondContact OG1-CB 3.15Å; T87-T89 PolarHBondContact OG1-N 3.39Å; T87-T89 VanDerWaalsContact OG1-N 3.11Å; T87-T89 PolarHBondContact OG1-OG1 3.13Å; T89-L109 HydrophobicContact CG2-CB 3.79Å; T89-L109 HydrophobicContact CG2-CD2 4.1Å; T89-L109 HydrophobicContact CG2-CG 4.38Å; T89-T110 CarbonylContact C-O 3.53Å; T89-T110 WeakPolarHBondContact CA-O 3.31Å; T89-A111 HydrophobicContact CG2-CB 4.48Å; T89-N116 PolarHBondContact OG1-O 2.91Å; T89-I117 HydrophobicContact CG2-CG1 4.42Å; T89-A120 HydrophobicContact CG2-CB 3.79Å
90	R	88.8	Confident	72.2	Confident	152 Å²	152	60.9 Å²	60.9	57%	0.574	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.3	147.3	171.3	-69.2	-179.3	175.3	174.8	6.6	110.4	E84 L109 T110	E84-R90 HydrophobicContact CG-CG 3.97Å; E84-R90 VanDerWaalsContact OE1-CG 3.27Å; E84-R90 WeakPolarHBondContact OE1-CG 3.22Å; E84-R90 IonicContact OE1-CZ 3.8Å; E84-R90 IonicContact OE1-NE 3.96Å; E84-R90 PolarHBondContact OE1-NE 3.24Å; E84-R90 IonicContact OE1-NH2 3.7Å; R90-L109 WeakPolarHBondContact O-CA 3.2Å; R90-T110 HydrophobicContact CB-CG2 3.68Å; R90-T110 PolarHBondContact N-O 2.77Å; R90-T110 PolarHBondContact O-N 3.23Å
91	M	86.1	Confident	71.1	Confident	3 Å²	3	64.1 Å²	64.1	2%	0.015	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	122.1	178.8	-60.1	164.6	69.8	0	0	108.7	L72 E80 I83 L107 I108 L109	L72-M91 HydrophobicContact CB-CE 4.07Å; L72-M91 HydrophobicContact CD1-CE 3.43Å; L72-M91 VanDerWaalsContact CD1-CE 3.43Å; L72-M91 HydrophobicContact CD2-CE 4Å; L72-M91 HydrophobicContact CG-CE 4.02Å; E80-M91 HydrophobicContact CB-SD 4.31Å; E80-M91 HydrophobicContact CG-CB 4.18Å; E80-M91 HydrophobicContact CG-SD 4.21Å; I83-M91 HydrophobicContact CB-SD 3.91Å; I83-M91 HydrophobicContact CD1-CE 3.95Å; I83-M91 HydrophobicContact CD1-SD 3.51Å; I83-M91 VanDerWaalsContact CD1-SD 3.51Å; I83-M91 HydrophobicContact CG1-SD 4.29Å; I83-M91 HydrophobicContact CG2-CG 4.43Å; I83-M91 HydrophobicContact CG2-SD 3.89Å; M91-L107 HydrophobicContact CB-CD1 4.11Å; M91-L107 HydrophobicContact CE-CD1 4.08Å; M91-L107 HydrophobicContact CE-CD2 3.39Å; M91-L107 HydrophobicContact CE-CG 4.32Å; M91-L107 HydrophobicContact CG-CD2 4.35Å; M91-I108 CarbonylContact C-O 3.59Å; M91-L109 HydrophobicContact CB-CD2 4.46Å; M91-L109 HydrophobicContact CG-CD2 3.72Å
92	L	80.8	Confident	70.3	Confident	93 Å²	93	65.5 Å²	65.5	49%	0.487	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	110.2	173.3	-60.1	173.7	0	0	0	107.1	I108 T110	L92-I108 HydrophobicContact CB-CB 4.09Å; L92-I108 PolarHBondContact N-O 2.78Å; L92-I108 PolarHBondContact O-N 3.24Å; L92-T110 HydrophobicContact CD1-CG2 4.33Å
93	C	67.5	Low	69.7	Low	38 Å²	38	70.8 Å²	70.8	26%	0.257	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	111	177.9	-58.8	0	0	0	0	108.2	L69 T73 T95 L107	L69-C93 HydrophobicContact CD1-CB 4.21Å; T73-C93 HydrophobicContact CG2-CB 4.08Å; T73-C93 WeakPolarHBondContact CG2-SG 3.4Å; C93-T95 VanDerWaalsContact C-N 3.33Å; C93-T95 HydrophobicContact CB-CG2 4.44Å; C93-T95 PolarHBondContact O-N 3.09Å; C93-T95 VanDerWaalsContact O-N 3.13Å; C93-L107 HydrophobicContact CB-CD1 4.32Å; C93-L107 WeakPolarHBondContact SG-CD1 3.45Å
94	Q	60.8	Low	69.1	Low	79 Å²	79	73.2 Å²	73.2	37%	0.369	40%	0.4	S	S	.	.			trans	-84.5	86	170.5	-168.4	167	-5.4	0	0	107.9	D96 I98	Q94-D96 VanDerWaalsContact CG-O 3.3Å; Q94-D96 WeakPolarHBondContact CG-O 3.22Å; Q94-D96 PolarHBondContact NE2-O 2.99Å; Q94-D96 PolarHBondContact O-N 3.41Å; Q94-I98 VanDerWaalsContact CD-CD1 3.44Å; Q94-I98 HydrophobicContact CG-CD1 4.41Å; Q94-I98 HydrophobicContact CG-CG1 4.41Å
95	T	51.9	Low	68.5	Low	101 Å²	101	70.7 Å²	70.7	62%	0.62	39%	0.39	S	S	*	.			trans	-70	-22.5	175.8	51.9	0	0	0	0	111.9	C93	C93-T95 VanDerWaalsContact C-N 3.33Å; C93-T95 HydrophobicContact CB-CG2 4.44Å; C93-T95 PolarHBondContact O-N 3.09Å; C93-T95 VanDerWaalsContact O-N 3.13Å
96	D	50.5	Low	68.3	Low	129 Å²	129	68.7 Å²	68.7	69%	0.69	38%	0.384	S	S	*	.	S	Bend	trans	-106.4	112.8	-175.3	-58.9	-26.6	0	0	0	111	Q94	Q94-D96 VanDerWaalsContact CG-O 3.3Å; Q94-D96 WeakPolarHBondContact CG-O 3.22Å; Q94-D96 PolarHBondContact NE2-O 2.99Å; Q94-D96 PolarHBondContact O-N 3.41Å
97	G	43.6	Very low	68.6	Low	82 Å²	82	67.7 Å²	67.7	85%	0.845	38%	0.379	S	S	*	.	S	Bend	trans	97	-2.9	159.9	0	0	0	0	0	117.8
98	I	48.5	Very low	68.6	Low	61 Å²	61	69 Å²	69	31%	0.313	39%	0.386	S	S	.	.			trans	-127.6	79.7	173.9	-46.5	-178.6	0	0	0	110.3	Q94 L106	Q94-I98 VanDerWaalsContact CD-CD1 3.44Å; Q94-I98 HydrophobicContact CG-CD1 4.41Å; Q94-I98 HydrophobicContact CG-CG1 4.41Å; I98-L106 HydrophobicContact CB-CB 4.27Å; I98-L106 HydrophobicContact CD1-CD2 3.83Å; I98-L106 HydrophobicContact CG2-CB 3.95Å; I98-L106 HydrophobicContact CG2-CD2 4.05Å
99	K	50.9	Low	68.8	Low	154 Å²	154	67 Å²	67	67%	0.67	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.2	111.4	156.9	-68.7	-168.3	177.5	-165.9	0	106.8
100	A	54.3	Low	68.9	Low	25 Å²	25	68 Å²	68	21%	0.207	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	-28.2	175.1	0	0	0	0	0	110.8	R63 D104	R63-A100 HydrophobicContact CG-CB 4.5Å; A100-D104 HydrophobicContact CB-CB 4.2Å; A100-D104 PolarHBondContact N-O 3.23Å
101	D	59.3	Low	69	Low	105 Å²	105	61 Å²	61	56%	0.561	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-162.6	171.2	169	-86.5	-51.2	0	0	0	108.2	N103 D104	D101-N103 PolarHBondContact O-N 2.98Å; D101-D104 HydrophobicContact CB-CB 4.42Å; D101-D104 PolarHBondContact O-N 3.46Å
102	L	59.6	Low	69	Low	142 Å²	142	68.8 Å²	68.8	74%	0.743	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	-22.7	-173.7	-78.7	165.8	0	0	0	115.1
103	N	67	Low	69.3	Low	118 Å²	118	69.9 Å²	69.9	63%	0.631	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.9	-0.1	-176.8	-61.3	-45.6	0	0	0	113.9	N65 E66 D101	N65-N103 CarbonylContact C-O 3.57Å; N65-N103 WeakPolarHBondContact CA-O 3.45Å; E66-N103 PolarHBondContact N-O 3.29Å; D101-N103 PolarHBondContact O-N 2.98Å
104	D	71.7	Confident	70.2	Confident	51 Å²	51	75 Å²	75	27%	0.273	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	138.2	-173.6	-73.8	-9.1	0	0	0	111	V64 A100 D101	V64-D104 WeakPolarHBondContact O-CA 3.47Å; A100-D104 HydrophobicContact CB-CB 4.2Å; A100-D104 PolarHBondContact N-O 3.23Å; D101-D104 HydrophobicContact CB-CB 4.42Å; D101-D104 PolarHBondContact O-N 3.46Å
105	A	74.1	Confident	71.5	Confident	13 Å²	13	77.2 Å²	77.2	11%	0.107	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	153.9	174.3	0	0	0	0	0	110.8	V64 L69	V64-A105 HydrophobicContact CG2-CB 4.39Å; V64-A105 PolarHBondContact N-O 2.66Å; V64-A105 PolarHBondContact O-N 2.78Å; L69-A105 HydrophobicContact CB-CB 4.45Å; L69-A105 HydrophobicContact CD2-CB 3.43Å; L69-A105 VanDerWaalsContact CD2-CB 3.43Å; L69-A105 HydrophobicContact CG-CB 4.45Å
106	L	77.5	Confident	73.3	Confident	29 Å²	29	73.2 Å²	73.2	15%	0.152	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	124	175	-159.9	74.9	0	0	0	110.3	A61 R63 I98	A61-L106 HydrophobicContact CB-CD1 3.93Å; A61-L106 HydrophobicContact CB-CD2 3.94Å; A61-L106 HydrophobicContact CB-CG 4.03Å; R63-L106 HydrophobicContact CG-CD1 4.24Å; I98-L106 HydrophobicContact CB-CB 4.27Å; I98-L106 HydrophobicContact CD1-CD2 3.83Å; I98-L106 HydrophobicContact CG2-CB 3.95Å; I98-L106 HydrophobicContact CG2-CD2 4.05Å
107	L	85.4	Confident	75.1	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	125	172.2	-172.8	72.8	0	0	0	109.5	A61 V62 V64 L69 L72 M91 C93 L109 M124	A61-L107 WeakPolarHBondContact CA-O 3.5Å; V62-L107 PolarHBondContact N-O 3.39Å; V62-L107 PolarHBondContact O-N 3Å; V64-L107 HydrophobicContact CG1-CB 4.45Å; V64-L107 HydrophobicContact CG2-CB 4.14Å; L69-L107 HydrophobicContact CD1-CD1 4.18Å; L72-L107 HydrophobicContact CD1-CD2 4.27Å; M91-L107 HydrophobicContact CB-CD1 4.11Å; M91-L107 HydrophobicContact CE-CD1 4.08Å; M91-L107 HydrophobicContact CE-CD2 3.39Å; M91-L107 HydrophobicContact CE-CG 4.32Å; M91-L107 HydrophobicContact CG-CD2 4.35Å; C93-L107 HydrophobicContact CB-CD1 4.32Å; C93-L107 WeakPolarHBondContact SG-CD1 3.45Å; L107-L109 HydrophobicContact CD2-CD2 3.71Å; L107-L109 HydrophobicContact CG-CD2 4.19Å; L107-M124 HydrophobicContact CD2-CE 3.42Å; L107-M124 VanDerWaalsContact CD2-CE 3.42Å; L107-M124 HydrophobicContact CD2-SD 3.9Å
108	I	87.2	Confident	77.3	Confident	33 Å²	33	65.7 Å²	65.7	17%	0.169	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	118.2	175.6	-61	168.7	0	0	0	108.3	M59 M91 L92	M59-I108 HydrophobicContact CE-CG2 3.66Å; M91-I108 CarbonylContact C-O 3.59Å; L92-I108 HydrophobicContact CB-CB 4.09Å; L92-I108 PolarHBondContact N-O 2.78Å; L92-I108 PolarHBondContact O-N 3.24Å
109	L	91.1	Very high	79.1	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	135.7	173.4	-61.1	-175.9	0	0	0	109.4	M59 E60 V62 T89 R90 M91 L107 I117 A120 K121 M124	M59-L109 CarbonylContact C-O 3.55Å; M59-L109 VanDerWaalsContact CA-O 3.28Å; M59-L109 WeakPolarHBondContact CA-O 2.9Å; E60-L109 PolarHBondContact N-O 3.23Å; E60-L109 PolarHBondContact O-N 3.02Å; V62-L109 HydrophobicContact CG2-CD1 3.69Å; V62-L109 HydrophobicContact CG2-CG 4.09Å; T89-L109 HydrophobicContact CG2-CB 3.79Å; T89-L109 HydrophobicContact CG2-CD2 4.1Å; T89-L109 HydrophobicContact CG2-CG 4.38Å; R90-L109 WeakPolarHBondContact O-CA 3.2Å; M91-L109 HydrophobicContact CB-CD2 4.46Å; M91-L109 HydrophobicContact CG-CD2 3.72Å; L107-L109 HydrophobicContact CD2-CD2 3.71Å; L107-L109 HydrophobicContact CG-CD2 4.19Å; L109-I117 HydrophobicContact CB-CG2 4.11Å; L109-I117 HydrophobicContact CD1-CG2 4.01Å; L109-A120 HydrophobicContact CD1-CB 4.45Å; L109-K121 HydrophobicContact CD1-CG 3.85Å; L109-M124 HydrophobicContact CD1-SD 4.28Å; L109-M124 HydrophobicContact CD2-SD 4.15Å
110	T	90.5	Very high	80.9	Confident	19 Å²	19	57 Å²	57	12%	0.117	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	135.5	176.3	-175.6	0	0	0	0	112.6	C58 T89 R90 L92	C58-T110 WeakPolarHBondContact O-CA 2.86Å; C58-T110 PolarHBondContact O-OG1 3Å; C58-T110 VanDerWaalsContact O-OG1 3.07Å; T89-T110 CarbonylContact C-O 3.53Å; T89-T110 WeakPolarHBondContact CA-O 3.31Å; R90-T110 HydrophobicContact CB-CG2 3.68Å; R90-T110 PolarHBondContact N-O 2.77Å; R90-T110 PolarHBondContact O-N 3.23Å; L92-T110 HydrophobicContact CD1-CG2 4.33Å
111	A	90.3	Very high	82.6	Confident	5 Å²	5	59 Å²	59	4%	0.041	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	165.9	-179.1	0	0	0	0	0	111.6	P57 C58 T89 K113 N116 I117	P57-A111 CarbonylContact C-O 3.47Å; P57-A111 WeakPolarHBondContact CA-O 3.39Å; C58-A111 PolarHBondContact N-O 3.43Å; C58-A111 PolarHBondContact O-N 3.11Å; C58-A111 VanDerWaalsContact O-N 3.08Å; T89-A111 HydrophobicContact CG2-CB 4.48Å; A111-K113 VanDerWaalsContact C-N 3.29Å; A111-K113 PolarHBondContact O-N 3.04Å; A111-N116 HydrophobicContact CB-CB 3.52Å; A111-I117 HydrophobicContact CB-CG1 3.91Å
112	E	87.8	Confident	83.9	Confident	168 Å²	168	58.5 Å²	58.5	79%	0.785	30%	0.297	S	S	*	.	S	Bend	trans	-69.5	-26.8	175.6	-64.9	-176.8	174	0	0	113.3
113	K	86.7	Confident	85.1	Confident	115 Å²	115	52 Å²	52	50%	0.5	26%	0.263	S	S	.	.	S	Bend	trans	-130.8	145	-177.7	-61.2	-178.8	-179.4	-178.6	0	110.2	A111 E115 N116	A111-K113 VanDerWaalsContact C-N 3.29Å; A111-K113 PolarHBondContact O-N 3.04Å; K113-E115 VanDerWaalsContact C-N 3.28Å; K113-E115 PolarHBondContact O-N 3.26Å; K113-N116 WeakPolarHBondContact O-CB 3.44Å; K113-N116 PolarHBondContact O-N 3Å
114	E	86.8	Confident	86	Confident	146 Å²	146	46.7 Å²	46.7	68%	0.682	23%	0.234	S	C	*	.	H	α-helix	trans	-62.8	-35.2	176.6	-171.4	174.9	177.9	0	0	112.3	N116 I117 A118	E114-N116 PolarHBondContact O-N 3.23Å; E114-I117 WeakPolarHBondContact O-CB 3.39Å; E114-I117 PolarHBondContact O-N 2.93Å; E114-A118 PolarHBondContact O-N 3.02Å; E114-A118 VanDerWaalsContact O-N 3.09Å
115	E	87.7	Confident	86.5	Confident	126 Å²	126	46.7 Å²	46.7	59%	0.589	24%	0.241	S	C	*	.	H	α-helix	trans	-54.5	-38.7	174.8	-65.2	171.3	-176.2	0	0	112.2	K113 I117 A118 V119	K113-E115 VanDerWaalsContact C-N 3.28Å; K113-E115 PolarHBondContact O-N 3.26Å; E115-I117 VanDerWaalsContact C-N 3.31Å; E115-I117 PolarHBondContact O-N 2.82Å; E115-A118 WeakPolarHBondContact O-CB 3.49Å; E115-A118 PolarHBondContact O-N 3.07Å; E115-V119 WeakPolarHBondContact O-CG2 3.35Å; E115-V119 PolarHBondContact O-N 3.12Å
116	N	88.4	Confident	86.7	Confident	16 Å²	16	47.8 Å²	47.8	9%	0.086	25%	0.245	C	C	.	.	H	α-helix	trans	-64.2	-37.3	178	-66.7	14.7	0	0	0	111.7	T87 T89 A111 K113 E114 A120 M154	T87-N116 WeakPolarHBondContact O-CB 3.19Å; T87-N116 PolarHBondContact O-ND2 2.88Å; T89-N116 PolarHBondContact OG1-O 2.91Å; A111-N116 HydrophobicContact CB-CB 3.52Å; K113-N116 WeakPolarHBondContact O-CB 3.44Å; K113-N116 PolarHBondContact O-N 3Å; E114-N116 PolarHBondContact O-N 3.23Å; N116-A120 WeakPolarHBondContact O-CB 3.26Å; N116-A120 PolarHBondContact O-N 2.78Å; N116-M154 WeakPolarHBondContact OD1-CE 3.48Å
117	I	89.2	Confident	86.8	Confident	3 Å²	3	46.7 Å²	46.7	2%	0.015	24%	0.239	C	C	.	.	H	α-helix	trans	-67.5	-42.2	176.8	-61.9	180	0	0	0	109.7	C58 E60 T89 L109 A111 E114 E115 A120 K121	C58-I117 HydrophobicContact CB-CD1 3.63Å; E60-I117 HydrophobicContact CB-CD1 4.31Å; E60-I117 HydrophobicContact CB-CG2 3.98Å; E60-I117 WeakPolarHBondContact OE2-CG2 3.39Å; T89-I117 HydrophobicContact CG2-CG1 4.42Å; L109-I117 HydrophobicContact CB-CG2 4.11Å; L109-I117 HydrophobicContact CD1-CG2 4.01Å; A111-I117 HydrophobicContact CB-CG1 3.91Å; E114-I117 WeakPolarHBondContact O-CB 3.39Å; E114-I117 PolarHBondContact O-N 2.93Å; E115-I117 VanDerWaalsContact C-N 3.31Å; E115-I117 PolarHBondContact O-N 2.82Å; I117-A120 PolarHBondContact O-N 2.94Å; I117-K121 HydrophobicContact CG2-CD 4.4Å; I117-K121 WeakPolarHBondContact O-CG 3.48Å; I117-K121 PolarHBondContact O-N 2.7Å
118	A	88.8	Confident	86.3	Confident	50 Å²	50	50.1 Å²	50.1	41%	0.413	26%	0.26	S	S	.	.	H	α-helix	trans	-59.4	-47.7	175.7	0	0	0	0	0	111.6	E114 E115 A120 K121 E122	E114-A118 PolarHBondContact O-N 3.02Å; E114-A118 VanDerWaalsContact O-N 3.09Å; E115-A118 WeakPolarHBondContact O-CB 3.49Å; E115-A118 PolarHBondContact O-N 3.07Å; A118-A120 VanDerWaalsContact C-N 3.33Å; A118-A120 PolarHBondContact O-N 3.05Å; A118-K121 WeakPolarHBondContact O-CB 3.43Å; A118-K121 PolarHBondContact O-N 2.88Å; A118-E122 PolarHBondContact O-N 2.96Å
119	V	87.6	Confident	85.7	Confident	33 Å²	33	55.7 Å²	55.7	20%	0.2	29%	0.287	C	S	.	.	H	α-helix	trans	-62.6	-38.9	176.7	178.6	0	0	0	0	111.5	T87 E115 K121 E122 F123	T87-V119 HydrophobicContact CG2-CB 4.44Å; T87-V119 HydrophobicContact CG2-CG1 3.83Å; E115-V119 WeakPolarHBondContact O-CG2 3.35Å; E115-V119 PolarHBondContact O-N 3.12Å; V119-K121 PolarHBondContact O-N 2.66Å; V119-E122 PolarHBondContact O-N 3.07Å; V119-F123 WeakPolarHBondContact O-CB 3.46Å; V119-F123 PolarHBondContact O-N 3.27Å
120	A	88.8	Confident	84.6	Confident	0 Å²	0	61 Å²	61	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-63.1	-40.1	175.8	0	0	0	0	0	112.8	I83 T87 T89 L109 N116 I117 A118 F123 M124	I83-A120 HydrophobicContact CG2-CB 4.11Å; T87-A120 HydrophobicContact CG2-CB 4.15Å; T89-A120 HydrophobicContact CG2-CB 3.79Å; L109-A120 HydrophobicContact CD1-CB 4.45Å; N116-A120 WeakPolarHBondContact O-CB 3.26Å; N116-A120 PolarHBondContact O-N 2.78Å; I117-A120 PolarHBondContact O-N 2.94Å; A118-A120 VanDerWaalsContact C-N 3.33Å; A118-A120 PolarHBondContact O-N 3.05Å; A120-F123 WeakPolarHBondContact O-CB 3.47Å; A120-F123 PolarHBondContact O-N 3.37Å; A120-M124 WeakPolarHBondContact O-CB 3.26Å; A120-M124 VanDerWaalsContact O-CG 3.26Å; A120-M124 WeakPolarHBondContact O-CG 3.44Å; A120-M124 PolarHBondContact O-N 2.86Å
121	K	89.1	Confident	83.4	Confident	66 Å²	66	67.4 Å²	67.4	29%	0.287	34%	0.34	S	S	.	.	H	α-helix	trans	-65.3	-43.3	174.7	-73.5	168	161.8	-177.5	0	112.4	E60 V62 L109 I117 A118 V119 F123 M124 A125	E60-K121 VanDerWaalsContact CD-CE 3.49Å; E60-K121 WeakPolarHBondContact OE1-CE 3.46Å; E60-K121 IonicContact OE1-NZ 2.82Å; E60-K121 PolarHBondContact OE1-NZ 3.4Å; E60-K121 WeakPolarHBondContact OE2-CE 3.27Å; E60-K121 IonicContact OE2-NZ 3.29Å; E60-K121 PolarHBondContact OE2-NZ 3.23Å; V62-K121 HydrophobicContact CG2-CG 4.33Å; L109-K121 HydrophobicContact CD1-CG 3.85Å; I117-K121 HydrophobicContact CG2-CD 4.4Å; I117-K121 WeakPolarHBondContact O-CG 3.48Å; I117-K121 PolarHBondContact O-N 2.7Å; A118-K121 WeakPolarHBondContact O-CB 3.43Å; A118-K121 PolarHBondContact O-N 2.88Å; V119-K121 PolarHBondContact O-N 2.66Å; K121-F123 VanDerWaalsContact C-N 3.3Å; K121-F123 PolarHBondContact O-N 3.49Å; K121-M124 PolarHBondContact O-N 2.94Å; K121-A125 WeakPolarHBondContact O-CB 3.39Å; K121-A125 PolarHBondContact O-N 3.31Å
122	E	86.9	Confident	82	Confident	95 Å²	95	68.3 Å²	68.3	44%	0.444	34%	0.344	S	S	.	.	H	α-helix	trans	-60.4	-43.7	174.3	-70.9	-179.7	166.3	0	0	110.9	A118 V119 M124 A125 I126 T157	A118-E122 PolarHBondContact O-N 2.96Å; V119-E122 PolarHBondContact O-N 3.07Å; E122-M124 PolarHBondContact O-N 2.56Å; E122-A125 PolarHBondContact O-N 3.26Å; E122-I126 WeakPolarHBondContact O-CG1 3.41Å; E122-I126 PolarHBondContact O-N 2.89Å; E122-T157 WeakPolarHBondContact OE2-CG2 3.34Å
123	F	84.1	Confident	80.5	Confident	5 Å²	5	67.9 Å²	67.9	2%	0.022	34%	0.34	C	S	.	.	H	α-helix	trans	-59.5	-46.3	175.1	-165.8	-85.1	0	0	0	111.6	V82 I83 V119 A120 K121 A125 I126 L127 V160 W164	V82-F123 HydrophobicContact CG1-CE1 4.29Å; V82-F123 HydrophobicContact CG1-CZ 3.85Å; I83-F123 HydrophobicContact CD1-CD1 4.23Å; I83-F123 HydrophobicContact CG1-CD1 3.53Å; I83-F123 HydrophobicContact CG1-CE1 3.69Å; V119-F123 WeakPolarHBondContact O-CB 3.46Å; V119-F123 PolarHBondContact O-N 3.27Å; A120-F123 WeakPolarHBondContact O-CB 3.47Å; A120-F123 PolarHBondContact O-N 3.37Å; K121-F123 VanDerWaalsContact C-N 3.3Å; K121-F123 PolarHBondContact O-N 3.49Å; F123-A125 VanDerWaalsContact C-N 3.34Å; F123-A125 PolarHBondContact O-N 2.98Å; F123-I126 PolarHBondContact O-N 3.21Å; F123-L127 HydrophobicContact CD1-CD1 3.83Å; F123-L127 HydrophobicContact CD1-CG 3.99Å; F123-L127 HydrophobicContact CE1-CD1 3.78Å; F123-L127 HydrophobicContact CE1-CD2 4.09Å; F123-L127 HydrophobicContact CE1-CG 3.93Å; F123-L127 WeakPolarHBondContact O-CG 3.04Å; F123-L127 PolarHBondContact O-N 3.03Å; F123-V160 HydrophobicContact CD2-CG1 3.56Å; F123-V160 HydrophobicContact CE2-CG1 3.75Å; F123-W164 HydrophobicContact CE1-CZ2 4.27Å; F123-W164 AromaticContact CE2-NE1 3.46Å; F123-W164 AromaticContact CZ-CE2 3.92Å; F123-W164 AromaticContact CZ-CZ2 3.79Å; F123-W164 HydrophobicContact CZ-CZ2 3.79Å; F123-W164 AromaticContact CZ-NE1 3.48Å
124	M	85.7	Confident	78.9	Confident	8 Å²	8	63.4 Å²	63.4	4%	0.039	32%	0.322	C	S	.	.	H	α-helix	trans	-63.3	-37.3	176.3	-73.4	171.3	62.3	0	0	112.8	V64 F68 L72 I83 L107 L109 A120 K121 E122 L127 T128	V64-M124 HydrophobicContact CG1-CE 3.65Å; F68-M124 HydrophobicContact CE1-CB 4.13Å; F68-M124 HydrophobicContact CE1-CE 3.74Å; F68-M124 HydrophobicContact CE1-CG 4.34Å; F68-M124 HydrophobicContact CZ-CB 4.06Å; F68-M124 HydrophobicContact CZ-CG 4.34Å; F68-M124 WeakPolarHBondContact CZ-O 3.21Å; L72-M124 HydrophobicContact CD1-CE 4.22Å; I83-M124 HydrophobicContact CD1-CG 3.95Å; L107-M124 HydrophobicContact CD2-CE 3.42Å; L107-M124 VanDerWaalsContact CD2-CE 3.42Å; L107-M124 HydrophobicContact CD2-SD 3.9Å; L109-M124 HydrophobicContact CD1-SD 4.28Å; L109-M124 HydrophobicContact CD2-SD 4.15Å; A120-M124 WeakPolarHBondContact O-CB 3.26Å; A120-M124 VanDerWaalsContact O-CG 3.26Å; A120-M124 WeakPolarHBondContact O-CG 3.44Å; A120-M124 PolarHBondContact O-N 2.86Å; K121-M124 PolarHBondContact O-N 2.94Å; E122-M124 PolarHBondContact O-N 2.56Å; M124-L127 PolarHBondContact O-N 2.96Å; M124-T128 WeakPolarHBondContact O-CB 3.22Å; M124-T128 PolarHBondContact O-N 3.04Å; M124-T128 PolarHBondContact O-OG1 3.39Å
125	A	83.4	Confident	77.3	Confident	50 Å²	50	63.1 Å²	63.1	41%	0.413	33%	0.326	S	S	.	.	H	α-helix	trans	-63.8	-43.2	175.7	0	0	0	0	0	111.3	K121 E122 F123 T128 M129	K121-A125 WeakPolarHBondContact O-CB 3.39Å; K121-A125 PolarHBondContact O-N 3.31Å; E122-A125 PolarHBondContact O-N 3.26Å; F123-A125 VanDerWaalsContact C-N 3.34Å; F123-A125 PolarHBondContact O-N 2.98Å; A125-T128 PolarHBondContact O-N 3.42Å; A125-M129 WeakPolarHBondContact O-CB 3.19Å; A125-M129 WeakPolarHBondContact O-CG 3.13Å; A125-M129 PolarHBondContact O-N 3.34Å
126	I	78.3	Confident	75.6	Confident	37 Å²	37	63.3 Å²	63.3	19%	0.19	33%	0.33	C	S	.	.	H	α-helix	trans	-60.4	-47	174.4	-67.1	167.4	0	0	0	110.7	E122 F123 T128 M129 H130 V160	E122-I126 WeakPolarHBondContact O-CG1 3.41Å; E122-I126 PolarHBondContact O-N 2.89Å; F123-I126 PolarHBondContact O-N 3.21Å; I126-T128 VanDerWaalsContact C-N 3.27Å; I126-T128 PolarHBondContact O-N 2.97Å; I126-M129 PolarHBondContact O-N 2.87Å; I126-H130 PolarHBondContact O-CD2 3.26Å; I126-H130 PolarHBondContact O-N 3.27Å; I126-H130 VanDerWaalsContact O-N 3.07Å; I126-V160 HydrophobicContact CD1-CG1 4.31Å
127	L	78.8	Confident	74	Confident	6 Å²	6	62.9 Å²	62.9	3%	0.031	33%	0.328	C	S	.	.	H	α-helix	trans	-57.9	-41.9	177.2	-70.9	179.2	0	0	0	112	F68 L72 I79 I83 F123 M124 E131 I132 W164	F68-L127 HydrophobicContact CE2-CB 3.79Å; F68-L127 HydrophobicContact CE2-CD1 4.49Å; F68-L127 HydrophobicContact CZ-CB 4.02Å; F68-L127 HydrophobicContact CZ-CD1 4.32Å; L72-L127 HydrophobicContact CD2-CD1 4.16Å; I79-L127 HydrophobicContact CG2-CD1 3.51Å; I83-L127 HydrophobicContact CD1-CD1 4.07Å; F123-L127 HydrophobicContact CD1-CD1 3.83Å; F123-L127 HydrophobicContact CD1-CG 3.99Å; F123-L127 HydrophobicContact CE1-CD1 3.78Å; F123-L127 HydrophobicContact CE1-CD2 4.09Å; F123-L127 HydrophobicContact CE1-CG 3.93Å; F123-L127 WeakPolarHBondContact O-CG 3.04Å; F123-L127 PolarHBondContact O-N 3.03Å; M124-L127 PolarHBondContact O-N 2.96Å; L127-E131 PolarHBondContact O-N 3.1Å; L127-I132 HydrophobicContact CD2-CB 4.4Å; L127-I132 HydrophobicContact CD2-CD1 3.96Å; L127-I132 HydrophobicContact CD2-CG1 4.46Å; L127-W164 HydrophobicContact CD2-CH2 3.93Å; L127-W164 HydrophobicContact CD2-CZ2 3.45Å; L127-W164 VanDerWaalsContact CD2-CZ2 3.45Å
128	T	75.2	Confident	72.4	Confident	71 Å²	71	65.5 Å²	65.5	44%	0.436	35%	0.346	S	S	.	.	H	α-helix	trans	-67.4	-45.4	179.9	-55.2	0	0	0	0	110.9	F68 M124 A125 I126 H130 E131	F68-T128 WeakPolarHBondContact CE2-OG1 3.35Å; F68-T128 WeakPolarHBondContact CZ-OG1 3.28Å; M124-T128 WeakPolarHBondContact O-CB 3.22Å; M124-T128 PolarHBondContact O-N 3.04Å; M124-T128 PolarHBondContact O-OG1 3.39Å; A125-T128 PolarHBondContact O-N 3.42Å; I126-T128 VanDerWaalsContact C-N 3.27Å; I126-T128 PolarHBondContact O-N 2.97Å; T128-H130 VanDerWaalsContact C-N 3.34Å; T128-H130 PolarHBondContact O-N 3.44Å; T128-E131 PolarHBondContact O-N 3.43Å
129	M	75	Confident	70.8	Confident	151 Å²	151	65.5 Å²	65.5	74%	0.744	34%	0.342	S	S	*	.	H	α-helix	trans	-62.9	-37.3	179.9	-80.8	-178.3	50	0	0	113.5	A125 I126	A125-M129 WeakPolarHBondContact O-CB 3.19Å; A125-M129 WeakPolarHBondContact O-CG 3.13Å; A125-M129 PolarHBondContact O-N 3.34Å; I126-M129 PolarHBondContact O-N 2.87Å
130	H	68	Low	69.3	Low	110 Å²	110	69 Å²	69	51%	0.509	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	4.7	-174.8	-73.9	-69.5	0	0	0	114.1	I126 T128 I132	I126-H130 PolarHBondContact O-CD2 3.26Å; I126-H130 PolarHBondContact O-N 3.27Å; I126-H130 VanDerWaalsContact O-N 3.07Å; T128-H130 VanDerWaalsContact C-N 3.34Å; T128-H130 PolarHBondContact O-N 3.44Å; H130-I132 HydrophobicContact CB-CD1 3.96Å; H130-I132 HydrophobicContact CB-CG1 3.49Å; H130-I132 VanDerWaalsContact CB-CG1 3.49Å; H130-I132 PolarHBondContact O-N 2.97Å
131	E	65.3	Low	67.7	Low	154 Å²	154	71.1 Å²	71.1	72%	0.72	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	43.2	39	-176	-61.2	-162.6	131.8	0	0	112.8	L127 T128 K133	L127-E131 PolarHBondContact O-N 3.1Å; T128-E131 PolarHBondContact O-N 3.43Å; E131-K133 PolarHBondContact O-N 3.36Å
132	I	60.3	Low	66	Low	25 Å²	25	68.2 Å²	68.2	13%	0.128	36%	0.358	C	S	.	.			trans	-61.1	117.4	-166.1	-56.4	-169.5	0	0	0	109.2	L127 H130 T134 W164	L127-I132 HydrophobicContact CD2-CB 4.4Å; L127-I132 HydrophobicContact CD2-CD1 3.96Å; L127-I132 HydrophobicContact CD2-CG1 4.46Å; H130-I132 HydrophobicContact CB-CD1 3.96Å; H130-I132 HydrophobicContact CB-CG1 3.49Å; H130-I132 VanDerWaalsContact CB-CG1 3.49Å; H130-I132 PolarHBondContact O-N 2.97Å; I132-T134 HydrophobicContact CG2-CG2 4.35Å; I132-T134 WeakPolarHBondContact O-CG2 3.35Å; I132-T134 PolarHBondContact O-N 3.3Å; I132-W164 HydrophobicContact CD1-CD2 4.07Å; I132-W164 HydrophobicContact CD1-CE3 3.88Å; I132-W164 HydrophobicContact CD1-CH2 3.78Å; I132-W164 HydrophobicContact CD1-CZ2 4.01Å; I132-W164 HydrophobicContact CD1-CZ3 3.73Å; I132-W164 HydrophobicContact CG2-CH2 3.88Å; I132-W164 HydrophobicContact CG2-CZ3 3.8Å
133	K	57	Low	64.6	Low	158 Å²	158	70 Å²	70	69%	0.687	36%	0.361	S	S	*	.			trans	-69.4	110.7	168.5	-69.1	-171.1	-179.5	-175.8	0	108.3	E131 D135	E131-K133 PolarHBondContact O-N 3.36Å; K133-D135 PolarHBondContact O-N 3.49Å
134	T	53.5	Low	63.2	Low	22 Å²	22	77.2 Å²	77.2	14%	0.135	39%	0.392	C	S	.	.	G	3₁₀ helix	trans	-86.5	-2.3	-169.2	53.4	0	0	0	0	113.4	I79 I132 N136 I137	I79-T134 VanDerWaalsContact CD1-CB 3.45Å; I79-T134 HydrophobicContact CD1-CG2 2.99Å; I79-T134 HydrophobicContact CG1-CG2 3.47Å; I79-T134 VanDerWaalsContact CG1-CG2 3.47Å; I132-T134 HydrophobicContact CG2-CG2 4.35Å; I132-T134 WeakPolarHBondContact O-CG2 3.35Å; I132-T134 PolarHBondContact O-N 3.3Å; T134-N136 PolarHBondContact O-N 2.83Å; T134-N136 VanDerWaalsContact O-N 3.1Å; T134-I137 HydrophobicContact CG2-CD1 3.62Å; T134-I137 PolarHBondContact O-N 2.93Å
135	D	51.9	Low	61.7	Low	140 Å²	140	78.7 Å²	78.7	75%	0.749	40%	0.403	S	S	*	.	G	3₁₀ helix	trans	-54.9	-24.6	170	-51.2	-35	0	0	0	112.4	K133	K133-D135 PolarHBondContact O-N 3.49Å
136	N	51.7	Low	60	Low	129 Å²	129	80.2 Å²	80.2	69%	0.69	40%	0.4	S	S	*	.	G	3₁₀ helix	trans	-93.4	-2.2	-179.4	-64.9	-27.9	0	0	0	114.3	T134 C138	T134-N136 PolarHBondContact O-N 2.83Å; T134-N136 VanDerWaalsContact O-N 3.1Å; N136-C138 PolarHBondContact O-N 3.34Å
137	I	56	Low	58.5	Low	8 Å²	8	85.6 Å²	85.6	4%	0.041	43%	0.427	C	S	.	.			trans	-86.6	104.8	-177.8	-54.2	169.5	0	0	0	109.1	I79 V82 T134 P139 W164	I79-I137 HydrophobicContact CG1-CD1 4.44Å; V82-I137 HydrophobicContact CG2-CG2 3.85Å; T134-I137 HydrophobicContact CG2-CD1 3.62Å; T134-I137 PolarHBondContact O-N 2.93Å; I137-P139 WeakPolarHBondContact O-CD 3.47Å; I137-W164 HydrophobicContact CD1-CH2 3.61Å; I137-W164 HydrophobicContact CD1-CZ3 4.36Å; I137-W164 HydrophobicContact CG1-CH2 4.12Å; I137-W164 HydrophobicContact CG1-CZ3 4.41Å
138	C	55	Low	57	Low	58 Å²	58	88.6 Å²	88.6	39%	0.392	46%	0.459	S	S	.	.			trans	-85.3	113.8	173.9	177.3	0	0	0	0	110.5	N136 E140 C141 C142	N136-C138 PolarHBondContact O-N 3.34Å; C138-E140 PolarHBondContact O-N 2.89Å; C138-C141 HydrophobicContact CB-CB 3.89Å; C138-C141 WeakPolarHBondContact O-CB 3.38Å; C138-C141 PolarHBondContact O-N 3.26Å; C138-C142 PolarHBondContact O-N 3.2Å
139	P	54.8	Low	55.5	Low	49 Å²	49	87.1 Å²	87.1	32%	0.318	45%	0.451	S	S	.	.	H	α-helix	trans	-58.9	-34.3	-178.9	-24.2	34.5	0	0	0	113.3	N78 I137 C142 R143	N78-P139 HydrophobicContact CB-CG 4.35Å; N78-P139 VanDerWaalsContact OD1-CG 3.31Å; N78-P139 WeakPolarHBondContact OD1-CG 3.38Å; I137-P139 WeakPolarHBondContact O-CD 3.47Å; P139-C142 WeakPolarHBondContact O-CB 3.33Å; P139-C142 PolarHBondContact O-N 3.42Å; P139-R143 PolarHBondContact O-N 3.46Å
140	E	57	Low	53.7	Low	107 Å²	107	85 Å²	85	50%	0.5	45%	0.452	S	S	.	.	H	α-helix	trans	-68.7	-36.6	176.3	-71.4	-60.1	134.9	0	0	112.2	C138 C142 R143 K144	C138-E140 PolarHBondContact O-N 2.89Å; E140-C142 VanDerWaalsContact C-N 3.32Å; E140-R143 PolarHBondContact O-N 3.02Å; E140-K144 WeakPolarHBondContact O-CG 3.45Å; E140-K144 PolarHBondContact O-N 3.1Å
141	C	55.7	Low	52.2	Low	44 Å²	44	83.1 Å²	83.1	30%	0.297	44%	0.444	S	S	.	.	H	α-helix	trans	-64.5	-40.9	170.4	-71.4	0	0	0	0	110.7	C138 R143 K144 S145	C138-C141 HydrophobicContact CB-CB 3.89Å; C138-C141 WeakPolarHBondContact O-CB 3.38Å; C138-C141 PolarHBondContact O-N 3.26Å; C141-R143 VanDerWaalsContact C-N 3.3Å; C141-R143 PolarHBondContact O-N 3.01Å; C141-K144 PolarHBondContact O-N 3.48Å; C141-S145 PolarHBondContact O-N 3.01Å; C141-S145 PolarHBondContact O-OG 2.68Å; C141-S145 VanDerWaalsContact O-OG 3.11Å
142	C	52.9	Low	51	Low	5 Å²	5	84.5 Å²	84.5	3%	0.034	45%	0.451	C	S	.	.	H	α-helix	trans	-60.2	-42.6	176.4	-67.5	0	0	0	0	112.2	C138 P139 E140 S145 K146 Y163	C138-C142 PolarHBondContact O-N 3.2Å; P139-C142 WeakPolarHBondContact O-CB 3.33Å; P139-C142 PolarHBondContact O-N 3.42Å; E140-C142 VanDerWaalsContact C-N 3.32Å; C142-S145 PolarHBondContact O-N 3.23Å; C142-K146 PolarHBondContact O-N 3.47Å; C142-Y163 WeakPolarHBondContact CA-OH 3.39Å; C142-Y163 PolarHBondContact O-OH 2.87Å
143	R	57.1	Low	50	Low	134 Å²	134	88.8 Å²	88.8	51%	0.506	48%	0.478	S	S	.	.	H	α-helix	trans	-63.9	-44.3	177.7	-164.5	179.7	-167.8	167.4	4.3	112.6	Y85 P139 E140 C141 M147	Y85-R143 PolarHBondContact OH-O 3.31Å; P139-R143 PolarHBondContact O-N 3.46Å; E140-R143 PolarHBondContact O-N 3.02Å; C141-R143 VanDerWaalsContact C-N 3.3Å; C141-R143 PolarHBondContact O-N 3.01Å; R143-M147 PolarHBondContact O-N 3.47Å
144	K	55.6	Low	49.2	Very low	156 Å²	156	86.2 Å²	86.2	68%	0.678	47%	0.47	S	S	*	.	H	α-helix	trans	-64.4	-38.4	177.9	-75.1	-178.6	179.7	-177.7	0	112.2	E140 C141 M147 G148	E140-K144 WeakPolarHBondContact O-CG 3.45Å; E140-K144 PolarHBondContact O-N 3.1Å; C141-K144 PolarHBondContact O-N 3.48Å; K144-M147 PolarHBondContact O-N 3.35Å; K144-G148 PolarHBondContact O-N 2.97Å
145	S	52.7	Low	48.7	Very low	39 Å²	39	86.1 Å²	86.1	27%	0.273	47%	0.47	S	S	.	.	H	α-helix	trans	-67.6	-39.1	-178.3	-60.9	0	0	0	0	113.1	C141 C142 M147 G148 S149 Y163	C141-S145 PolarHBondContact O-N 3.01Å; C141-S145 PolarHBondContact O-OG 2.68Å; C141-S145 VanDerWaalsContact O-OG 3.11Å; C142-S145 PolarHBondContact O-N 3.23Å; S145-M147 VanDerWaalsContact C-N 3.34Å; S145-G148 PolarHBondContact O-N 3.22Å; S145-S149 PolarHBondContact O-N 3.3Å; S145-S149 PolarHBondContact O-OG 3.29Å; S145-Y163 VanDerWaalsContact CB-CE2 3.48Å
146	K	49.4	Very low	48.5	Very low	81 Å²	81	82.8 Å²	82.8	35%	0.352	46%	0.457	S	S	.	.	H	α-helix	trans	-73.6	-24.7	175.8	-168.4	-176.8	-173.8	176	0	112.8	Y85 C142	Y85-K146 HydrophobicContact CD1-CD 4.02Å; Y85-K146 HydrophobicContact CD2-CD 4.49Å; Y85-K146 HydrophobicContact CE1-CB 3.56Å; Y85-K146 HydrophobicContact CE1-CD 3.26Å; Y85-K146 HydrophobicContact CE1-CG 4.02Å; Y85-K146 HydrophobicContact CE2-CD 3.79Å; Y85-K146 PolarHBondContact O-NZ 3.37Å; Y85-K146 WeakPolarHBondContact OH-CB 3.4Å; Y85-K146 VanDerWaalsContact OH-CD 3.28Å; Y85-K146 WeakPolarHBondContact OH-CD 3.41Å; C142-K146 PolarHBondContact O-N 3.47Å
147	M	46.4	Very low	48.2	Very low	151 Å²	151	80.5 Å²	80.5	74%	0.744	45%	0.448	S	S	*	.	H	α-helix	trans	-75.8	-27.8	170.2	-74.7	-173.5	167	0	0	112.4	R143 K144 S145	R143-M147 PolarHBondContact O-N 3.47Å; K144-M147 PolarHBondContact O-N 3.35Å; S145-M147 VanDerWaalsContact C-N 3.34Å
148	G	46.4	Very low	47.9	Very low	69 Å²	69	83.1 Å²	83.1	71%	0.711	47%	0.467	S	S	*	.	H	α-helix	trans	-82.9	-32.1	176.8	0	0	0	0	0	113.9	K144 S145	K144-G148 PolarHBondContact O-N 2.97Å; S145-G148 PolarHBondContact O-N 3.22Å
149	S	43.1	Very low	47.8	Very low	39 Å²	39	81 Å²	81	27%	0.273	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	113.1	169.8	61.1	0	0	0	0	108.7	S145 M151	S145-S149 PolarHBondContact O-N 3.3Å; S145-S149 PolarHBondContact O-OG 3.29Å; S149-M151 PolarHBondContact O-N 2.81Å
150	S	37.7	Very low	47.6	Very low	108 Å²	108	79.2 Å²	79.2	76%	0.755	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	70.3	163.3	-174.4	0	0	0	0	110	E152	S150-E152 VanDerWaalsContact C-N 3.27Å; S150-E152 PolarHBondContact O-N 2.85Å
151	M	38	Very low	47.4	Very low	69 Å²	69	79.5 Å²	79.5	34%	0.34	44%	0.442	S	S	.	.			trans	-86.9	75.1	172.2	-84.9	-175.5	167.6	0	0	107.1	S149 T153 P155	S149-M151 PolarHBondContact O-N 2.81Å; M151-T153 PolarHBondContact O-N 3.06Å; M151-P155 HydrophobicContact CE-CB 4.39Å
152	E	39.2	Very low	47.3	Very low	184 Å²	184	83.3 Å²	83.3	86%	0.86	46%	0.456	S	S	*	.			trans	-72.6	-3.3	162.7	-70.1	-170.8	127.9	0	0	111.6	S150	S150-E152 VanDerWaalsContact C-N 3.27Å; S150-E152 PolarHBondContact O-N 2.85Å
153	T	39.7	Very low	47.5	Very low	115 Å²	115	83.8 Å²	83.8	71%	0.706	46%	0.457	S	S	*	.	S	Bend	trans	-124.2	133.3	-179	-19.5	0	0	0	0	109.6	M151	M151-T153 PolarHBondContact O-N 3.06Å
154	M	40.1	Very low	47.4	Very low	104 Å²	104	78 Å²	78	51%	0.512	44%	0.435	S	S	.	.			trans	-47.9	140	174.7	-90.4	-176.5	174	0	0	111.2	N116 S156	N116-M154 WeakPolarHBondContact OD1-CE 3.48Å; M154-S156 PolarHBondContact O-N 2.8Å; M154-S156 VanDerWaalsContact O-N 3.09Å
155	P	42.8	Very low	47.5	Very low	20 Å²	20	74.5 Å²	74.5	13%	0.13	42%	0.424	C	S	.	.			trans	-67.6	114.4	177.3	27.3	-31.5	0	0	0	109.5	M151 S159 V160	M151-P155 HydrophobicContact CE-CB 4.39Å; P155-S159 WeakPolarHBondContact CA-OG 2.96Å; P155-S159 WeakPolarHBondContact CB-OG 3.44Å; P155-V160 HydrophobicContact CB-CG2 3.9Å; P155-V160 HydrophobicContact CG-CG2 4.12Å
156	S	47.9	Very low	47.7	Very low	70 Å²	70	79.3 Å²	79.3	49%	0.49	44%	0.442	S	S	.	.			trans	-58.5	154.4	161.4	57.5	0	0	0	0	109.2	M154 S158 S159 V160	M154-S156 PolarHBondContact O-N 2.8Å; M154-S156 VanDerWaalsContact O-N 3.09Å; S156-S158 PolarHBondContact O-N 2.92Å; S156-S158 PolarHBondContact OG-OG 2.83Å; S156-S158 VanDerWaalsContact OG-OG 3.05Å; S156-S159 PolarHBondContact N-OG 3.01Å; S156-S159 WeakPolarHBondContact O-CA 3.4Å; S156-S159 PolarHBondContact O-N 3.42Å; S156-S159 PolarHBondContact O-OG 3.1Å; S156-V160 PolarHBondContact O-N 3.21Å
157	T	45.6	Very low	47.8	Very low	80 Å²	80	77.1 Å²	77.1	49%	0.491	43%	0.434	S	S	.	.	H	α-helix	trans	-44	-36	179	41.3	0	0	0	0	114	E122 Q161	E122-T157 WeakPolarHBondContact OE2-CG2 3.34Å; T157-Q161 PolarHBondContact O-N 3.3Å
158	S	49.8	Very low	48.1	Very low	64 Å²	64	74.5 Å²	74.5	45%	0.448	42%	0.422	S	S	.	.	H	α-helix	trans	-65.8	-37.9	175.9	58.7	0	0	0	0	113.8	S156 Q161 Q162	S156-S158 PolarHBondContact O-N 2.92Å; S156-S158 PolarHBondContact OG-OG 2.83Å; S156-S158 VanDerWaalsContact OG-OG 3.05Å; S158-Q161 PolarHBondContact O-N 3.4Å; S158-Q162 WeakPolarHBondContact O-CG 3.47Å; S158-Q162 PolarHBondContact O-N 3.23Å
159	S	51.8	Low	48.2	Very low	14 Å²	14	78.8 Å²	78.8	10%	0.098	42%	0.421	C	S	.	.	H	α-helix	trans	-75.4	-29.8	179.3	66.3	0	0	0	0	113.1	P155 S156 Q161 Q162 Y163	P155-S159 WeakPolarHBondContact CA-OG 2.96Å; P155-S159 WeakPolarHBondContact CB-OG 3.44Å; S156-S159 PolarHBondContact N-OG 3.01Å; S156-S159 WeakPolarHBondContact O-CA 3.4Å; S156-S159 PolarHBondContact O-N 3.42Å; S156-S159 PolarHBondContact O-OG 3.1Å; S159-Q161 VanDerWaalsContact C-N 3.32Å; S159-Q162 PolarHBondContact O-N 3.2Å; S159-Y163 VanDerWaalsContact O-CB 3.22Å; S159-Y163 WeakPolarHBondContact O-CB 3.33Å; S159-Y163 PolarHBondContact O-N 3Å
160	V	51.7	Low	48.4	Very low	11 Å²	11	84.2 Å²	84.2	7%	0.067	44%	0.44	C	S	.	.	H	α-helix	trans	-60.8	-44.9	168.5	175.2	0	0	0	0	110	F123 I126 P155 S156 Y163 W164	F123-V160 HydrophobicContact CD2-CG1 3.56Å; F123-V160 HydrophobicContact CE2-CG1 3.75Å; I126-V160 HydrophobicContact CD1-CG1 4.31Å; P155-V160 HydrophobicContact CB-CG2 3.9Å; P155-V160 HydrophobicContact CG-CG2 4.12Å; S156-V160 PolarHBondContact O-N 3.21Å; V160-Y163 WeakPolarHBondContact O-CB 3.02Å; V160-Y163 PolarHBondContact O-N 3.25Å; V160-W164 VanDerWaalsContact O-CD1 3.24Å; V160-W164 PolarHBondContact O-N 3.35Å
161	Q	51	Low	48.5	Very low	112 Å²	112	83.7 Å²	83.7	52%	0.523	43%	0.434	S	S	.	.	H	α-helix	trans	-68	-39.3	179.2	-150.8	176.8	13.7	0	0	112.3	T157 S158 S159 W164 N165	T157-Q161 PolarHBondContact O-N 3.3Å; S158-Q161 PolarHBondContact O-N 3.4Å; S159-Q161 VanDerWaalsContact C-N 3.32Å; Q161-W164 PolarHBondContact O-N 3.37Å; Q161-N165 PolarHBondContact O-N 3.32Å; Q161-N165 PolarHBondContact O-ND2 3.01Å
162	Q	55.5	Low	48.7	Very low	124 Å²	124	90.5 Å²	90.5	58%	0.579	46%	0.462	S	S	*	.	H	α-helix	trans	-63.7	-40.3	172.4	-75.1	179.8	-14.8	0	0	112.4	S158 S159 N165 Q166	S158-Q162 WeakPolarHBondContact O-CG 3.47Å; S158-Q162 PolarHBondContact O-N 3.23Å; S159-Q162 PolarHBondContact O-N 3.2Å; Q162-N165 WeakPolarHBondContact O-CB 3.49Å; Q162-N165 PolarHBondContact O-N 3.01Å; Q162-Q166 PolarHBondContact O-N 3.31Å; Q162-Q166 VanDerWaalsContact O-N 3.1Å
163	Y	56.1	Low	48.8	Very low	15 Å²	15	88.8 Å²	88.8	6%	0.059	46%	0.458	C	S	.	.	H	α-helix	trans	-63.2	-43.4	176.3	-176.9	-99.8	0	0	0	111.6	F86 C142 S145 S159 V160 N165 Q166 I167	F86-Y163 HydrophobicContact CD2-CE1 4.48Å; F86-Y163 HydrophobicContact CE1-CD1 4.28Å; F86-Y163 HydrophobicContact CE1-CD2 4.48Å; F86-Y163 AromaticContact CE1-CE1 3.94Å; F86-Y163 HydrophobicContact CE1-CE1 3.94Å; F86-Y163 HydrophobicContact CE1-CE2 4.17Å; F86-Y163 AromaticContact CE1-CZ 3.92Å; F86-Y163 HydrophobicContact CE2-CD1 4.28Å; F86-Y163 AromaticContact CE2-CE1 3.46Å; F86-Y163 HydrophobicContact CE2-CE1 3.46Å; F86-Y163 VanDerWaalsContact CE2-CE1 3.46Å; F86-Y163 AromaticContact CE2-CZ 3.82Å; F86-Y163 AromaticContact CZ-CD1 3.94Å; F86-Y163 HydrophobicContact CZ-CD1 3.94Å; F86-Y163 HydrophobicContact CZ-CD2 4.45Å; F86-Y163 AromaticContact CZ-CE1 3.19Å; F86-Y163 HydrophobicContact CZ-CE1 3.19Å; F86-Y163 AromaticContact CZ-CE2 3.81Å; F86-Y163 HydrophobicContact CZ-CE2 3.81Å; F86-Y163 AromaticContact CZ-CZ 3.14Å; F86-Y163 VanDerWaalsContact CZ-OH 3.22Å; F86-Y163 WeakPolarHBondContact CZ-OH 3.05Å; C142-Y163 WeakPolarHBondContact CA-OH 3.39Å; C142-Y163 PolarHBondContact O-OH 2.87Å; S145-Y163 VanDerWaalsContact CB-CE2 3.48Å; S159-Y163 VanDerWaalsContact O-CB 3.22Å; S159-Y163 WeakPolarHBondContact O-CB 3.33Å; S159-Y163 PolarHBondContact O-N 3Å; V160-Y163 WeakPolarHBondContact O-CB 3.02Å; V160-Y163 PolarHBondContact O-N 3.25Å; Y163-N165 VanDerWaalsContact C-N 3.33Å; Y163-N165 PolarHBondContact O-N 2.98Å; Y163-Q166 WeakPolarHBondContact O-CB 3.44Å; Y163-Q166 PolarHBondContact O-N 2.91Å; Y163-I167 HydrophobicContact CD1-CD1 3.85Å; Y163-I167 HydrophobicContact CD1-CG1 4.31Å; Y163-I167 HydrophobicContact CE1-CD1 3.07Å; Y163-I167 HydrophobicContact CE1-CG1 3.88Å; Y163-I167 HydrophobicContact CE2-CD1 4.41Å; Y163-I167 PolarHBondContact O-N 3.07Å; Y163-I167 WeakPolarHBondContact OH-CD1 3.28Å
164	W	55.4	Low	48.6	Very low	13 Å²	13	90.7 Å²	90.7	5%	0.049	50%	0.501	C	S	.	.	H	α-helix	trans	-60.5	-40.9	172.7	-88.7	110	0	0	0	112.7	F123 L127 I132 I137 V160 Q161 Q166 I167 L168	F123-W164 HydrophobicContact CE1-CZ2 4.27Å; F123-W164 AromaticContact CE2-NE1 3.46Å; F123-W164 AromaticContact CZ-CE2 3.92Å; F123-W164 AromaticContact CZ-CZ2 3.79Å; F123-W164 HydrophobicContact CZ-CZ2 3.79Å; F123-W164 AromaticContact CZ-NE1 3.48Å; L127-W164 HydrophobicContact CD2-CH2 3.93Å; L127-W164 HydrophobicContact CD2-CZ2 3.45Å; L127-W164 VanDerWaalsContact CD2-CZ2 3.45Å; I132-W164 HydrophobicContact CD1-CD2 4.07Å; I132-W164 HydrophobicContact CD1-CE3 3.88Å; I132-W164 HydrophobicContact CD1-CH2 3.78Å; I132-W164 HydrophobicContact CD1-CZ2 4.01Å; I132-W164 HydrophobicContact CD1-CZ3 3.73Å; I132-W164 HydrophobicContact CG2-CH2 3.88Å; I132-W164 HydrophobicContact CG2-CZ3 3.8Å; I137-W164 HydrophobicContact CD1-CH2 3.61Å; I137-W164 HydrophobicContact CD1-CZ3 4.36Å; I137-W164 HydrophobicContact CG1-CH2 4.12Å; I137-W164 HydrophobicContact CG1-CZ3 4.41Å; V160-W164 VanDerWaalsContact O-CD1 3.24Å; V160-W164 PolarHBondContact O-N 3.35Å; Q161-W164 PolarHBondContact O-N 3.37Å; W164-Q166 PolarHBondContact O-N 3.37Å; W164-I167 PolarHBondContact O-N 2.71Å; W164-L168 HydrophobicContact CB-CD1 4.39Å; W164-L168 HydrophobicContact CE3-CD1 3.68Å; W164-L168 HydrophobicContact CE3-CD2 4.07Å; W164-L168 HydrophobicContact CE3-CG 3.7Å; W164-L168 HydrophobicContact CZ3-CD1 4.36Å; W164-L168 HydrophobicContact CZ3-CD2 4.01Å; W164-L168 HydrophobicContact CZ3-CG 4.17Å; W164-L168 VanDerWaalsContact O-CB 3.26Å; W164-L168 WeakPolarHBondContact O-CB 3.43Å; W164-L168 VanDerWaalsContact O-CG 3.28Å; W164-L168 WeakPolarHBondContact O-CG 3.21Å; W164-L168 PolarHBondContact O-N 2.83Å
165	N	57.6	Low	49	Very low	83 Å²	83	90.1 Å²	90.1	44%	0.444	50%	0.501	S	S	.	.	H	α-helix	trans	-61.1	-30.8	172.8	-77.1	-42.2	0	0	0	112.5	Q161 Q162 Y163 K169	Q161-N165 PolarHBondContact O-N 3.32Å; Q161-N165 PolarHBondContact O-ND2 3.01Å; Q162-N165 WeakPolarHBondContact O-CB 3.49Å; Q162-N165 PolarHBondContact O-N 3.01Å; Y163-N165 VanDerWaalsContact C-N 3.33Å; Y163-N165 PolarHBondContact O-N 2.98Å; N165-K169 WeakPolarHBondContact O-CB 3.26Å; N165-K169 WeakPolarHBondContact O-CD 3.38Å; N165-K169 WeakPolarHBondContact O-CG 2.91Å; N165-K169 PolarHBondContact O-N 2.97Å
166	Q	57.1	Low	49.4	Very low	139 Å²	139	93.7 Å²	93.7	65%	0.65	52%	0.52	S	S	*	.	H	α-helix	trans	-77.1	-38.9	175	-70.4	-175	44.4	0	0	113	Q162 Y163 W164	Q162-Q166 PolarHBondContact O-N 3.31Å; Q162-Q166 VanDerWaalsContact O-N 3.1Å; Y163-Q166 WeakPolarHBondContact O-CB 3.44Å; Y163-Q166 PolarHBondContact O-N 2.91Å; W164-Q166 PolarHBondContact O-N 3.37Å
167	I	52.1	Low	49.4	Very low	35 Å²	35	95.1 Å²	95.1	18%	0.179	52%	0.522	C	S	.	.	H	α-helix	trans	-71	-41.4	178	-67.5	-168.4	0	0	0	111.5	Y163 W164	Y163-I167 HydrophobicContact CD1-CD1 3.85Å; Y163-I167 HydrophobicContact CD1-CG1 4.31Å; Y163-I167 HydrophobicContact CE1-CD1 3.07Å; Y163-I167 HydrophobicContact CE1-CG1 3.88Å; Y163-I167 HydrophobicContact CE2-CD1 4.41Å; Y163-I167 PolarHBondContact O-N 3.07Å; Y163-I167 WeakPolarHBondContact OH-CD1 3.28Å; W164-I167 PolarHBondContact O-N 2.71Å
168	L	51.1	Low	49.7	Very low	96 Å²	96	95.9 Å²	95.9	50%	0.503	52%	0.524	S	S	.	.	H	α-helix	trans	-79.4	-22.3	-177.5	-64.7	168.7	0	0	0	113.2	W164 K170	W164-L168 HydrophobicContact CB-CD1 4.39Å; W164-L168 HydrophobicContact CE3-CD1 3.68Å; W164-L168 HydrophobicContact CE3-CD2 4.07Å; W164-L168 HydrophobicContact CE3-CG 3.7Å; W164-L168 HydrophobicContact CZ3-CD1 4.36Å; W164-L168 HydrophobicContact CZ3-CD2 4.01Å; W164-L168 HydrophobicContact CZ3-CG 4.17Å; W164-L168 VanDerWaalsContact O-CB 3.26Å; W164-L168 WeakPolarHBondContact O-CB 3.43Å; W164-L168 VanDerWaalsContact O-CG 3.28Å; W164-L168 WeakPolarHBondContact O-CG 3.21Å; W164-L168 PolarHBondContact O-N 2.83Å; L168-K170 VanDerWaalsContact C-N 3.29Å; L168-K170 PolarHBondContact O-N 3.47Å
169	K	49.9	Very low	49.7	Very low	159 Å²	159	97.9 Å²	97.9	69%	0.691	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	10.9	177.8	-76	-179.4	178.8	-174.8	0	114.6	N165 P171	N165-K169 WeakPolarHBondContact O-CB 3.26Å; N165-K169 WeakPolarHBondContact O-CD 3.38Å; N165-K169 WeakPolarHBondContact O-CG 2.91Å; N165-K169 PolarHBondContact O-N 2.97Å; K169-P171 WeakPolarHBondContact O-CD 3.5Å; K169-P171 VanDerWaalsContact O-N 3.12Å
170	K	46	Very low	49.5	Very low	154 Å²	154	103.5 Å²	103.5	67%	0.67	56%	0.557	S	S	*	*			trans	-65.6	114.4	164	-79.2	-156.3	175.4	-171.9	0	108.5	L168	L168-K170 VanDerWaalsContact C-N 3.29Å; L168-K170 PolarHBondContact O-N 3.47Å
171	P	41.1	Very low	49.4	Very low	96 Å²	96	110.1 Å²	110.1	62%	0.623	59%	0.592	S	S	*	*			trans	-69.5	149.8	-174.8	-0.5	14.5	0	0	0	110.4	K169 D173	K169-P171 WeakPolarHBondContact O-CD 3.5Å; K169-P171 VanDerWaalsContact O-N 3.12Å; P171-D173 VanDerWaalsContact C-N 3.3Å; P171-D173 PolarHBondContact O-N 3.43Å
172	K	42.3	Very low	49.2	Very low	213 Å²	213	110 Å²	110	93%	0.926	60%	0.598	S	S	*	*			trans	-55.3	95	153.6	-70.8	176.7	173.4	177.6	0	108.1
173	D	39.7	Very low	48.7	Very low	147 Å²	147	108.8 Å²	108.8	79%	0.786	60%	0.599	S	S	*	*			trans	-135.1	102.6	165.1	-75.7	-48.1	0	0	0	107.2	P171	P171-D173 VanDerWaalsContact C-N 3.3Å; P171-D173 PolarHBondContact O-N 3.43Å
174	G	36.2	Very low	48	Very low	156 Å²	156	117.4 Å²	117.4	100%	1.608	65%	0.648	S	S	*	*			trans	145.6	0	-175.8	0	0	0	0	0	111.6

Retrieved 174 of 174 residues in 99 ms (Link to these results)

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