A0A077Z828_TRITR Loading...

E ubiquitin protein ligase march

AlphaFold DB , UniProt , Accession A0A077Z828, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 254 aa.

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(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	41.3	Very low	38	Very low	236 Å²	236	156.4 Å²	156.4	100%	1.163	81%	0.811	S	S	*	*				0	103.9	0	-83.7	161.2	84.8	0	0	106.5
2	Q	33.8	Very low	38.3	Very low	197 Å²	197	155.3 Å²	155.3	92%	0.921	81%	0.807	S	S	*	*			trans	-85.1	110.1	176	-87.6	162.9	-57.5	0	0	107.8	S4	Q2-S4 PolarHBondContact O-N 3.45Å
3	D	38.2	Very low	38.5	Very low	161 Å²	161	153.9 Å²	153.9	86%	0.861	79%	0.794	S	S	*	*			trans	-81	105.1	165.7	-76.6	-38.8	0	0	0	108.1	E5	D3-E5 PolarHBondContact O-N 3.24Å
4	S	41.5	Very low	38.6	Very low	107 Å²	107	151.4 Å²	151.4	75%	0.748	78%	0.782	S	S	*	*			trans	-80.6	105.9	170.1	52.6	0	0	0	0	109.3	Q2 I6	Q2-S4 PolarHBondContact O-N 3.45Å; S4-I6 PolarHBondContact O-N 2.8Å
5	E	39.6	Very low	38.8	Very low	172 Å²	172	150.8 Å²	150.8	80%	0.804	77%	0.774	S	S	*	*			trans	-61	115.2	172.7	-165.3	-178.4	109.8	0	0	110.7	D3 Q7	D3-E5 PolarHBondContact O-N 3.24Å; E5-Q7 PolarHBondContact O-N 3.28Å
6	I	39.5	Very low	38.9	Very low	158 Å²	158	147.1 Å²	147.1	81%	0.81	77%	0.766	S	S	*	*			trans	-82.4	100.1	174.2	-60.6	174.2	0	0	0	107.9	S4	S4-I6 PolarHBondContact O-N 2.8Å
7	Q	36.5	Very low	38.8	Very low	155 Å²	155	148 Å²	148	72%	0.724	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-66.9	132.2	169.6	-84.2	175.9	-12.3	0	0	111.1	E5 L9	E5-Q7 PolarHBondContact O-N 3.28Å; Q7-L9 PolarHBondContact O-N 3.39Å
8	P	39.6	Very low	38.8	Very low	129 Å²	129	148 Å²	148	84%	0.838	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-74.7	116.4	172.8	28.5	-30.1	0	0	0	110.9
9	L	36.5	Very low	38.6	Very low	152 Å²	152	146.1 Å²	146.1	80%	0.796	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-52.9	130.5	178.5	-116	133.2	0	0	0	114.4	Q7 V11	Q7-L9 PolarHBondContact O-N 3.39Å; L9-V11 PolarHBondContact O-N 2.83Å
10	K	34	Very low	38.4	Very low	159 Å²	159	145.7 Å²	145.7	69%	0.691	77%	0.767	S	S	*	*			trans	8.1	89.9	150.5	-68.9	-179.6	159.1	-132.4	0	117.9	E13	K10-E13 IonicContact NZ-OE1 3.93Å; K10-E13 IonicContact NZ-OE2 2.8Å; K10-E13 PolarHBondContact NZ-OE2 3.28Å
11	V	38.2	Very low	38.2	Very low	94 Å²	94	146 Å²	146	57%	0.57	77%	0.769	S	S	*	*			trans	-113.6	-0.8	164.7	-175.9	0	0	0	0	112.7	L9 L123	L9-V11 PolarHBondContact O-N 2.83Å; V11-L123 HydrophobicContact CG1-CD2 3.93Å
12	L	41.6	Very low	37.7	Very low	144 Å²	144	139 Å²	139	75%	0.754	74%	0.743	S	S	*	*	G	3₁₀ helix	trans	-83.8	-9.2	-175.8	-74.2	166.5	0	0	0	115.4	L14	L12-L14 VanDerWaalsContact C-N 3.35Å; L12-L14 PolarHBondContact O-N 2.95Å
13	E	39.8	Very low	37.6	Very low	137 Å²	137	135 Å²	135	64%	0.64	74%	0.737	S	S	*	*	G	3₁₀ helix	trans	-87.7	5.9	-176.9	-77	174.6	102.6	0	0	114.2	K10	K10-E13 IonicContact NZ-OE1 3.93Å; K10-E13 IonicContact NZ-OE2 2.8Å; K10-E13 PolarHBondContact NZ-OE2 3.28Å
14	L	40	Very low	37.5	Very low	119 Å²	119	132.3 Å²	132.3	62%	0.623	73%	0.73	S	S	*	*	G	3₁₀ helix	trans	-114	-1.6	-176.4	-146.5	84.3	0	0	0	114.8	L12	L12-L14 VanDerWaalsContact C-N 3.35Å; L12-L14 PolarHBondContact O-N 2.95Å
15	E	41.8	Very low	37.1	Very low	142 Å²	142	138.7 Å²	138.7	66%	0.664	74%	0.738	S	S	*	*	G	3₁₀ helix	trans	-86.2	-4.4	179.1	-71.6	-171.9	109.3	0	0	113.6
16	S	40.1	Very low	36.8	Very low	92 Å²	92	139.3 Å²	139.3	64%	0.643	74%	0.741	S	S	*	*	G	3₁₀ helix	trans	-83.1	-6	-175.7	60.1	0	0	0	0	115.9
17	E	37.8	Very low	36.8	Very low	162 Å²	162	137.3 Å²	137.3	76%	0.757	74%	0.741	S	S	*	*	G	3₁₀ helix	trans	-113.7	15.7	-169	-64.1	-67	123.9	0	0	114.8
18	L	39.6	Very low	36.5	Very low	148 Å²	148	137.8 Å²	137.8	78%	0.775	75%	0.748	S	S	*	*			trans	-99.4	115.5	177.8	-75.2	172.6	0	0	0	112.2	V20	L18-V20 PolarHBondContact O-N 3.18Å
19	P	34.3	Very low	36.5	Very low	112 Å²	112	137.1 Å²	137.1	73%	0.727	75%	0.747	S	S	*	*			trans	-70.9	127.6	178.5	27.5	-31	0	0	0	110.6	L21	P19-L21 PolarHBondContact O-N 2.69Å
20	V	35	Very low	36.3	Very low	138 Å²	138	139 Å²	139	84%	0.836	75%	0.749	S	S	*	*			trans	-61.4	101.1	172.1	178.2	0	0	0	0	108.9	L18 S22	L18-V20 PolarHBondContact O-N 3.18Å; V20-S22 PolarHBondContact O-N 3.41Å
21	L	33.3	Very low	36.3	Very low	152 Å²	152	139.3 Å²	139.3	80%	0.796	76%	0.758	S	S	*	*			trans	-82.8	88.5	169.1	-105.3	157.8	0	0	0	108.6	P19 S23	P19-L21 PolarHBondContact O-N 2.69Å; L21-S23 PolarHBondContact O-N 3.18Å
22	S	32	Very low	36.1	Very low	90 Å²	90	143.7 Å²	143.7	63%	0.629	77%	0.77	S	S	*	*			trans	-69.9	110.4	161.6	52.9	0	0	0	0	109	V20 S24	V20-S22 PolarHBondContact O-N 3.41Å; S22-S24 PolarHBondContact O-N 3.26Å; S22-S24 VanDerWaalsContact O-N 3.15Å
23	S	31.8	Very low	35.8	Very low	113 Å²	113	141.7 Å²	141.7	79%	0.79	77%	0.768	S	S	*	*			trans	-77.2	91	169.6	58.5	0	0	0	0	109.9	L21 R25	L21-S23 PolarHBondContact O-N 3.18Å; S23-R25 PolarHBondContact O-N 3.47Å
24	S	34.2	Very low	35.8	Very low	103 Å²	103	141.6 Å²	141.6	72%	0.72	78%	0.777	S	S	*	*			trans	-77.7	105.9	160.7	-59.1	0	0	0	0	108.1	S22	S22-S24 PolarHBondContact O-N 3.26Å; S22-S24 VanDerWaalsContact O-N 3.15Å
25	R	33.6	Very low	35.5	Very low	242 Å²	242	144.1 Å²	144.1	91%	0.913	79%	0.791	S	S	*	*			trans	-90.4	100.4	161.5	-85.5	178.2	164.9	149.8	-4.9	106.7	S23	S23-R25 PolarHBondContact O-N 3.47Å
26	E	34.5	Very low	35.2	Very low	184 Å²	184	140.1 Å²	140.1	86%	0.86	79%	0.788	S	S	*	*			trans	-109.2	117.6	158.5	-77.3	-174.4	103.9	0	0	107.5
27	S	38.2	Very low	35	Very low	116 Å²	116	141.8 Å²	141.8	81%	0.811	79%	0.794	S	S	*	*			trans	-81.5	126.2	-180	34.5	0	0	0	0	110.4
28	D	30.6	Very low	35.1	Very low	165 Å²	165	142.3 Å²	142.3	88%	0.882	79%	0.794	S	S	*	*			trans	-57.4	126.6	167.2	-71.3	-52.6	0	0	0	112
29	S	39.9	Very low	34.8	Very low	116 Å²	116	142.8 Å²	142.8	81%	0.811	80%	0.797	S	S	*	*			trans	-155.3	89.1	146	56.8	0	0	0	0	110.4
30	F	32.7	Very low	35	Very low	192 Å²	192	140.6 Å²	140.6	84%	0.842	80%	0.796	S	S	*	*			trans	-13.3	123.2	149.3	-153.2	-102.9	0	0	0	115.6
31	N	34.1	Very low	35	Very low	164 Å²	164	143.2 Å²	143.2	88%	0.877	80%	0.799	S	S	*	*			trans	-164.6	122.9	141.7	-93.3	-20.3	0	0	0	111
32	K	33	Very low	35.3	Very low	186 Å²	186	140.5 Å²	140.5	81%	0.809	79%	0.793	S	S	*	*			trans	-119.7	147.6	172	-178.8	177.9	-179.3	-178.4	0	107.7
33	S	36.3	Very low	35.3	Very low	102 Å²	102	142.5 Å²	142.5	71%	0.713	80%	0.801	S	S	*	*			trans	92.3	130.7	170.9	-33.4	0	0	0	0	112.6
34	T	40	Very low	35.4	Very low	135 Å²	135	142.5 Å²	142.5	83%	0.828	80%	0.796	S	S	*	*			cis	-171.5	138.8	6.7	11.5	0	0	0	0	107
35	D	33	Very low	35.4	Very low	172 Å²	172	144.6 Å²	144.6	92%	0.92	80%	0.798	S	S	*	*			trans	23.1	135.9	148.5	-147.5	2.4	0	0	0	122.7
36	G	34.9	Very low	35.5	Very low	59 Å²	59	140.1 Å²	140.1	61%	0.608	79%	0.792	S	S	*	*			trans	139.7	91.4	154.2	0	0	0	0	0	118.8
37	T	36.4	Very low	35.6	Very low	126 Å²	126	139.1 Å²	139.1	77%	0.773	79%	0.79	S	S	*	*			trans	88.1	96.8	130.8	-51.4	0	0	0	0	121.7
38	K	39.4	Very low	35.7	Very low	173 Å²	173	140 Å²	140	75%	0.752	79%	0.785	S	S	*	*				71.2	125.6	119	-70.8	-173.7	-176.1	176.4	0	123.9
39	N	34.2	Very low	35.9	Very low	158 Å²	158	137.9 Å²	137.9	85%	0.845	78%	0.779	S	S	*	*			trans	81.7	134.6	140.3	-52.4	-7	0	0	0	117.8
40	G	37.6	Very low	35.8	Very low	67 Å²	67	143 Å²	143	69%	0.691	78%	0.782	S	S	*	*			cis	173.6	152.2	0.3	0	0	0	0	0	110
41	E	35.3	Very low	35.7	Very low	192 Å²	192	141.1 Å²	141.1	90%	0.897	78%	0.781	S	S	*	*			trans	62.4	146.5	147.3	-72.7	-167.5	60.8	0	0	121.6
42	S	38.9	Very low	35.8	Very low	96 Å²	96	136 Å²	136	67%	0.671	77%	0.766	S	S	*	*			cis	-169.3	156.6	-0.6	-98	0	0	0	0	110
43	T	33.3	Very low	36	Very low	131 Å²	131	134 Å²	134	80%	0.804	77%	0.77	S	S	*	*			trans	-83.7	168.5	178.5	-51.9	0	0	0	0	111.9
44	V	33.3	Very low	36	Very low	113 Å²	113	137.2 Å²	137.2	69%	0.685	77%	0.774	S	S	*	*			trans	128.6	108.9	135.6	-175.9	0	0	0	0	117
45	L	33.6	Very low	35.8	Very low	147 Å²	147	140 Å²	140	77%	0.77	78%	0.777	S	S	*	*				41.8	148	128.4	-51.1	173	0	0	0	125.3
46	N	36.9	Very low	35.7	Very low	148 Å²	148	138.6 Å²	138.6	79%	0.791	77%	0.769	S	S	*	*			trans	117.5	116.9	149.1	-61.4	-18.1	0	0	0	114.3
47	M	35.5	Very low	36	Very low	164 Å²	164	145.7 Å²	145.7	81%	0.808	78%	0.784	S	S	*	*				83.8	121.2	65.8	-165.9	102.7	142.8	0	0	113
48	D	40.2	Very low	36	Very low	133 Å²	133	148.7 Å²	148.7	71%	0.711	79%	0.788	S	S	*	*			trans	147.4	111.9	137.1	-73.7	-38.1	0	0	0	116.2
49	T	36.5	Very low	35.8	Very low	121 Å²	121	144.3 Å²	144.3	74%	0.742	79%	0.792	S	S	*	*				47.9	127	119.6	-29.9	0	0	0	0	123
50	Y	36.2	Very low	36	Very low	225 Å²	225	141.2 Å²	141.2	88%	0.882	79%	0.789	S	S	*	*				-177.5	153.3	118.1	-135.4	-103.5	0	0	0	114.8
51	D	31.1	Very low	36.1	Very low	152 Å²	152	145.6 Å²	145.6	81%	0.813	80%	0.795	S	S	*	*			trans	-119.3	166.5	-169.7	174.3	39.3	0	0	0	112.9
52	G	36.1	Very low	36.4	Very low	56 Å²	56	148 Å²	148	58%	0.577	80%	0.796	S	S	*	*			trans	93.6	139	167.4	0	0	0	0	0	115.1
53	T	36.7	Very low	36.5	Very low	143 Å²	143	148.8 Å²	148.8	88%	0.877	80%	0.802	S	S	*	*			cis	-166.4	167.4	28.5	-38	0	0	0	0	110.5
54	E	36.1	Very low	37.3	Very low	171 Å²	171	149.8 Å²	149.8	80%	0.799	80%	0.802	S	S	*	*			trans	-58	159.2	-171	-46.6	-168.2	128.8	0	0	119.5
55	E	36.3	Very low	38	Very low	193 Å²	193	149.4 Å²	149.4	90%	0.902	81%	0.805	S	S	*	*				173.5	144.2	107.4	-91.2	-160	122.9	0	0	114.7
56	N	30.6	Very low	38.9	Very low	142 Å²	142	151 Å²	151	76%	0.759	81%	0.812	S	S	*	*			trans	-65.4	153	-179.7	-90	-53.4	0	0	0	115.5
57	K	41	Very low	39.4	Very low	208 Å²	208	154.9 Å²	154.9	90%	0.904	82%	0.816	S	S	*	*				-174.9	139.6	122.5	-98.4	156.9	-168	173.7	0	114.3
58	H	36.7	Very low	39.6	Very low	189 Å²	189	152.4 Å²	152.4	88%	0.875	81%	0.814	S	S	*	*			trans	-58.3	153.8	179.6	-65.1	-6	0	0	0	115.8
59	G	36.8	Very low	40.1	Very low	81 Å²	81	150.5 Å²	150.5	84%	0.835	82%	0.817	S	S	*	*			trans	178	121.6	161.7	0	0	0	0	0	113.3
60	A	36.7	Very low	40.3	Very low	93 Å²	93	150.5 Å²	150.5	77%	0.769	82%	0.822	S	S	*	*			trans	-79.9	156.7	-167.4	0	0	0	0	0	115.7
61	L	40.1	Very low	40.6	Very low	159 Å²	159	144.6 Å²	144.6	83%	0.832	81%	0.814	S	S	*	*			trans	58.7	112.4	150.3	-73.9	160.9	0	0	0	118.4
62	R	42.8	Very low	41	Very low	243 Å²	243	143.6 Å²	143.6	92%	0.917	81%	0.813	S	S	*	*				-175	131.2	117.5	-96.4	156.2	-169.3	-128.9	1.2	111.7
63	S	40.9	Very low	41.2	Very low	113 Å²	113	145.9 Å²	145.9	79%	0.79	82%	0.821	S	S	*	*			trans	-56.3	127	172.3	-49.7	0	0	0	0	111
64	D	49.1	Very low	41.4	Very low	151 Å²	151	145.2 Å²	145.2	81%	0.807	82%	0.816	S	S	*	*			trans	-162.2	112.5	153.8	-94	-37.1	0	0	0	111.8
65	S	48.1	Very low	41.5	Very low	105 Å²	105	143.2 Å²	143.2	73%	0.734	82%	0.82	S	S	*	*			trans	52.9	84.8	138.8	-56.2	0	0	0	0	119.1	R67	S65-R67 VanDerWaalsContact C-N 3.32Å; S65-R67 PolarHBondContact O-N 3.31Å
66	I	51.8	Low	41.8	Very low	180 Å²	180	137.9 Å²	137.9	92%	0.923	80%	0.804	S	S	*	*			trans	-69.8	95	156.5	-61.9	-178.7	0	0	0	108.1
67	R	48.6	Very low	43.3	Very low	231 Å²	231	139.5 Å²	139.5	87%	0.872	81%	0.811	S	S	*	*			trans	-74.8	121.3	175.3	-169.1	173.3	172.1	-154.9	-1.1	109.3	S65 A69	S65-R67 VanDerWaalsContact C-N 3.32Å; S65-R67 PolarHBondContact O-N 3.31Å; R67-A69 PolarHBondContact O-N 3.47Å
68	S	39.8	Very low	44.8	Very low	111 Å²	111	136.6 Å²	136.6	78%	0.776	80%	0.801	S	S	*	*			trans	-35.5	113.7	174	-46.7	0	0	0	0	114.6
69	A	49.3	Very low	47.2	Very low	94 Å²	94	132.6 Å²	132.6	78%	0.777	78%	0.783	S	S	*	*			trans	-96.6	105.8	155.8	0	0	0	0	0	108.1	R67 S71	R67-A69 PolarHBondContact O-N 3.47Å; A69-S71 PolarHBondContact O-N 3.07Å
70	S	40.6	Very low	49.8	Very low	121 Å²	121	132 Å²	132	85%	0.846	76%	0.76	S	S	*	*			trans	-54.6	97.1	-179.3	-44.1	0	0	0	0	112.3
71	S	44.3	Very low	52.5	Low	100 Å²	100	127.7 Å²	127.7	70%	0.699	72%	0.724	S	S	*	*			trans	-110.7	114.3	152.6	54.8	0	0	0	0	106.3	A69 S73	A69-S71 PolarHBondContact O-N 3.07Å; S71-S73 VanDerWaalsContact C-N 3.31Å; S71-S73 PolarHBondContact O-N 3.15Å
72	T	39.7	Very low	55.1	Low	132 Å²	132	121.7 Å²	121.7	81%	0.81	69%	0.69	S	S	*	*			trans	-63.5	91.9	-174.6	-22.9	0	0	0	0	109.4	V74	T72-V74 PolarHBondContact O-N 2.77Å
73	S	39.9	Very low	57.4	Low	104 Å²	104	113 Å²	113	73%	0.727	66%	0.661	S	S	*	*			trans	-71.7	67.1	172.4	52.9	0	0	0	0	110.4	S71 C75	S71-S73 VanDerWaalsContact C-N 3.31Å; S71-S73 PolarHBondContact O-N 3.15Å; S73-C75 PolarHBondContact O-N 3.02Å
74	V	39.5	Very low	59.9	Low	128 Å²	128	109.9 Å²	109.9	78%	0.776	64%	0.639	S	S	*	*			trans	-87.5	50.8	155.2	-75.7	0	0	0	0	109.3	T72 S76	T72-V74 PolarHBondContact O-N 2.77Å; V74-S76 VanDerWaalsContact C-N 3.34Å
75	C	40	Very low	62	Low	130 Å²	130	109.4 Å²	109.4	88%	0.878	63%	0.632	S	S	*	*			trans	-105.6	36.8	167.5	-150.5	0	0	0	0	109.8	S73	S73-C75 PolarHBondContact O-N 3.02Å
76	S	42.5	Very low	64.1	Low	81 Å²	81	109.1 Å²	109.1	57%	0.566	62%	0.621	S	S	*	*	S	Bend	trans	-106.9	101.5	179.8	54.9	0	0	0	0	110.3	V74 Q78	V74-S76 VanDerWaalsContact C-N 3.34Å; S76-Q78 PolarHBondContact O-N 2.92Å
77	L	60.5	Low	66	Low	175 Å²	175	103.4 Å²	103.4	92%	0.916	60%	0.596	S	S	*	*			trans	70.2	8.8	147.9	-69.6	154.9	0	0	0	120.5	Q79	L77-Q79 PolarHBondContact O-N 3.5Å
78	Q	72.2	Confident	68	Low	147 Å²	147	95.2 Å²	95.2	69%	0.687	58%	0.577	S	S	*	*			trans	-72.4	124.2	171.7	-77.7	-174.8	-12.1	0	0	111.3	S76 L80	S76-Q78 PolarHBondContact O-N 2.92Å; Q78-L80 WeakPolarHBondContact O-CD1 3.16Å; Q78-L80 PolarHBondContact O-N 2.94Å
79	Q	87.5	Confident	70.3	Confident	106 Å²	106	93.7 Å²	93.7	50%	0.495	57%	0.567	S	S	.	*			trans	-65	118.4	173.9	-59.3	177.8	-2.9	0	0	108.5	L77 L94 F106	L77-Q79 PolarHBondContact O-N 3.5Å; Q79-L94 HydrophobicContact CB-CD1 3.85Å; Q79-L94 WeakPolarHBondContact O-CD1 3.34Å; Q79-F106 HydrophobicContact CB-CD1 4.25Å; Q79-F106 HydrophobicContact CB-CD2 3.88Å; Q79-F106 HydrophobicContact CB-CE1 4.4Å; Q79-F106 HydrophobicContact CB-CE2 4.05Å; Q79-F106 HydrophobicContact CB-CG 3.99Å; Q79-F106 HydrophobicContact CB-CZ 4.31Å; Q79-F106 HydrophobicContact CG-CD1 4.35Å; Q79-F106 HydrophobicContact CG-CD2 3.94Å; Q79-F106 HydrophobicContact CG-CE1 4Å; Q79-F106 HydrophobicContact CG-CE2 3.55Å; Q79-F106 HydrophobicContact CG-CG 4.32Å; Q79-F106 HydrophobicContact CG-CZ 3.59Å; Q79-F106 VanDerWaalsContact NE2-CZ 3.25Å
80	L	92.7	Very high	71.8	Confident	69 Å²	69	101.4 Å²	101.4	36%	0.361	58%	0.576	S	S	.	*	B	Isolated β-bridge	trans	-116	148.1	-178.7	-67.5	141.6	0	0	0	109.1	Q78 R82 H85 F106	Q78-L80 WeakPolarHBondContact O-CD1 3.16Å; Q78-L80 PolarHBondContact O-N 2.94Å; L80-R82 PolarHBondContact O-N 2.72Å; L80-H85 VanDerWaalsContact CD2-O 3.3Å; L80-H85 WeakPolarHBondContact CD2-O 3.39Å; L80-F106 WeakPolarHBondContact O-CB 3.4Å
81	C	93.5	Very high	73.6	Confident	1 Å²	1	99.7 Å²	99.7	1%	0.007	58%	0.577	C	S	.	*			trans	-67.6	124.3	172.6	176.8	0	0	0	0	109.8	I83 C84 H85 L86 L94 H108	C81-I83 PolarHBondContact O-N 3.41Å; C81-C84 WeakPolarHBondContact CB-SG 3.22Å; C81-C84 PolarHBondContact SG-SG 3.12Å; C81-H85 WeakPolarHBondContact O-CA 3.26Å; C81-H85 PolarHBondContact O-CD2 2.92Å; C81-H85 PolarHBondContact O-N 3.33Å; C81-L86 WeakPolarHBondContact CB-O 3.47Å; C81-L86 PolarHBondContact N-O 2.74Å; C81-L94 HydrophobicContact CB-CD2 3.67Å; C81-H108 WeakPolarHBondContact CB-ND1 3.36Å; C81-H108 PolarHBondContact SG-N 3.22Å
82	R	92.9	Very high	75.5	Confident	34 Å²	34	100.8 Å²	100.8	13%	0.128	57%	0.569	C	S	.	*	T	Hydrogen-bonded Turn	trans	-63.6	-12.8	179	81	-173.5	-160.6	176.7	7.4	115.5	L80 H85 L104 F106 E130	L80-R82 PolarHBondContact O-N 2.72Å; R82-H85 PolarHBondContact O-NE2 3.08Å; R82-L104 HydrophobicContact CB-CD2 4.31Å; R82-L104 WeakPolarHBondContact CD-O 3.16Å; R82-L104 PolarHBondContact NH1-O 3.39Å; R82-F106 PolarHBondContact N-O 2.92Å; R82-E130 IonicContact CZ-OE1 2.64Å; R82-E130 IonicContact NH2-OE1 2.77Å; R82-E130 PolarHBondContact NH2-OE1 3.3Å
83	I	91.4	Very high	77.7	Confident	61 Å²	61	97.6 Å²	97.6	31%	0.313	56%	0.557	S	S	.	*	T	Hydrogen-bonded Turn	trans	-98.4	-47.2	-175.7	-59.9	179	0	0	0	111	C81 V107 C111 W115	C81-I83 PolarHBondContact O-N 3.41Å; I83-V107 HydrophobicContact CD1-CG2 3.36Å; I83-V107 HydrophobicContact CG1-CG2 3.79Å; I83-C111 HydrophobicContact CB-CB 4.05Å; I83-C111 HydrophobicContact CD1-CB 3.97Å; I83-C111 HydrophobicContact CG2-CB 4.14Å; I83-W115 HydrophobicContact CD1-CB 3.84Å; I83-W115 HydrophobicContact CD1-CG 4.16Å
84	C	93.8	Very high	80.1	Confident	47 Å²	47	94 Å²	94	32%	0.318	53%	0.529	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.7	-3	-176.5	66.5	0	0	0	0	113.9	C81 L86 H108	C81-C84 WeakPolarHBondContact CB-SG 3.22Å; C81-C84 PolarHBondContact SG-SG 3.12Å; C84-L86 HydrophobicContact CB-CD1 4.37Å; C84-L86 PolarHBondContact O-N 2.9Å; C84-L86 VanDerWaalsContact O-N 3.1Å; C84-H108 VanDerWaalsContact SG-CE1 3.51Å; C84-H108 PolarHBondContact SG-ND1 3.21Å
85	H	93.3	Very high	82.4	Confident	141 Å²	141	88.6 Å²	88.6	65%	0.653	50%	0.496	S	S	*	.			trans	56.8	24.7	179.7	-53.3	168	0	0	0	114.3	L80 C81 R82	L80-H85 VanDerWaalsContact CD2-O 3.3Å; L80-H85 WeakPolarHBondContact CD2-O 3.39Å; C81-H85 WeakPolarHBondContact O-CA 3.26Å; C81-H85 PolarHBondContact O-CD2 2.92Å; C81-H85 PolarHBondContact O-N 3.33Å; R82-H85 PolarHBondContact O-NE2 3.08Å
86	L	93	Very high	84.8	Confident	98 Å²	98	83.9 Å²	83.9	51%	0.513	47%	0.465	S	S	.	.			trans	-102.6	146.8	176.1	-68.6	163.8	0	0	0	110.9	C81 C84 H108	C81-L86 WeakPolarHBondContact CB-O 3.47Å; C81-L86 PolarHBondContact N-O 2.74Å; C84-L86 HydrophobicContact CB-CD1 4.37Å; C84-L86 PolarHBondContact O-N 2.9Å; C84-L86 VanDerWaalsContact O-N 3.1Å; L86-H108 PolarHBondContact O-CE1 2.88Å
87	P	92	Very high	87	Confident	60 Å²	60	80.2 Å²	80.2	39%	0.39	44%	0.439	S	S	.	.	B	Isolated β-bridge	trans	-70.2	174.1	176.3	30.3	-35.6	0	0	0	111.9	H108	P87-H108 PolarHBondContact O-NE2 2.97Å
88	A	90.7	Very high	88.4	Confident	59 Å²	59	72 Å²	72	49%	0.488	40%	0.396	S	S	.	.			trans	-62.8	137.9	168.9	0	0	0	0	0	110.6	K92 L94	A88-K92 WeakPolarHBondContact CA-O 3.37Å; A88-L94 HydrophobicContact CB-CB 4.47Å; A88-L94 HydrophobicContact CB-CD1 3.8Å; A88-L94 HydrophobicContact CB-CG 3.95Å
89	S	87.8	Confident	89.2	Confident	80 Å²	80	71.2 Å²	71.2	56%	0.559	39%	0.387	S	S	*	.	B	Isolated β-bridge	trans	-131.9	163.7	175.9	-179.5	0	0	0	0	110.9	G91 K92	S89-G91 PolarHBondContact O-N 2.95Å; S89-K92 PolarHBondContact N-O 3.34Å; S89-K92 CarbonylContact O-C 3.34Å; S89-K92 PolarHBondContact O-N 3.4Å
90	R	79.5	Confident	89.3	Confident	256 Å²	256	66.8 Å²	66.8	97%	0.966	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	105.3	174.6	-66.4	-174.3	179.7	-167.2	0.5	108.8
91	G	78.8	Confident	89.1	Confident	85 Å²	85	70.1 Å²	70.1	88%	0.876	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	104.4	-10.9	-175.5	0	0	0	0	0	115.5	S89	S89-G91 PolarHBondContact O-N 2.95Å
92	K	83.3	Confident	88.8	Confident	122 Å²	122	72.4 Å²	72.4	53%	0.53	41%	0.409	S	S	.	.	B	Isolated β-bridge	trans	-131.4	75.6	174.3	-65.7	-177.7	-176.6	176.2	0	109.6	A88 S89 H108	A88-K92 WeakPolarHBondContact CA-O 3.37Å; S89-K92 PolarHBondContact N-O 3.34Å; S89-K92 CarbonylContact O-C 3.34Å; S89-K92 PolarHBondContact O-N 3.4Å; K92-H108 PolarHBondContact O-CD2 2.95Å; K92-H108 VanDerWaalsContact O-CD2 3.23Å
93	A	86.6	Confident	88.6	Confident	66 Å²	66	75 Å²	75	55%	0.545	43%	0.429	S	S	.	.			trans	-70.7	144.2	174.1	0	0	0	0	0	111
94	L	90.2	Very high	88.5	Confident	28 Å²	28	76.3 Å²	76.3	15%	0.147	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	138.5	169.2	-70.1	161.7	0	0	0	108.8	Q79 C81 A88 F106 V107	Q79-L94 HydrophobicContact CB-CD1 3.85Å; Q79-L94 WeakPolarHBondContact O-CD1 3.34Å; C81-L94 HydrophobicContact CB-CD2 3.67Å; A88-L94 HydrophobicContact CB-CB 4.47Å; A88-L94 HydrophobicContact CB-CD1 3.8Å; A88-L94 HydrophobicContact CB-CG 3.95Å; L94-F106 HydrophobicContact CB-CB 4.45Å; L94-F106 HydrophobicContact CD2-CB 4.15Å; L94-V107 WeakPolarHBondContact CA-O 3.44Å
95	V	88.7	Confident	88.3	Confident	14 Å²	14	78.1 Å²	78.1	9%	0.085	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	153.5	175.5	-68.6	0	0	0	0	109.1	P97 F106 V107 K109 D243	V95-P97 VanDerWaalsContact O-CD 3.31Å; V95-P97 WeakPolarHBondContact O-CD 3.38Å; V95-F106 WeakPolarHBondContact O-CA 3.45Å; V95-V107 HydrophobicContact CG2-CG1 3.88Å; V95-V107 WeakPolarHBondContact CG2-O 3.16Å; V95-V107 PolarHBondContact N-O 3.27Å; V95-V107 PolarHBondContact O-N 2.96Å; V95-K109 HydrophobicContact CG2-CB 4.44Å; V95-D243 WeakPolarHBondContact CA-OD1 3.49Å; V95-D243 WeakPolarHBondContact CB-OD1 3.44Å; V95-D243 WeakPolarHBondContact CG1-OD1 3.46Å
96	S	90.5	Very high	88.3	Confident	32 Å²	32	72.9 Å²	72.9	22%	0.224	41%	0.411	C	S	.	.			trans	-111	85.6	172.3	58.2	0	0	0	0	110.3	C98 R105 D243 Y244	S96-C98 VanDerWaalsContact C-N 3.3Å; S96-C98 PolarHBondContact O-N 2.94Å; S96-R105 WeakPolarHBondContact CA-O 3.36Å; S96-D243 PolarHBondContact N-OD1 3.32Å; S96-Y244 WeakPolarHBondContact O-CB 3.04Å; S96-Y244 PolarHBondContact O-N 2.95Å
97	P	87.7	Confident	88.2	Confident	3 Å²	3	68.2 Å²	68.2	2%	0.019	39%	0.387	C	S	.	.			trans	-81.6	-7.5	-169.4	36.6	-42	0	0	0	113.5	V95 R105 V107 L112 Y136 V241	V95-P97 VanDerWaalsContact O-CD 3.31Å; V95-P97 WeakPolarHBondContact O-CD 3.38Å; P97-R105 WeakPolarHBondContact CD-O 3.16Å; P97-V107 HydrophobicContact CG-CG1 3.67Å; P97-L112 HydrophobicContact CB-CD2 3.7Å; P97-L112 HydrophobicContact CG-CD2 3.76Å; P97-Y136 HydrophobicContact CB-CD1 3.71Å; P97-Y136 HydrophobicContact CB-CE1 3.67Å; P97-Y136 HydrophobicContact CG-CD1 4.36Å; P97-Y136 HydrophobicContact CG-CE1 3.8Å; P97-Y136 VanDerWaalsContact O-CD1 3.27Å; P97-Y136 WeakPolarHBondContact O-CD1 3.16Å; P97-V241 HydrophobicContact CB-CG1 3.66Å
98	C	90.1	Very high	88.2	Confident	3 Å²	3	65.6 Å²	65.6	2%	0.02	37%	0.369	C	S	.	.	S	Bend	trans	-144.5	176.7	-172.5	66.9	0	0	0	0	113	S96 C100 C129 Y134 Y136	S96-C98 VanDerWaalsContact C-N 3.3Å; S96-C98 PolarHBondContact O-N 2.94Å; C98-C100 VanDerWaalsContact C-N 3.26Å; C98-C100 PolarHBondContact O-N 3.39Å; C98-C100 PolarHBondContact SG-SG 3.29Å; C98-C129 HydrophobicContact CB-CB 3.82Å; C98-C129 VanDerWaalsContact SG-SG 3.61Å; C98-Y134 HydrophobicContact CB-CD1 4.17Å; C98-Y136 HydrophobicContact CB-CE1 3.97Å
99	R	88.4	Confident	88	Confident	131 Å²	131	66.5 Å²	66.5	49%	0.494	36%	0.362	S	S	.	.	S	Bend	trans	-84.1	12.2	-178.4	-61.1	179.6	-178.5	-115.1	-0.4	114.3	Y134 Y244	R99-Y134 HydrophobicContact CG-CD2 3.87Å; R99-Y134 HydrophobicContact CG-CE2 4.39Å; R99-Y134 HydrophobicContact CG-CG 4.06Å; R99-Y134 VanDerWaalsContact NE-CE2 3.34Å; R99-Y244 HydrophobicContact CG-CD1 4.34Å; R99-Y244 HydrophobicContact CG-CD2 4.37Å; R99-Y244 HydrophobicContact CG-CE1 3.85Å; R99-Y244 HydrophobicContact CG-CE2 3.91Å; R99-Y244 PolarHBondContact NH1-OH 3.1Å; R99-Y244 PolarHBondContact NH2-OH 3.19Å
100	C	90.6	Very high	87.9	Confident	13 Å²	13	66 Å²	66	9%	0.088	36%	0.362	C	S	.	.			trans	-61.8	150.6	177.4	-68.9	0	0	0	0	111.1	C98 L104 R105 C132	C98-C100 VanDerWaalsContact C-N 3.26Å; C98-C100 PolarHBondContact O-N 3.39Å; C98-C100 PolarHBondContact SG-SG 3.29Å; C100-L104 HydrophobicContact CB-CB 4.28Å; C100-R105 HydrophobicContact CB-CB 4.38Å; C100-R105 VanDerWaalsContact O-CB 3.24Å; C100-R105 WeakPolarHBondContact O-CB 3.39Å; C100-C132 VanDerWaalsContact SG-SG 3.64Å
101	L	88.6	Confident	88.4	Confident	139 Å²	139	55 Å²	55	73%	0.728	33%	0.325	S	S	*	.			trans	-100.8	167.6	178.6	-63	173.2	0	0	0	111.2
102	G	87.2	Confident	88.9	Confident	48 Å²	48	51 Å²	51	50%	0.495	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	59.4	-145.2	-179.4	0	0	0	0	0	114.1	L104 R105	G102-L104 VanDerWaalsContact C-N 3.32Å; G102-L104 PolarHBondContact O-N 2.85Å; G102-R105 WeakPolarHBondContact O-CG 3.09Å; G102-R105 PolarHBondContact O-NE 3.35Å
103	T	87.7	Confident	88.9	Confident	90 Å²	90	46.5 Å²	46.5	55%	0.552	27%	0.266	S	S	*	.	G	3₁₀ helix	trans	-70.4	-24.6	-178.1	51.9	0	0	0	0	113.3	R105 F106	T103-R105 PolarHBondContact O-N 2.95Å; T103-R105 VanDerWaalsContact O-N 3.13Å; T103-F106 PolarHBondContact O-N 2.97Å
104	L	89.4	Confident	88.8	Confident	87 Å²	87	48.9 Å²	48.9	46%	0.455	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-68.6	-10.3	-178.1	-64.4	175.5	0	0	0	114.2	R82 C100 G102 L131	R82-L104 HydrophobicContact CB-CD2 4.31Å; R82-L104 WeakPolarHBondContact CD-O 3.16Å; R82-L104 PolarHBondContact NH1-O 3.39Å; C100-L104 HydrophobicContact CB-CB 4.28Å; G102-L104 VanDerWaalsContact C-N 3.32Å; G102-L104 PolarHBondContact O-N 2.85Å; L104-L131 HydrophobicContact CB-CD1 4.39Å; L104-L131 HydrophobicContact CD1-CD1 4.1Å
105	R	91	Very high	88.7	Confident	85 Å²	85	52.1 Å²	52.1	32%	0.321	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-75.9	-26.2	175.6	83	177.7	66.4	-174.4	-3.6	112.7	S96 P97 C100 G102 T103	S96-R105 WeakPolarHBondContact CA-O 3.36Å; P97-R105 WeakPolarHBondContact CD-O 3.16Å; C100-R105 HydrophobicContact CB-CB 4.38Å; C100-R105 VanDerWaalsContact O-CB 3.24Å; C100-R105 WeakPolarHBondContact O-CB 3.39Å; G102-R105 WeakPolarHBondContact O-CG 3.09Å; G102-R105 PolarHBondContact O-NE 3.35Å; T103-R105 PolarHBondContact O-N 2.95Å; T103-R105 VanDerWaalsContact O-N 3.13Å
106	F	91.6	Very high	88.6	Confident	31 Å²	31	51.5 Å²	51.5	14%	0.136	27%	0.272	C	S	.	.			trans	-93.7	131.2	-170.6	-59.1	-72.2	0	0	0	111.8	Q79 L80 R82 L94 V95 T103	Q79-F106 HydrophobicContact CB-CD1 4.25Å; Q79-F106 HydrophobicContact CB-CD2 3.88Å; Q79-F106 HydrophobicContact CB-CE1 4.4Å; Q79-F106 HydrophobicContact CB-CE2 4.05Å; Q79-F106 HydrophobicContact CB-CG 3.99Å; Q79-F106 HydrophobicContact CB-CZ 4.31Å; Q79-F106 HydrophobicContact CG-CD1 4.35Å; Q79-F106 HydrophobicContact CG-CD2 3.94Å; Q79-F106 HydrophobicContact CG-CE1 4Å; Q79-F106 HydrophobicContact CG-CE2 3.55Å; Q79-F106 HydrophobicContact CG-CG 4.32Å; Q79-F106 HydrophobicContact CG-CZ 3.59Å; Q79-F106 VanDerWaalsContact NE2-CZ 3.25Å; L80-F106 WeakPolarHBondContact O-CB 3.4Å; R82-F106 PolarHBondContact N-O 2.92Å; L94-F106 HydrophobicContact CB-CB 4.45Å; L94-F106 HydrophobicContact CD2-CB 4.15Å; V95-F106 WeakPolarHBondContact O-CA 3.45Å; T103-F106 PolarHBondContact O-N 2.97Å
107	V	92	Very high	88.1	Confident	1 Å²	1	53.7 Å²	53.7	1%	0.006	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	147.4	177.7	67.2	0	0	0	0	110.2	I83 L94 V95 P97 C111 L112	I83-V107 HydrophobicContact CD1-CG2 3.36Å; I83-V107 HydrophobicContact CG1-CG2 3.79Å; L94-V107 WeakPolarHBondContact CA-O 3.44Å; V95-V107 HydrophobicContact CG2-CG1 3.88Å; V95-V107 WeakPolarHBondContact CG2-O 3.16Å; V95-V107 PolarHBondContact N-O 3.27Å; V95-V107 PolarHBondContact O-N 2.96Å; P97-V107 HydrophobicContact CG-CG1 3.67Å; V107-C111 HydrophobicContact CG2-CB 4.21Å; V107-L112 HydrophobicContact CG1-CB 3.97Å; V107-L112 HydrophobicContact CG1-CD1 4.42Å; V107-L112 HydrophobicContact CG1-CD2 4.14Å; V107-L112 HydrophobicContact CG1-CG 4.41Å; V107-L112 HydrophobicContact CG2-CB 3.98Å
108	H	91.4	Very high	87.8	Confident	4 Å²	4	58.4 Å²	58.4	2%	0.019	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	139.9	168.4	-60.9	124.9	0	0	0	109.8	C81 C84 L86 P87 K92 A110 C111 L112	C81-H108 WeakPolarHBondContact CB-ND1 3.36Å; C81-H108 PolarHBondContact SG-N 3.22Å; C84-H108 VanDerWaalsContact SG-CE1 3.51Å; C84-H108 PolarHBondContact SG-ND1 3.21Å; L86-H108 PolarHBondContact O-CE1 2.88Å; P87-H108 PolarHBondContact O-NE2 2.97Å; K92-H108 PolarHBondContact O-CD2 2.95Å; K92-H108 VanDerWaalsContact O-CD2 3.23Å; H108-A110 PolarHBondContact O-N 3.39Å; H108-C111 HydrophobicContact CB-CB 4.08Å; H108-C111 PolarHBondContact O-N 3.25Å; H108-L112 PolarHBondContact O-N 3.41Å
109	K	87.6	Confident	87.4	Confident	79 Å²	79	59.5 Å²	59.5	34%	0.343	32%	0.315	S	S	.	.	H	α-helix	trans	-52.3	-42.4	177	-171.4	171.7	-169.7	152.8	0	113.1	V95 V113	V95-K109 HydrophobicContact CG2-CB 4.44Å; K109-V113 VanDerWaalsContact O-CG2 3.31Å; K109-V113 WeakPolarHBondContact O-CG2 3.5Å; K109-V113 PolarHBondContact O-N 3.44Å; K109-V113 VanDerWaalsContact O-N 3.09Å
110	A	85.6	Confident	86.4	Confident	68 Å²	68	58.3 Å²	58.3	56%	0.562	33%	0.327	S	S	*	.	H	α-helix	trans	-67.1	-42.4	177.8	0	0	0	0	0	112.5	H108 L112 V113 H114	H108-A110 PolarHBondContact O-N 3.39Å; A110-L112 VanDerWaalsContact C-N 3.34Å; A110-L112 PolarHBondContact O-N 2.75Å; A110-V113 PolarHBondContact O-N 3.41Å; A110-H114 WeakPolarHBondContact O-CB 3.26Å; A110-H114 PolarHBondContact O-N 3.39Å
111	C	89.1	Confident	85.3	Confident	27 Å²	27	60.6 Å²	60.6	18%	0.182	33%	0.334	C	S	.	.	H	α-helix	trans	-63.4	-40.7	177.1	-65.1	0	0	0	0	111.5	I83 V107 H108 W115	I83-C111 HydrophobicContact CB-CB 4.05Å; I83-C111 HydrophobicContact CD1-CB 3.97Å; I83-C111 HydrophobicContact CG2-CB 4.14Å; V107-C111 HydrophobicContact CG2-CB 4.21Å; H108-C111 HydrophobicContact CB-CB 4.08Å; H108-C111 PolarHBondContact O-N 3.25Å; C111-W115 WeakPolarHBondContact O-CB 3.4Å; C111-W115 PolarHBondContact O-N 3.17Å
112	L	88.9	Confident	84.1	Confident	1 Å²	1	58.4 Å²	58.4	1%	0.005	32%	0.318	C	S	.	.	H	α-helix	trans	-64.3	-45.4	177	-178.5	64.6	0	0	0	112.1	P97 V107 H108 A110 W115 L116 Y136 V241	P97-L112 HydrophobicContact CB-CD2 3.7Å; P97-L112 HydrophobicContact CG-CD2 3.76Å; V107-L112 HydrophobicContact CG1-CB 3.97Å; V107-L112 HydrophobicContact CG1-CD1 4.42Å; V107-L112 HydrophobicContact CG1-CD2 4.14Å; V107-L112 HydrophobicContact CG1-CG 4.41Å; V107-L112 HydrophobicContact CG2-CB 3.98Å; H108-L112 PolarHBondContact O-N 3.41Å; A110-L112 VanDerWaalsContact C-N 3.34Å; A110-L112 PolarHBondContact O-N 2.75Å; L112-W115 PolarHBondContact O-N 2.96Å; L112-L116 HydrophobicContact CD1-CD1 3.85Å; L112-L116 HydrophobicContact CD1-CG 4.42Å; L112-L116 HydrophobicContact CG-CD1 3.84Å; L112-L116 WeakPolarHBondContact O-CD1 3.16Å; L112-L116 VanDerWaalsContact O-CG 3.27Å; L112-L116 WeakPolarHBondContact O-CG 3.26Å; L112-L116 PolarHBondContact O-N 2.98Å; L112-Y136 HydrophobicContact CD1-CE2 4.32Å; L112-V241 HydrophobicContact CD2-CB 3.96Å; L112-V241 HydrophobicContact CD2-CG1 3.85Å; L112-V241 HydrophobicContact CD2-CG2 3.88Å
113	V	83.5	Confident	82.7	Confident	27 Å²	27	62.1 Å²	62.1	16%	0.164	33%	0.326	C	S	.	.	H	α-helix	trans	-61.9	-47.7	177.5	170.4	0	0	0	0	110.5	K109 A110 W115 L116 E117	K109-V113 VanDerWaalsContact O-CG2 3.31Å; K109-V113 WeakPolarHBondContact O-CG2 3.5Å; K109-V113 PolarHBondContact O-N 3.44Å; K109-V113 VanDerWaalsContact O-N 3.09Å; A110-V113 PolarHBondContact O-N 3.41Å; V113-W115 VanDerWaalsContact C-N 3.34Å; V113-W115 PolarHBondContact O-N 3.46Å; V113-L116 PolarHBondContact O-N 2.9Å; V113-E117 WeakPolarHBondContact O-CG 3.27Å; V113-E117 PolarHBondContact O-N 3.49Å
114	H	84.3	Confident	81.7	Confident	115 Å²	115	60 Å²	60	53%	0.532	32%	0.317	S	S	.	.	H	α-helix	trans	-61.8	-41.7	178.1	-176	60.1	0	0	0	112.2	A110 L116 E117 V118	A110-H114 WeakPolarHBondContact O-CB 3.26Å; A110-H114 PolarHBondContact O-N 3.39Å; H114-L116 VanDerWaalsContact C-N 3.34Å; H114-L116 PolarHBondContact O-N 3Å; H114-E117 WeakPolarHBondContact O-CB 3.4Å; H114-E117 PolarHBondContact O-N 3.38Å; H114-V118 WeakPolarHBondContact O-CG2 3.23Å; H114-V118 PolarHBondContact O-N 2.82Å
115	W	88.6	Confident	80.7	Confident	97 Å²	97	62 Å²	62	37%	0.367	34%	0.339	S	S	.	.	H	α-helix	trans	-60	-44	174.8	176.6	-110.8	0	0	0	112	I83 C111 L112 V113 E117 V118 S119 R121 E130	I83-W115 HydrophobicContact CD1-CB 3.84Å; I83-W115 HydrophobicContact CD1-CG 4.16Å; C111-W115 WeakPolarHBondContact O-CB 3.4Å; C111-W115 PolarHBondContact O-N 3.17Å; L112-W115 PolarHBondContact O-N 2.96Å; V113-W115 VanDerWaalsContact C-N 3.34Å; V113-W115 PolarHBondContact O-N 3.46Å; W115-E117 VanDerWaalsContact C-N 3.31Å; W115-E117 PolarHBondContact O-N 2.96Å; W115-V118 PolarHBondContact O-N 3.22Å; W115-S119 WeakPolarHBondContact O-CB 3.41Å; W115-S119 PolarHBondContact O-N 3.47Å; W115-S119 PolarHBondContact O-OG 3.26Å; W115-R121 VanDerWaalsContact CE2-NH2 3.29Å; W115-E130 VanDerWaalsContact CE2-OE2 3.29Å; W115-E130 VanDerWaalsContact CZ2-OE2 3.26Å; W115-E130 WeakPolarHBondContact CZ2-OE2 3.19Å; W115-E130 PolarHBondContact NE1-OE1 3.49Å; W115-E130 PolarHBondContact NE1-OE2 3.11Å
116	L	86.5	Confident	80	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-70.5	-29.5	179.1	-66.9	163.1	0	0	0	112.5	L112 V113 H114 S119 R121 K122 P127 Y136 W239	L112-L116 HydrophobicContact CD1-CD1 3.85Å; L112-L116 HydrophobicContact CD1-CG 4.42Å; L112-L116 HydrophobicContact CG-CD1 3.84Å; L112-L116 WeakPolarHBondContact O-CD1 3.16Å; L112-L116 VanDerWaalsContact O-CG 3.27Å; L112-L116 WeakPolarHBondContact O-CG 3.26Å; L112-L116 PolarHBondContact O-N 2.98Å; V113-L116 PolarHBondContact O-N 2.9Å; H114-L116 VanDerWaalsContact C-N 3.34Å; H114-L116 PolarHBondContact O-N 3Å; L116-S119 WeakPolarHBondContact CA-OG 3.37Å; L116-R121 HydrophobicContact CD2-CB 3.99Å; L116-R121 PolarHBondContact O-N 3.42Å; L116-K122 WeakPolarHBondContact O-CB 3.47Å; L116-K122 PolarHBondContact O-N 2.99Å; L116-P127 HydrophobicContact CD2-CB 4.4Å; L116-Y136 HydrophobicContact CD1-CD2 4.03Å; L116-Y136 HydrophobicContact CD1-CE2 3.93Å; L116-Y136 HydrophobicContact CD2-CE2 4.1Å; L116-W239 HydrophobicContact CB-CH2 3.99Å; L116-W239 HydrophobicContact CB-CZ2 3.72Å; L116-W239 HydrophobicContact CD1-CH2 3.19Å; L116-W239 HydrophobicContact CD1-CZ2 3.76Å; L116-W239 HydrophobicContact CD1-CZ3 4Å; L116-W239 HydrophobicContact CG-CH2 4.06Å; L116-W239 HydrophobicContact CG-CZ2 4.29Å
117	E	80.1	Confident	79.5	Confident	78 Å²	78	58.9 Å²	58.9	36%	0.364	33%	0.334	S	S	.	.	H	α-helix	trans	-64.3	-49.1	170.5	-82.5	166.8	176	0	0	112.5	V113 H114 W115 K122	V113-E117 WeakPolarHBondContact O-CG 3.27Å; V113-E117 PolarHBondContact O-N 3.49Å; H114-E117 WeakPolarHBondContact O-CB 3.4Å; H114-E117 PolarHBondContact O-N 3.38Å; W115-E117 VanDerWaalsContact C-N 3.31Å; W115-E117 PolarHBondContact O-N 2.96Å; E117-K122 HydrophobicContact CG-CD 3.55Å; E117-K122 IonicContact OE1-NZ 2.77Å; E117-K122 PolarHBondContact OE1-NZ 2.84Å
118	V	82.2	Confident	79.3	Confident	102 Å²	102	63.4 Å²	63.4	62%	0.618	36%	0.355	S	S	*	.	H	α-helix	trans	-77	-31.9	-177.4	177.8	0	0	0	0	111.9	H114 W115 S120	H114-V118 WeakPolarHBondContact O-CG2 3.23Å; H114-V118 PolarHBondContact O-N 2.82Å; W115-V118 PolarHBondContact O-N 3.22Å; V118-S120 PolarHBondContact O-N 2.96Å; V118-S120 VanDerWaalsContact O-N 3.14Å
119	S	81.2	Confident	79.2	Confident	26 Å²	26	63.3 Å²	63.3	18%	0.182	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	24.4	-174	62.1	0	0	0	0	115.2	W115 L116 R121	W115-S119 WeakPolarHBondContact O-CB 3.41Å; W115-S119 PolarHBondContact O-N 3.47Å; W115-S119 PolarHBondContact O-OG 3.26Å; L116-S119 WeakPolarHBondContact CA-OG 3.37Å; S119-R121 WeakPolarHBondContact O-CG 3.37Å; S119-R121 PolarHBondContact O-N 3.46Å; S119-R121 PolarHBondContact OG-NE 3.34Å; S119-R121 PolarHBondContact OG-NH2 2.85Å
120	S	67.4	Low	79.2	Confident	106 Å²	106	63.1 Å²	63.1	74%	0.741	36%	0.355	S	S	*	.	S	Bend	trans	50.4	7.2	-176.3	63.4	0	0	0	0	116.4	V118	V118-S120 PolarHBondContact O-N 2.96Å; V118-S120 VanDerWaalsContact O-N 3.14Å
121	R	68.2	Low	79.4	Confident	61 Å²	61	64.7 Å²	64.7	23%	0.23	35%	0.354	C	S	.	.	G	3₁₀ helix	trans	-89.2	-8.1	-177.3	-78.1	178.2	-65.9	-143.5	5.9	114.2	W115 L116 S119 L123 A124 E130	W115-R121 VanDerWaalsContact CE2-NH2 3.29Å; L116-R121 HydrophobicContact CD2-CB 3.99Å; L116-R121 PolarHBondContact O-N 3.42Å; S119-R121 WeakPolarHBondContact O-CG 3.37Å; S119-R121 PolarHBondContact O-N 3.46Å; S119-R121 PolarHBondContact OG-NE 3.34Å; S119-R121 PolarHBondContact OG-NH2 2.85Å; R121-L123 PolarHBondContact O-N 3.31Å; R121-A124 WeakPolarHBondContact O-CB 3.43Å; R121-A124 PolarHBondContact O-N 2.88Å; R121-E130 IonicContact CZ-OE2 3.17Å; R121-E130 IonicContact NH1-OE2 3.01Å; R121-E130 PolarHBondContact NH1-OE2 2.91Å; R121-E130 IonicContact NH2-OE2 3.81Å; R121-E130 PolarHBondContact NH2-OE2 2.94Å
122	K	62.5	Low	79.5	Confident	93 Å²	93	66 Å²	66	40%	0.404	36%	0.362	S	S	.	.	G	3₁₀ helix	trans	-61.1	-28.5	172.8	-169.2	176.6	-173.1	171.8	0	112.3	L116 E117	L116-K122 WeakPolarHBondContact O-CB 3.47Å; L116-K122 PolarHBondContact O-N 2.99Å; E117-K122 HydrophobicContact CG-CD 3.55Å; E117-K122 IonicContact OE1-NZ 2.77Å; E117-K122 PolarHBondContact OE1-NZ 2.84Å
123	L	58.6	Low	79.4	Confident	126 Å²	126	67.9 Å²	67.9	66%	0.66	38%	0.382	S	S	*	.	G	3₁₀ helix	trans	-90.2	-7.5	-179.5	-162.6	60.3	0	0	0	113.3	V11 R121 S125	V11-L123 HydrophobicContact CG1-CD2 3.93Å; R121-L123 PolarHBondContact O-N 3.31Å; L123-S125 PolarHBondContact O-N 3.33Å
124	A	66.3	Low	79.6	Confident	45 Å²	45	68.4 Å²	68.4	37%	0.372	38%	0.381	S	S	.	.	S	Bend	trans	-66.7	131.4	170.1	0	0	0	0	0	109.1	R121 S126	R121-A124 WeakPolarHBondContact O-CB 3.43Å; R121-A124 PolarHBondContact O-N 2.88Å; A124-S126 PolarHBondContact O-N 2.99Å
125	S	67.3	Low	79.7	Confident	130 Å²	130	68.4 Å²	68.4	91%	0.909	38%	0.381	S	S	*	.	S	Bend	trans	-51.9	-29.8	176.4	53.6	0	0	0	0	112.6	L123	L123-S125 PolarHBondContact O-N 3.33Å
126	S	76.4	Confident	79.5	Confident	40 Å²	40	64.4 Å²	64.4	28%	0.28	37%	0.366	S	S	.	.	S	Bend	trans	-133.9	99.3	174.9	58.6	0	0	0	0	111	A124 Q128	A124-S126 PolarHBondContact O-N 2.99Å; S126-Q128 PolarHBondContact O-N 2.89Å
127	P	82	Confident	79.1	Confident	11 Å²	11	69.2 Å²	69.2	7%	0.071	39%	0.387	C	S	.	.			trans	-67.7	130.9	176.1	27.7	-32.5	0	0	0	109.5	L116 Y136 T138 W239	L116-P127 HydrophobicContact CD2-CB 4.4Å; P127-Y136 HydrophobicContact CB-CD2 4.1Å; P127-Y136 WeakPolarHBondContact O-CB 3.2Å; P127-Y136 VanDerWaalsContact O-CD2 3.25Å; P127-Y136 WeakPolarHBondContact O-CD2 3.33Å; P127-Y136 PolarHBondContact O-N 3.29Å; P127-T138 HydrophobicContact CG-CG2 3.83Å; P127-W239 HydrophobicContact CB-CH2 3.43Å; P127-W239 VanDerWaalsContact CB-CH2 3.43Å; P127-W239 HydrophobicContact CB-CZ2 4.45Å; P127-W239 HydrophobicContact CB-CZ3 3.86Å; P127-W239 HydrophobicContact CG-CE3 4.15Å; P127-W239 HydrophobicContact CG-CH2 3.29Å; P127-W239 HydrophobicContact CG-CZ2 4.36Å; P127-W239 HydrophobicContact CG-CZ3 3.2Å
128	Q	87.4	Confident	78.8	Confident	96 Å²	96	67.5 Å²	67.5	45%	0.449	38%	0.382	S	S	.	.	B	Isolated β-bridge	trans	-125.5	157.6	-173.9	60.5	-176.5	-28.6	0	0	111.7	S126 Y134 Q135 Y136	S126-Q128 PolarHBondContact O-N 2.89Å; Q128-Y134 CarbonylContact C-O 3.59Å; Q128-Y134 WeakPolarHBondContact CA-O 3.3Å; Q128-Q135 HydrophobicContact CB-CG 4.42Å; Q128-Y136 VanDerWaalsContact C-CE2 3.43Å; Q128-Y136 WeakPolarHBondContact O-CE2 3.3Å
129	C	89.5	Confident	78.1	Confident	2 Å²	2	66.9 Å²	66.9	1%	0.014	37%	0.372	C	S	.	.			trans	-70.6	129.3	173.9	-169.7	0	0	0	0	111	C98 L131 C132 G133 Y134 Y136	C98-C129 HydrophobicContact CB-CB 3.82Å; C98-C129 VanDerWaalsContact SG-SG 3.61Å; C129-L131 PolarHBondContact O-N 2.86Å; C129-C132 VanDerWaalsContact CB-SG 3.52Å; C129-C132 VanDerWaalsContact SG-SG 3.65Å; C129-G133 VanDerWaalsContact O-CA 3.24Å; C129-G133 WeakPolarHBondContact O-CA 3.38Å; C129-G133 PolarHBondContact O-N 3.35Å; C129-Y134 PolarHBondContact N-O 3.42Å; C129-Y136 WeakPolarHBondContact CA-OH 3.2Å; C129-Y136 HydrophobicContact CB-CE1 4.1Å
130	E	88.1	Confident	77.4	Confident	74 Å²	74	70.9 Å²	70.9	35%	0.346	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-16.8	178.9	70.3	-120.1	140.6	0	0	115	R82 W115 R121	R82-E130 IonicContact CZ-OE1 2.64Å; R82-E130 IonicContact NH2-OE1 2.77Å; R82-E130 PolarHBondContact NH2-OE1 3.3Å; W115-E130 VanDerWaalsContact CE2-OE2 3.29Å; W115-E130 VanDerWaalsContact CZ2-OE2 3.26Å; W115-E130 WeakPolarHBondContact CZ2-OE2 3.19Å; W115-E130 PolarHBondContact NE1-OE1 3.49Å; W115-E130 PolarHBondContact NE1-OE2 3.11Å; R121-E130 IonicContact CZ-OE2 3.17Å; R121-E130 IonicContact NH1-OE2 3.01Å; R121-E130 PolarHBondContact NH1-OE2 2.91Å; R121-E130 IonicContact NH2-OE2 3.81Å; R121-E130 PolarHBondContact NH2-OE2 2.94Å
131	L	89.9	Confident	77.1	Confident	102 Å²	102	67.4 Å²	67.4	53%	0.534	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	-43.6	-176.9	-58.1	-179.2	0	0	0	112	L104 C129	L104-L131 HydrophobicContact CB-CD1 4.39Å; L104-L131 HydrophobicContact CD1-CD1 4.1Å; C129-L131 PolarHBondContact O-N 2.86Å
132	C	90.1	Very high	76.6	Confident	54 Å²	54	69.6 Å²	69.6	37%	0.365	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.9	-1.1	-174.5	66.8	0	0	0	0	114.3	C100 C129 Y134	C100-C132 VanDerWaalsContact SG-SG 3.64Å; C129-C132 VanDerWaalsContact CB-SG 3.52Å; C129-C132 VanDerWaalsContact SG-SG 3.65Å; C132-Y134 PolarHBondContact O-N 3.01Å
133	G	86.9	Confident	76.4	Confident	40 Å²	40	68.7 Å²	68.7	41%	0.412	38%	0.377	S	S	.	.			trans	67.9	0.2	-178.8	0	0	0	0	0	115.3	C129 Q135	C129-G133 VanDerWaalsContact O-CA 3.24Å; C129-G133 WeakPolarHBondContact O-CA 3.38Å; C129-G133 PolarHBondContact O-N 3.35Å; G133-Q135 PolarHBondContact O-N 2.87Å
134	Y	87.9	Confident	76.3	Confident	38 Å²	38	70.6 Å²	70.6	15%	0.149	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-64.6	125.8	-179.2	-177.6	-102	0	0	0	111.2	C98 R99 Q128 C129 C132 Y136 K137 Y244	C98-Y134 HydrophobicContact CB-CD1 4.17Å; R99-Y134 HydrophobicContact CG-CD2 3.87Å; R99-Y134 HydrophobicContact CG-CE2 4.39Å; R99-Y134 HydrophobicContact CG-CG 4.06Å; R99-Y134 VanDerWaalsContact NE-CE2 3.34Å; Q128-Y134 CarbonylContact C-O 3.59Å; Q128-Y134 WeakPolarHBondContact CA-O 3.3Å; C129-Y134 PolarHBondContact N-O 3.42Å; C132-Y134 PolarHBondContact O-N 3.01Å; Y134-Y136 PolarHBondContact O-N 2.75Å; Y134-K137 WeakPolarHBondContact OH-CE 3.36Å; Y134-Y244 AromaticContact CE1-CD2 3.81Å; Y134-Y244 HydrophobicContact CE1-CD2 3.81Å; Y134-Y244 HydrophobicContact CE2-CD2 4.09Å; Y134-Y244 AromaticContact CE2-CE2 3.98Å; Y134-Y244 HydrophobicContact CE2-CE2 3.98Å; Y134-Y244 AromaticContact CZ-CD2 3.5Å; Y134-Y244 AromaticContact CZ-CE2 3.85Å; Y134-Y244 WeakPolarHBondContact OH-CD2 3.36Å
135	Q	86.4	Confident	75.6	Confident	116 Å²	116	80.3 Å²	80.3	54%	0.542	41%	0.407	S	S	.	.	B	Isolated β-bridge	trans	-71	122.9	175	-65.4	-176.6	42.8	0	0	110.2	Q128 G133 K137	Q128-Q135 HydrophobicContact CB-CG 4.42Å; G133-Q135 PolarHBondContact O-N 2.87Å; Q135-K137 PolarHBondContact O-N 3.35Å
136	Y	84.5	Confident	75	Confident	12 Å²	12	84.1 Å²	84.1	5%	0.047	40%	0.402	C	S	.	.	P	Polyproline II helix	trans	-64.6	133.4	-179.9	-63.7	-54.8	0	0	0	110.4	P97 C98 L112 L116 P127 Q128 C129 Y134 T138 V241	P97-Y136 HydrophobicContact CB-CD1 3.71Å; P97-Y136 HydrophobicContact CB-CE1 3.67Å; P97-Y136 HydrophobicContact CG-CD1 4.36Å; P97-Y136 HydrophobicContact CG-CE1 3.8Å; P97-Y136 VanDerWaalsContact O-CD1 3.27Å; P97-Y136 WeakPolarHBondContact O-CD1 3.16Å; C98-Y136 HydrophobicContact CB-CE1 3.97Å; L112-Y136 HydrophobicContact CD1-CE2 4.32Å; L116-Y136 HydrophobicContact CD1-CD2 4.03Å; L116-Y136 HydrophobicContact CD1-CE2 3.93Å; L116-Y136 HydrophobicContact CD2-CE2 4.1Å; P127-Y136 HydrophobicContact CB-CD2 4.1Å; P127-Y136 WeakPolarHBondContact O-CB 3.2Å; P127-Y136 VanDerWaalsContact O-CD2 3.25Å; P127-Y136 WeakPolarHBondContact O-CD2 3.33Å; P127-Y136 PolarHBondContact O-N 3.29Å; Q128-Y136 VanDerWaalsContact C-CE2 3.43Å; Q128-Y136 WeakPolarHBondContact O-CE2 3.3Å; C129-Y136 WeakPolarHBondContact CA-OH 3.2Å; C129-Y136 HydrophobicContact CB-CE1 4.1Å; Y134-Y136 PolarHBondContact O-N 2.75Å; Y136-T138 WeakPolarHBondContact O-CG2 3.41Å; Y136-T138 PolarHBondContact O-N 3.26Å; Y136-V241 HydrophobicContact CD1-CG1 4.3Å; Y136-V241 HydrophobicContact CG-CG1 4.36Å
137	K	78.5	Confident	74.1	Confident	101 Å²	101	84.4 Å²	84.4	44%	0.439	41%	0.406	S	S	.	.			trans	-74.8	108.2	170.8	-72.3	-177.9	178.5	176.1	0	108.5	Y134 Q135 K242	Y134-K137 WeakPolarHBondContact OH-CE 3.36Å; Q135-K137 PolarHBondContact O-N 3.35Å; K137-K242 HydrophobicContact CB-CB 4.33Å; K137-K242 PolarHBondContact O-N 3.46Å
138	T	73.9	Confident	73	Confident	42 Å²	42	90.9 Å²	90.9	26%	0.258	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	141	-178.8	79	0	0	0	0	110.1	P127 Y136 W239	P127-T138 HydrophobicContact CG-CG2 3.83Å; Y136-T138 WeakPolarHBondContact O-CG2 3.41Å; Y136-T138 PolarHBondContact O-N 3.26Å; T138-W239 HydrophobicContact CG2-CD2 4.42Å; T138-W239 HydrophobicContact CG2-CE3 3.2Å; T138-W239 HydrophobicContact CG2-CZ3 3.34Å
139	H	67.6	Low	71.6	Confident	90 Å²	90	91.2 Å²	91.2	42%	0.417	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	137.6	165.2	-72	-91.7	0	0	0	109.2	C141 R240 K242	H139-C141 PolarHBondContact O-N 3.32Å; H139-R240 PolarHBondContact N-O 3.5Å; H139-R240 VanDerWaalsContact N-O 3.14Å; H139-R240 PolarHBondContact O-N 3.48Å; H139-K242 VanDerWaalsContact CD2-CD 3.42Å; H139-K242 WeakPolarHBondContact CD2-CD 3.49Å; H139-K242 WeakPolarHBondContact CD2-CE 3.15Å; H139-K242 PolarHBondContact CD2-NZ 2.95Å; H139-K242 WeakPolarHBondContact NE2-CD 3.47Å; H139-K242 WeakPolarHBondContact NE2-CE 3.44Å; H139-K242 PolarHBondContact NE2-NZ 3.24Å
140	H	65.1	Low	70.3	Confident	109 Å²	109	92.3 Å²	92.3	51%	0.505	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	120.3	172.2	-59.1	-54.2	0	0	0	108.5	R237	H140-R237 PolarHBondContact CD2-NH2 2.86Å; H140-R237 VanDerWaalsContact CD2-NH2 3.34Å; H140-R237 PolarHBondContact CE1-NE 3.38Å; H140-R237 PolarHBondContact CE1-NH2 3.23Å; H140-R237 PolarHBondContact ND1-NE 3.5Å; H140-R237 PolarHBondContact NE2-NH2 3.49Å
141	C	61.6	Low	69	Low	34 Å²	34	100 Å²	100	23%	0.23	48%	0.477	C	S	.	.			trans	-122.6	109.3	174.6	-66.6	0	0	0	0	107.6	H139 T143 H238	H139-C141 PolarHBondContact O-N 3.32Å; C141-T143 PolarHBondContact O-N 2.98Å; C141-H238 PolarHBondContact N-O 3.22Å; C141-H238 VanDerWaalsContact N-O 3.12Å; C141-H238 VanDerWaalsContact O-O 3.09Å
142	F	58.2	Low	67.7	Low	107 Å²	107	96.1 Å²	96.1	47%	0.469	46%	0.458	S	S	.	.			trans	-81.1	107.9	174.3	-168.6	-111.7	0	0	0	108.9	F144 W233 N236	F142-F144 HydrophobicContact CE1-CB 4.31Å; F142-F144 AromaticContact CE1-CD2 3.56Å; F142-F144 HydrophobicContact CE1-CD2 3.56Å; F142-F144 HydrophobicContact CE1-CE2 4.38Å; F142-F144 HydrophobicContact CE1-CG 4.42Å; F142-F144 AromaticContact CZ-CD2 3.99Å; F142-F144 HydrophobicContact CZ-CD2 3.99Å; F142-W233 HydrophobicContact CE2-CE3 4.45Å; F142-N236 HydrophobicContact CE2-CB 4.18Å
143	T	57.8	Low	66.9	Low	73 Å²	73	97.5 Å²	97.5	45%	0.448	47%	0.465	S	S	.	.			trans	-104.8	92	176.7	-54.3	0	0	0	0	108.6	C141 R145 R146	C141-T143 PolarHBondContact O-N 2.98Å; T143-R145 HydrophobicContact CG2-CB 4.41Å; T143-R145 PolarHBondContact O-N 2.83Å; T143-R145 VanDerWaalsContact O-N 3.09Å; T143-R146 PolarHBondContact O-N 2.76Å
144	F	57	Low	66.3	Low	166 Å²	166	106 Å²	106	73%	0.728	49%	0.485	S	S	*	.	G	3₁₀ helix	trans	-57.8	-26.3	-176.7	-162.7	-105	0	0	0	113.7	F142 R146 A147	F142-F144 HydrophobicContact CE1-CB 4.31Å; F142-F144 AromaticContact CE1-CD2 3.56Å; F142-F144 HydrophobicContact CE1-CD2 3.56Å; F142-F144 HydrophobicContact CE1-CE2 4.38Å; F142-F144 HydrophobicContact CE1-CG 4.42Å; F142-F144 AromaticContact CZ-CD2 3.99Å; F142-F144 HydrophobicContact CZ-CD2 3.99Å; F144-R146 VanDerWaalsContact C-N 3.26Å; F144-R146 PolarHBondContact O-N 3.47Å; F144-A147 PolarHBondContact O-N 3.33Å
145	R	51.1	Low	65.6	Low	249 Å²	249	111.7 Å²	111.7	94%	0.94	51%	0.513	S	S	*	.	G	3₁₀ helix	trans	-67.7	-14	-175.7	-99.9	-176.4	168.1	-156.9	-3.3	115.8	T143	T143-R145 HydrophobicContact CG2-CB 4.41Å; T143-R145 PolarHBondContact O-N 2.83Å; T143-R145 VanDerWaalsContact O-N 3.09Å
146	R	55.6	Low	65	Low	211 Å²	211	108.2 Å²	108.2	80%	0.796	50%	0.498	S	S	*	.	G	3₁₀ helix	trans	-133.5	37.6	-179.9	-157.1	-178.8	-85.8	173.7	-7.9	110.9	T143 F144 E148	T143-R146 PolarHBondContact O-N 2.76Å; F144-R146 VanDerWaalsContact C-N 3.26Å; F144-R146 PolarHBondContact O-N 3.47Å; R146-E148 PolarHBondContact O-N 2.83Å
147	A	56.5	Low	64.4	Low	45 Å²	45	114.3 Å²	114.3	37%	0.372	52%	0.521	S	S	.	.	P	Polyproline II helix	trans	-66.8	116.5	177.5	0	0	0	0	0	109.8	F144 N236	F144-A147 PolarHBondContact O-N 3.33Å; A147-N236 WeakPolarHBondContact CA-OD1 3.46Å
148	E	58.8	Low	64.5	Low	147 Å²	147	113.6 Å²	113.6	69%	0.687	53%	0.525	S	S	*	.	P	Polyproline II helix	trans	-86.4	122.4	170.4	-166.4	162.4	-166	0	0	107.6	R146 N236	R146-E148 PolarHBondContact O-N 2.83Å; E148-N236 PolarHBondContact N-OD1 3.06Å; E148-N236 PolarHBondContact O-ND2 3.01Å; E148-N236 PolarHBondContact O-OD1 2.8Å
149	V	58.1	Low	64.8	Low	103 Å²	103	113 Å²	113	62%	0.624	52%	0.52	S	S	*	.	P	Polyproline II helix	trans	-80.1	129.6	178.3	-173.6	0	0	0	0	106.8	R151	V149-R151 PolarHBondContact O-N 3.38Å
150	P	63	Low	65.3	Low	26 Å²	26	109.5 Å²	109.5	17%	0.169	50%	0.504	C	S	.	.	P	Polyproline II helix	trans	-52.4	144.8	172.9	21.5	-31.4	0	0	0	109.1	C152 C232 I235	P150-C152 PolarHBondContact O-N 3.47Å; P150-C152 PolarHBondContact O-SG 2.91Å; P150-C232 HydrophobicContact CG-CB 4.46Å; P150-I235 HydrophobicContact CB-CD1 3.87Å; P150-I235 HydrophobicContact CG-CD1 4.45Å
151	R	60.7	Low	66.2	Low	234 Å²	234	109.8 Å²	109.8	88%	0.883	51%	0.508	S	S	*	.			trans	-63.8	88	177.2	-71.2	-171.4	176	-177.6	0	109.3	V149	V149-R151 PolarHBondContact O-N 3.38Å
152	C	62.4	Low	67.3	Low	21 Å²	21	112.1 Å²	112.1	14%	0.142	52%	0.518	C	S	.	.			trans	-79.8	127.9	171.7	-58.6	0	0	0	0	108.6	P150 R157	P150-C152 PolarHBondContact O-N 3.47Å; P150-C152 PolarHBondContact O-SG 2.91Å; C152-R157 HydrophobicContact CB-CG 3.87Å; C152-R157 PolarHBondContact O-NE 3.39Å
153	T	72.4	Confident	68.6	Low	83 Å²	83	108.8 Å²	108.8	51%	0.509	50%	0.503	S	S	.	.			trans	-59.8	150.3	172.3	-56.9	0	0	0	0	109.4	Q155 D156 R157	T153-Q155 HydrophobicContact CG2-CB 4.42Å; T153-Q155 PolarHBondContact O-N 2.93Å; T153-Q155 VanDerWaalsContact O-N 3.16Å; T153-D156 PolarHBondContact O-N 3.33Å; T153-D156 VanDerWaalsContact O-N 3.15Å; T153-R157 PolarHBondContact O-N 2.95Å
154	R	74.8	Confident	69.9	Low	219 Å²	219	110 Å²	110	83%	0.826	51%	0.506	S	S	*	.	H	α-helix	trans	-55.7	-34.3	-179.9	-83.1	-160.6	170.7	-169.6	-0.7	112.7	R157 V158	R154-R157 PolarHBondContact O-N 3.33Å; R154-V158 WeakPolarHBondContact O-CG2 3.23Å; R154-V158 PolarHBondContact O-N 2.99Å; R154-V158 VanDerWaalsContact O-N 3.13Å
155	Q	74	Confident	71.3	Confident	157 Å²	157	104.5 Å²	104.5	73%	0.734	49%	0.489	S	S	*	.	H	α-helix	trans	-62.4	-48.9	176.8	-70.3	177.6	-14.8	0	0	111.9	T153 R157 V158 L159	T153-Q155 HydrophobicContact CG2-CB 4.42Å; T153-Q155 PolarHBondContact O-N 2.93Å; T153-Q155 VanDerWaalsContact O-N 3.16Å; Q155-R157 VanDerWaalsContact C-N 3.3Å; Q155-R157 PolarHBondContact O-N 3.45Å; Q155-V158 PolarHBondContact O-N 3.29Å; Q155-V158 VanDerWaalsContact O-N 3.17Å; Q155-L159 PolarHBondContact O-N 2.9Å
156	D	73	Confident	73	Confident	44 Å²	44	94.3 Å²	94.3	24%	0.235	45%	0.452	C	S	.	.	H	α-helix	trans	-59.8	-41.8	177.5	-58.3	-31.6	0	0	0	111.5	T153 V158 L159 H160	T153-D156 PolarHBondContact O-N 3.33Å; T153-D156 VanDerWaalsContact O-N 3.15Å; D156-V158 VanDerWaalsContact C-N 3.35Å; D156-V158 PolarHBondContact O-N 3.39Å; D156-L159 PolarHBondContact O-N 2.74Å; D156-H160 WeakPolarHBondContact O-CB 3.31Å; D156-H160 PolarHBondContact O-CD2 3.46Å; D156-H160 VanDerWaalsContact O-CG 3.23Å; D156-H160 PolarHBondContact O-N 3.37Å
157	R	73.1	Confident	74.5	Confident	140 Å²	140	85.6 Å²	85.6	53%	0.528	43%	0.425	S	S	.	.	H	α-helix	trans	-60.1	-45.4	177.1	-64.1	-174.5	-166	-164.5	-1.8	111.7	C152 T153 R154 Q155 L159 H160 L161	C152-R157 HydrophobicContact CB-CG 3.87Å; C152-R157 PolarHBondContact O-NE 3.39Å; T153-R157 PolarHBondContact O-N 2.95Å; R154-R157 PolarHBondContact O-N 3.33Å; Q155-R157 VanDerWaalsContact C-N 3.3Å; Q155-R157 PolarHBondContact O-N 3.45Å; R157-L159 VanDerWaalsContact C-N 3.34Å; R157-H160 PolarHBondContact O-N 3.47Å; R157-L161 WeakPolarHBondContact O-CB 3.34Å; R157-L161 WeakPolarHBondContact O-CG 3.22Å; R157-L161 PolarHBondContact O-N 2.95Å
158	V	80.8	Confident	76.1	Confident	85 Å²	85	90 Å²	90	52%	0.515	44%	0.436	S	S	.	.	H	α-helix	trans	-63	-43.6	177.8	173	0	0	0	0	110.4	R154 Q155 D156 H160 L161 L162	R154-V158 WeakPolarHBondContact O-CG2 3.23Å; R154-V158 PolarHBondContact O-N 2.99Å; R154-V158 VanDerWaalsContact O-N 3.13Å; Q155-V158 PolarHBondContact O-N 3.29Å; Q155-V158 VanDerWaalsContact O-N 3.17Å; D156-V158 VanDerWaalsContact C-N 3.35Å; D156-V158 PolarHBondContact O-N 3.39Å; V158-H160 PolarHBondContact O-N 3.29Å; V158-L161 PolarHBondContact O-N 2.83Å; V158-L162 HydrophobicContact CG1-CD1 4.18Å; V158-L162 WeakPolarHBondContact O-CG 3.3Å; V158-L162 PolarHBondContact O-N 3.35Å
159	L	79.3	Confident	77.6	Confident	30 Å²	30	85.8 Å²	85.8	16%	0.157	42%	0.42	C	S	.	.	H	α-helix	trans	-64.2	-40.8	-179.8	-167.6	58.5	0	0	0	112.3	Q155 D156 R157 L162 F163 T217 A221	Q155-L159 PolarHBondContact O-N 2.9Å; D156-L159 PolarHBondContact O-N 2.74Å; R157-L159 VanDerWaalsContact C-N 3.34Å; L159-L162 PolarHBondContact O-N 2.94Å; L159-F163 PolarHBondContact O-N 2.92Å; L159-T217 HydrophobicContact CD1-CG2 3.6Å; L159-A221 HydrophobicContact CD2-CB 3.5Å; L159-A221 VanDerWaalsContact CD2-CB 3.5Å; L159-A221 HydrophobicContact CG-CB 4.32Å
160	H	79.2	Confident	79	Confident	17 Å²	17	82.4 Å²	82.4	8%	0.079	40%	0.398	C	S	.	.	H	α-helix	trans	-68	-38.9	174.5	-69.5	-38.6	0	0	0	113.2	D156 R157 V158 L162 F163 L164 T223 L225 L228	D156-H160 WeakPolarHBondContact O-CB 3.31Å; D156-H160 PolarHBondContact O-CD2 3.46Å; D156-H160 VanDerWaalsContact O-CG 3.23Å; D156-H160 PolarHBondContact O-N 3.37Å; R157-H160 PolarHBondContact O-N 3.47Å; V158-H160 PolarHBondContact O-N 3.29Å; H160-L162 VanDerWaalsContact C-N 3.34Å; H160-F163 PolarHBondContact O-N 3.3Å; H160-L164 WeakPolarHBondContact O-CB 3.3Å; H160-L164 VanDerWaalsContact O-CG 3.29Å; H160-L164 WeakPolarHBondContact O-CG 3.42Å; H160-L164 PolarHBondContact O-N 2.8Å; H160-T223 PolarHBondContact CE1-O 3.41Å; H160-L225 HydrophobicContact CB-CD2 3.77Å; H160-L225 WeakPolarHBondContact ND1-CD2 3.33Å; H160-L225 WeakPolarHBondContact ND1-CG 3.31Å; H160-L228 WeakPolarHBondContact CD2-CD1 3.48Å; H160-L228 WeakPolarHBondContact NE2-CD1 3.35Å
161	L	82.6	Confident	80.3	Confident	115 Å²	115	85.1 Å²	85.1	60%	0.602	41%	0.414	S	S	*	.	H	α-helix	trans	-63.1	-41.5	173.6	-73.8	173.2	0	0	0	111.4	R157 V158 L164 S165	R157-L161 WeakPolarHBondContact O-CB 3.34Å; R157-L161 WeakPolarHBondContact O-CG 3.22Å; R157-L161 PolarHBondContact O-N 2.95Å; V158-L161 PolarHBondContact O-N 2.83Å; L161-L164 PolarHBondContact O-N 2.89Å; L161-S165 PolarHBondContact O-N 3.47Å; L161-S165 PolarHBondContact O-OG 3.4Å
162	L	85.1	Confident	81.8	Confident	82 Å²	82	76 Å²	76	43%	0.429	39%	0.386	S	S	.	.	H	α-helix	trans	-62.4	-44.8	174.1	-74.2	173.1	0	0	0	111.6	V158 L159 H160 L164 S165 M166 T217	V158-L162 HydrophobicContact CG1-CD1 4.18Å; V158-L162 WeakPolarHBondContact O-CG 3.3Å; V158-L162 PolarHBondContact O-N 3.35Å; L159-L162 PolarHBondContact O-N 2.94Å; H160-L162 VanDerWaalsContact C-N 3.34Å; L162-L164 PolarHBondContact O-N 2.8Å; L162-S165 WeakPolarHBondContact CA-OG 3.43Å; L162-S165 PolarHBondContact O-N 3.21Å; L162-S165 PolarHBondContact O-OG 3.04Å; L162-M166 VanDerWaalsContact O-CG 3.3Å; L162-M166 WeakPolarHBondContact O-CG 3.4Å; L162-M166 PolarHBondContact O-N 3.21Å; L162-T217 HydrophobicContact CB-CG2 4.41Å
163	F	85.4	Confident	83	Confident	38 Å²	38	75.2 Å²	75.2	17%	0.167	38%	0.381	C	S	.	.	H	α-helix	trans	-59.9	-46.4	175.9	-180	-89.4	0	0	0	111.7	L159 H160 S165 M166 A167 A214 Q218 L225	L159-F163 PolarHBondContact O-N 2.92Å; H160-F163 PolarHBondContact O-N 3.3Å; F163-S165 VanDerWaalsContact C-N 3.35Å; F163-S165 PolarHBondContact O-N 3.36Å; F163-M166 PolarHBondContact O-N 2.81Å; F163-A167 WeakPolarHBondContact O-CB 3.4Å; F163-A167 PolarHBondContact O-N 3.21Å; F163-A214 HydrophobicContact CD2-CB 3.97Å; F163-A214 HydrophobicContact CE2-CB 3.83Å; F163-Q218 HydrophobicContact CD2-CG 3.87Å; F163-Q218 HydrophobicContact CE2-CG 3.64Å; F163-L225 HydrophobicContact CB-CD1 4.48Å; F163-L225 HydrophobicContact CD1-CD1 3.18Å; F163-L225 HydrophobicContact CD1-CG 4.41Å; F163-L225 HydrophobicContact CE1-CD1 3.59Å; F163-L225 HydrophobicContact CG-CD1 4.03Å
164	L	84.3	Confident	83.8	Confident	98 Å²	98	73 Å²	73	51%	0.513	37%	0.371	S	S	.	.	H	α-helix	trans	-63.2	-39.2	177.8	-71.7	173.1	0	0	0	112	H160 L161 L162 A167 F168 L225	H160-L164 WeakPolarHBondContact O-CB 3.3Å; H160-L164 VanDerWaalsContact O-CG 3.29Å; H160-L164 WeakPolarHBondContact O-CG 3.42Å; H160-L164 PolarHBondContact O-N 2.8Å; L161-L164 PolarHBondContact O-N 2.89Å; L162-L164 PolarHBondContact O-N 2.8Å; L164-A167 PolarHBondContact O-N 3.24Å; L164-F168 PolarHBondContact O-N 2.88Å; L164-L225 HydrophobicContact CD2-CD1 4.39Å
165	S	88.1	Confident	84.5	Confident	51 Å²	51	68.5 Å²	68.5	36%	0.357	36%	0.358	S	S	.	.	H	α-helix	trans	-65.9	-40.8	175.8	64.2	0	0	0	0	111.9	L161 L162 F163 F168 V169	L161-S165 PolarHBondContact O-N 3.47Å; L161-S165 PolarHBondContact O-OG 3.4Å; L162-S165 WeakPolarHBondContact CA-OG 3.43Å; L162-S165 PolarHBondContact O-N 3.21Å; L162-S165 PolarHBondContact O-OG 3.04Å; F163-S165 VanDerWaalsContact C-N 3.35Å; F163-S165 PolarHBondContact O-N 3.36Å; S165-F168 PolarHBondContact O-N 3.38Å; S165-V169 WeakPolarHBondContact O-CG2 3.46Å; S165-V169 PolarHBondContact O-N 2.91Å
166	M	87.1	Confident	85.1	Confident	35 Å²	35	64.4 Å²	64.4	17%	0.172	34%	0.34	C	S	.	.	H	α-helix	trans	-67.2	-38.7	176	-59.6	-36.7	-75.8	0	0	111.6	L162 F163 F168 V169 M170 A210 V213 A214	L162-M166 VanDerWaalsContact O-CG 3.3Å; L162-M166 WeakPolarHBondContact O-CG 3.4Å; L162-M166 PolarHBondContact O-N 3.21Å; F163-M166 PolarHBondContact O-N 2.81Å; M166-F168 VanDerWaalsContact C-N 3.33Å; M166-F168 PolarHBondContact O-N 3.16Å; M166-V169 PolarHBondContact O-N 2.82Å; M166-M170 WeakPolarHBondContact O-CG 3.37Å; M166-M170 PolarHBondContact O-N 3.34Å; M166-A210 HydrophobicContact CB-CB 4.35Å; M166-A210 VanDerWaalsContact CE-CA 3.42Å; M166-A210 HydrophobicContact CE-CB 3.64Å; M166-V213 HydrophobicContact CE-CB 4.07Å; M166-V213 HydrophobicContact CE-CG1 4.26Å; M166-V213 HydrophobicContact CE-CG2 4.38Å; M166-V213 HydrophobicContact CG-CB 4.06Å; M166-V213 HydrophobicContact CG-CG1 3.67Å; M166-V213 HydrophobicContact SD-CG1 4.13Å; M166-A214 HydrophobicContact CB-CB 4.25Å
167	A	86.1	Confident	85.7	Confident	28 Å²	28	63.2 Å²	63.2	23%	0.231	34%	0.335	C	S	.	.	H	α-helix	trans	-60.3	-42.5	173.7	0	0	0	0	0	112	F163 L164 M170 T171	F163-A167 WeakPolarHBondContact O-CB 3.4Å; F163-A167 PolarHBondContact O-N 3.21Å; L164-A167 PolarHBondContact O-N 3.24Å; A167-M170 HydrophobicContact CB-CE 4.26Å; A167-M170 PolarHBondContact O-N 3.3Å; A167-T171 WeakPolarHBondContact O-CG2 3.3Å; A167-T171 PolarHBondContact O-N 2.93Å; A167-T171 PolarHBondContact O-OG1 2.87Å
168	F	90.2	Very high	86.3	Confident	138 Å²	138	61.6 Å²	61.6	61%	0.605	34%	0.336	S	S	*	.	H	α-helix	trans	-60.4	-48.3	174	-177.7	-101.7	0	0	0	111.5	L164 S165 M166 M170 T171 C172	L164-F168 PolarHBondContact O-N 2.88Å; S165-F168 PolarHBondContact O-N 3.38Å; M166-F168 VanDerWaalsContact C-N 3.33Å; M166-F168 PolarHBondContact O-N 3.16Å; F168-M170 VanDerWaalsContact C-N 3.31Å; F168-M170 PolarHBondContact O-N 3.02Å; F168-T171 WeakPolarHBondContact CA-OG1 3.44Å; F168-T171 PolarHBondContact O-N 3.43Å; F168-T171 VanDerWaalsContact O-N 3.11Å; F168-T171 PolarHBondContact O-OG1 3.24Å; F168-C172 VanDerWaalsContact CE1-SG 3.51Å; F168-C172 WeakPolarHBondContact CZ-SG 3.16Å; F168-C172 PolarHBondContact O-N 3.41Å; F168-C172 PolarHBondContact O-SG 3.28Å; F168-C172 VanDerWaalsContact O-SG 3.39Å
169	V	90.2	Very high	86.5	Confident	57 Å²	57	61.6 Å²	61.6	35%	0.345	33%	0.333	S	S	.	.	H	α-helix	trans	-58.9	-40.8	176.2	173	0	0	0	0	111.7	S165 M166 C172 S173 A210	S165-V169 WeakPolarHBondContact O-CG2 3.46Å; S165-V169 PolarHBondContact O-N 2.91Å; M166-V169 PolarHBondContact O-N 2.82Å; V169-C172 PolarHBondContact O-N 2.91Å; V169-S173 VanDerWaalsContact O-CB 3.3Å; V169-S173 WeakPolarHBondContact O-CB 3.46Å; V169-S173 PolarHBondContact O-N 2.92Å; V169-S173 PolarHBondContact O-OG 3.47Å; V169-A210 HydrophobicContact CG1-CB 4.2Å
170	M	87.9	Confident	86.5	Confident	32 Å²	32	65 Å²	65	16%	0.158	34%	0.344	C	S	.	.	H	α-helix	trans	-61.3	-45.9	173.8	-71.9	-171	-65.2	0	0	111.8	M166 A167 F168 S173 A174 F207 A210 F211 A214	M166-M170 WeakPolarHBondContact O-CG 3.37Å; M166-M170 PolarHBondContact O-N 3.34Å; A167-M170 HydrophobicContact CB-CE 4.26Å; A167-M170 PolarHBondContact O-N 3.3Å; F168-M170 VanDerWaalsContact C-N 3.31Å; F168-M170 PolarHBondContact O-N 3.02Å; M170-S173 WeakPolarHBondContact CA-OG 3.24Å; M170-S173 PolarHBondContact O-OG 3.37Å; M170-A174 VanDerWaalsContact O-CB 3.26Å; M170-A174 WeakPolarHBondContact O-CB 3.35Å; M170-A174 PolarHBondContact O-N 3.45Å; M170-F207 HydrophobicContact CB-CD2 4.01Å; M170-F207 HydrophobicContact CB-CE2 4.04Å; M170-F207 HydrophobicContact CG-CD2 4.04Å; M170-F207 HydrophobicContact CG-CE2 4.17Å; M170-F207 HydrophobicContact SD-CE2 4.29Å; M170-A210 HydrophobicContact CG-CB 3.59Å; M170-F211 HydrophobicContact SD-CB 3.94Å; M170-F211 HydrophobicContact SD-CD2 4.28Å; M170-A214 HydrophobicContact CE-CB 4.21Å
171	T	90.4	Very high	86.4	Confident	84 Å²	84	68.9 Å²	68.9	52%	0.515	37%	0.365	S	S	.	.	H	α-helix	trans	-66.1	-41.3	178.8	56.7	0	0	0	0	112.6	A167 F168 F175	A167-T171 WeakPolarHBondContact O-CG2 3.3Å; A167-T171 PolarHBondContact O-N 2.93Å; A167-T171 PolarHBondContact O-OG1 2.87Å; F168-T171 WeakPolarHBondContact CA-OG1 3.44Å; F168-T171 PolarHBondContact O-N 3.43Å; F168-T171 VanDerWaalsContact O-N 3.11Å; F168-T171 PolarHBondContact O-OG1 3.24Å; T171-F175 WeakPolarHBondContact O-CB 3.11Å; T171-F175 PolarHBondContact O-N 3.46Å
172	C	90.7	Very high	86.4	Confident	41 Å²	41	67.1 Å²	67.1	28%	0.277	36%	0.362	S	S	.	.	H	α-helix	trans	-67.9	-45	178.5	-68.8	0	0	0	0	111.7	F168 V169 F175 I176	F168-C172 VanDerWaalsContact CE1-SG 3.51Å; F168-C172 WeakPolarHBondContact CZ-SG 3.16Å; F168-C172 PolarHBondContact O-N 3.41Å; F168-C172 PolarHBondContact O-SG 3.28Å; F168-C172 VanDerWaalsContact O-SG 3.39Å; V169-C172 PolarHBondContact O-N 2.91Å; C172-F175 PolarHBondContact O-N 3.35Å; C172-I176 WeakPolarHBondContact O-CB 3.14Å; C172-I176 WeakPolarHBondContact O-CD1 3.46Å; C172-I176 WeakPolarHBondContact O-CG1 3.29Å; C172-I176 PolarHBondContact O-N 3.05Å
173	S	88.8	Confident	86	Confident	5 Å²	5	69 Å²	69	4%	0.035	37%	0.369	C	S	.	.	H	α-helix	trans	-63.9	-41.3	177.7	54.7	0	0	0	0	112.2	V169 M170 S177	V169-S173 VanDerWaalsContact O-CB 3.3Å; V169-S173 WeakPolarHBondContact O-CB 3.46Å; V169-S173 PolarHBondContact O-N 2.92Å; V169-S173 PolarHBondContact O-OG 3.47Å; M170-S173 WeakPolarHBondContact CA-OG 3.24Å; M170-S173 PolarHBondContact O-OG 3.37Å; S173-S177 WeakPolarHBondContact O-CB 3.28Å; S173-S177 PolarHBondContact O-N 3.41Å; S173-S177 PolarHBondContact O-OG 3.25Å
174	A	88.3	Confident	85.1	Confident	37 Å²	37	70.1 Å²	70.1	31%	0.306	38%	0.376	S	S	.	.	H	α-helix	trans	-64	-46	173.6	0	0	0	0	0	111.7	M170 S177 I178	M170-A174 VanDerWaalsContact O-CB 3.26Å; M170-A174 WeakPolarHBondContact O-CB 3.35Å; M170-A174 PolarHBondContact O-N 3.45Å; A174-S177 WeakPolarHBondContact O-CB 3.36Å; A174-S177 PolarHBondContact O-N 2.95Å; A174-I178 VanDerWaalsContact O-CG1 3.27Å; A174-I178 WeakPolarHBondContact O-CG1 3Å; A174-I178 PolarHBondContact O-N 3.3Å
175	F	89.7	Confident	84.2	Confident	125 Å²	125	70.3 Å²	70.3	55%	0.548	39%	0.386	S	S	.	.	H	α-helix	trans	-62	-45.9	178.4	-177.4	-108.1	0	0	0	111.9	T171 C172 S177 I178 L179	T171-F175 WeakPolarHBondContact O-CB 3.11Å; T171-F175 PolarHBondContact O-N 3.46Å; C172-F175 PolarHBondContact O-N 3.35Å; F175-S177 VanDerWaalsContact C-N 3.33Å; F175-S177 PolarHBondContact O-N 2.8Å; F175-I178 PolarHBondContact O-N 3.41Å; F175-L179 HydrophobicContact CD1-CD1 3.8Å; F175-L179 HydrophobicContact CD1-CG 4.21Å; F175-L179 HydrophobicContact CE1-CD1 3.31Å; F175-L179 HydrophobicContact CE1-CD2 4.38Å; F175-L179 HydrophobicContact CE1-CG 3.91Å; F175-L179 HydrophobicContact CE2-CD2 4.28Å; F175-L179 HydrophobicContact CE2-CG 4.34Å; F175-L179 HydrophobicContact CZ-CD1 3.75Å; F175-L179 HydrophobicContact CZ-CD2 3.96Å; F175-L179 HydrophobicContact CZ-CG 3.97Å; F175-L179 WeakPolarHBondContact O-CG 3.38Å; F175-L179 PolarHBondContact O-N 2.81Å
176	I	87.3	Confident	82.9	Confident	70 Å²	70	74.6 Å²	74.6	36%	0.359	41%	0.405	S	S	.	.	H	α-helix	trans	-58.1	-47.1	175	-71.4	164.5	0	0	0	110	C172 I178 L179 Y180	C172-I176 WeakPolarHBondContact O-CB 3.14Å; C172-I176 WeakPolarHBondContact O-CD1 3.46Å; C172-I176 WeakPolarHBondContact O-CG1 3.29Å; C172-I176 PolarHBondContact O-N 3.05Å; I176-I178 VanDerWaalsContact C-N 3.33Å; I176-I178 PolarHBondContact O-N 2.74Å; I176-L179 PolarHBondContact O-N 3.39Å; I176-Y180 HydrophobicContact CG2-CD2 3.55Å; I176-Y180 HydrophobicContact CG2-CE2 3.52Å; I176-Y180 VanDerWaalsContact O-CD2 3.23Å; I176-Y180 WeakPolarHBondContact O-CD2 3.35Å; I176-Y180 PolarHBondContact O-N 3.46Å
177	S	85.7	Confident	81.5	Confident	19 Å²	19	76.3 Å²	76.3	13%	0.133	42%	0.417	C	S	.	.	H	α-helix	trans	-59.2	-43	177.8	-56.3	0	0	0	0	112	S173 A174 F175 Y180 L181 C203	S173-S177 WeakPolarHBondContact O-CB 3.28Å; S173-S177 PolarHBondContact O-N 3.41Å; S173-S177 PolarHBondContact O-OG 3.25Å; A174-S177 WeakPolarHBondContact O-CB 3.36Å; A174-S177 PolarHBondContact O-N 2.95Å; F175-S177 VanDerWaalsContact C-N 3.33Å; F175-S177 PolarHBondContact O-N 2.8Å; S177-Y180 PolarHBondContact O-N 3.13Å; S177-L181 WeakPolarHBondContact O-CB 3.42Å; S177-L181 VanDerWaalsContact O-CG 3.26Å; S177-L181 WeakPolarHBondContact O-CG 3.37Å; S177-L181 PolarHBondContact O-N 3.15Å; S177-C203 WeakPolarHBondContact OG-CB 3.46Å
178	I	84.9	Confident	80.1	Confident	106 Å²	106	86.2 Å²	86.2	54%	0.544	45%	0.449	S	S	.	.	H	α-helix	trans	-65	-42.2	177.1	-67.5	163.5	0	0	0	111.2	A174 F175 I176 L181 S182	A174-I178 VanDerWaalsContact O-CG1 3.27Å; A174-I178 WeakPolarHBondContact O-CG1 3Å; A174-I178 PolarHBondContact O-N 3.3Å; F175-I178 PolarHBondContact O-N 3.41Å; I176-I178 VanDerWaalsContact C-N 3.33Å; I176-I178 PolarHBondContact O-N 2.74Å; I178-L181 PolarHBondContact O-N 3.43Å; I178-S182 VanDerWaalsContact O-CB 3.26Å; I178-S182 WeakPolarHBondContact O-CB 3.41Å; I178-S182 PolarHBondContact O-N 2.77Å
179	L	84.7	Confident	78.5	Confident	86 Å²	86	86.7 Å²	86.7	45%	0.45	46%	0.455	S	S	.	.	H	α-helix	trans	-62.5	-43.4	177.2	-72	-175.9	0	0	0	111.7	F175 I176 S182 Q183	F175-L179 HydrophobicContact CD1-CD1 3.8Å; F175-L179 HydrophobicContact CD1-CG 4.21Å; F175-L179 HydrophobicContact CE1-CD1 3.31Å; F175-L179 HydrophobicContact CE1-CD2 4.38Å; F175-L179 HydrophobicContact CE1-CG 3.91Å; F175-L179 HydrophobicContact CE2-CD2 4.28Å; F175-L179 HydrophobicContact CE2-CG 4.34Å; F175-L179 HydrophobicContact CZ-CD1 3.75Å; F175-L179 HydrophobicContact CZ-CD2 3.96Å; F175-L179 HydrophobicContact CZ-CG 3.97Å; F175-L179 WeakPolarHBondContact O-CG 3.38Å; F175-L179 PolarHBondContact O-N 2.81Å; I176-L179 PolarHBondContact O-N 3.39Å; L179-S182 PolarHBondContact O-N 3.16Å; L179-Q183 WeakPolarHBondContact O-CB 3.24Å; L179-Q183 PolarHBondContact O-N 2.82Å
180	Y	80.3	Confident	77	Confident	100 Å²	100	94.5 Å²	94.5	39%	0.392	48%	0.478	S	S	.	.	H	α-helix	trans	-63.8	-44.3	176.5	-86.5	-73	0	0	0	111.9	I176 S177 S182 Q183 D184	I176-Y180 HydrophobicContact CG2-CD2 3.55Å; I176-Y180 HydrophobicContact CG2-CE2 3.52Å; I176-Y180 VanDerWaalsContact O-CD2 3.23Å; I176-Y180 WeakPolarHBondContact O-CD2 3.35Å; I176-Y180 PolarHBondContact O-N 3.46Å; S177-Y180 PolarHBondContact O-N 3.13Å; Y180-S182 VanDerWaalsContact C-N 3.33Å; Y180-S182 PolarHBondContact O-N 3.17Å; Y180-Q183 PolarHBondContact O-N 3.17Å; Y180-D184 PolarHBondContact O-N 3.44Å
181	L	77.6	Confident	75.5	Confident	100 Å²	100	100.8 Å²	100.8	52%	0.524	51%	0.512	S	S	.	.	H	α-helix	trans	-63.3	-38.9	175.7	-71.2	171.6	0	0	0	112.2	S177 I178	S177-L181 WeakPolarHBondContact O-CB 3.42Å; S177-L181 VanDerWaalsContact O-CG 3.26Å; S177-L181 WeakPolarHBondContact O-CG 3.37Å; S177-L181 PolarHBondContact O-N 3.15Å; I178-L181 PolarHBondContact O-N 3.43Å
182	S	82	Confident	74	Confident	77 Å²	77	100.5 Å²	100.5	54%	0.538	51%	0.507	S	S	.	.	H	α-helix	trans	-65.5	-39.6	176.8	-174.9	0	0	0	0	111.6	I178 L179 Y180 S185	I178-S182 VanDerWaalsContact O-CB 3.26Å; I178-S182 WeakPolarHBondContact O-CB 3.41Å; I178-S182 PolarHBondContact O-N 2.77Å; L179-S182 PolarHBondContact O-N 3.16Å; Y180-S182 VanDerWaalsContact C-N 3.33Å; Y180-S182 PolarHBondContact O-N 3.17Å; S182-S185 PolarHBondContact O-OG 3.23Å
183	Q	75.5	Confident	72.7	Confident	123 Å²	123	103.1 Å²	103.1	58%	0.575	52%	0.518	S	S	*	.	H	α-helix	trans	-71.3	-35.5	-180	-174	172.9	-9.3	0	0	113.4	L179 Y180 S185 N186 T187	L179-Q183 WeakPolarHBondContact O-CB 3.24Å; L179-Q183 PolarHBondContact O-N 2.82Å; Y180-Q183 PolarHBondContact O-N 3.17Å; Q183-S185 VanDerWaalsContact C-N 3.28Å; Q183-S185 PolarHBondContact O-N 3.04Å; Q183-N186 PolarHBondContact O-N 3Å; Q183-T187 PolarHBondContact O-N 2.93Å; Q183-T187 PolarHBondContact O-OG1 3.34Å
184	D	68.4	Low	71.7	Confident	60 Å²	60	108.8 Å²	108.8	32%	0.321	55%	0.547	S	S	.	.	H	α-helix	trans	-63.2	-34.6	178.8	-175.8	37.6	0	0	0	112.4	Y180 N186 T187 Q196	Y180-D184 PolarHBondContact O-N 3.44Å; D184-N186 PolarHBondContact O-N 3.33Å; D184-T187 PolarHBondContact O-N 3.41Å; D184-Q196 VanDerWaalsContact CB-NE2 3.27Å; D184-Q196 PolarHBondContact OD1-OE1 3.43Å; D184-Q196 PolarHBondContact OD2-NE2 3.34Å
185	S	63.6	Low	71.1	Confident	102 Å²	102	116.5 Å²	116.5	71%	0.713	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56	-22.6	175.9	75.6	0	0	0	0	113.9	S182 Q183	S182-S185 PolarHBondContact O-OG 3.23Å; Q183-S185 VanDerWaalsContact C-N 3.28Å; Q183-S185 PolarHBondContact O-N 3.04Å
186	N	61.1	Low	70.4	Confident	142 Å²	142	111.8 Å²	111.8	76%	0.759	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.5	-13.5	-174.3	-138.2	-20.4	0	0	0	114.1	Q183 D184	Q183-N186 PolarHBondContact O-N 3Å; D184-N186 PolarHBondContact O-N 3.33Å
187	T	58.2	Low	70	Confident	71 Å²	71	112 Å²	112	44%	0.436	55%	0.55	S	S	.	*	S	Bend	trans	-131.1	61.5	-163.8	-31.9	0	0	0	0	114.4	Q183 D184 M189	Q183-T187 PolarHBondContact O-N 2.93Å; Q183-T187 PolarHBondContact O-OG1 3.34Å; D184-T187 PolarHBondContact O-N 3.41Å; T187-M189 PolarHBondContact O-N 3.38Å
188	R	57.5	Low	69.9	Low	236 Å²	236	115.7 Å²	115.7	89%	0.891	57%	0.568	S	S	*	*			trans	25.7	80.1	154.3	-68.5	-179.5	-160.5	172.8	6.7	117.2	R190	R188-R190 PolarHBondContact O-N 2.89Å
189	M	56.2	Low	69.8	Low	148 Å²	148	112.3 Å²	112.3	73%	0.729	55%	0.552	S	S	*	*	S	Bend		36.2	85.7	112.8	-161.1	105.8	77.3	0	0	116.5	T187	T187-M189 PolarHBondContact O-N 3.38Å
190	R	57.4	Low	69.9	Low	221 Å²	221	110.2 Å²	110.2	83%	0.834	54%	0.542	S	S	*	.	S	Bend	trans	177.9	-31.3	139.5	-101.6	168.9	75.4	128.2	-0.5	115.3	R188	R188-R190 PolarHBondContact O-N 2.89Å
191	N	57.6	Low	70.2	Confident	163 Å²	163	110.3 Å²	110.3	87%	0.872	55%	0.549	S	S	*	.	S	Bend	trans	-110.6	-1.8	177.3	-74.1	-26	0	0	0	113.9
192	L	59.2	Low	70.7	Confident	78 Å²	78	107.9 Å²	107.9	41%	0.408	54%	0.54	S	S	.	.	S	Bend	trans	-92.1	-23.3	-178.5	-80.4	162.5	0	0	0	113.7	N194 R195 Q196	L192-N194 PolarHBondContact O-N 3.03Å; L192-R195 PolarHBondContact O-N 3.22Å; L192-Q196 VanDerWaalsContact O-CB 3.22Å; L192-Q196 WeakPolarHBondContact O-CB 3.14Å; L192-Q196 PolarHBondContact O-N 2.88Å
193	L	62.9	Low	71.1	Confident	97 Å²	97	104.8 Å²	104.8	51%	0.508	52%	0.519	S	S	.	.	H	α-helix	trans	-50	-52.7	-177.8	-92.8	141.1	0	0	0	112	R195 Q196 D197	L193-R195 VanDerWaalsContact C-N 3.35Å; L193-R195 PolarHBondContact O-N 3.23Å; L193-Q196 PolarHBondContact O-N 3.31Å; L193-D197 WeakPolarHBondContact O-CB 3.1Å; L193-D197 PolarHBondContact O-N 2.92Å
194	N	68.1	Low	71.8	Confident	123 Å²	123	101.4 Å²	101.4	66%	0.658	51%	0.508	S	S	*	.	H	α-helix	trans	-63.9	-36.5	-179.4	-162	18.8	0	0	0	113.2	L192 I198	L192-N194 PolarHBondContact O-N 3.03Å; N194-I198 WeakPolarHBondContact O-CD1 3.22Å; N194-I198 WeakPolarHBondContact O-CG1 3.16Å; N194-I198 PolarHBondContact O-N 3.46Å
195	R	75.9	Confident	73	Confident	200 Å²	200	103.7 Å²	103.7	76%	0.755	52%	0.52	S	S	*	.	H	α-helix	trans	-76.8	-41.7	179.1	-110.3	-164.7	176.7	158.9	1.9	112.5	L192 L193 T199	L192-R195 PolarHBondContact O-N 3.22Å; L193-R195 VanDerWaalsContact C-N 3.35Å; L193-R195 PolarHBondContact O-N 3.23Å; R195-T199 WeakPolarHBondContact O-CG2 3.46Å; R195-T199 PolarHBondContact O-N 3.28Å; R195-T199 VanDerWaalsContact O-N 3.08Å; R195-T199 PolarHBondContact O-OG1 3.14Å
196	Q	74.1	Confident	74.2	Confident	25 Å²	25	103.5 Å²	103.5	12%	0.117	51%	0.511	C	S	.	.	H	α-helix	trans	-66.5	-45.2	179.4	-174.6	176.7	-30.9	0	0	110.7	D184 L192 L193 I198 T199 V200	D184-Q196 VanDerWaalsContact CB-NE2 3.27Å; D184-Q196 PolarHBondContact OD1-OE1 3.43Å; D184-Q196 PolarHBondContact OD2-NE2 3.34Å; L192-Q196 VanDerWaalsContact O-CB 3.22Å; L192-Q196 WeakPolarHBondContact O-CB 3.14Å; L192-Q196 PolarHBondContact O-N 2.88Å; L193-Q196 PolarHBondContact O-N 3.31Å; Q196-I198 VanDerWaalsContact C-N 3.34Å; Q196-I198 PolarHBondContact O-N 2.71Å; Q196-T199 WeakPolarHBondContact CA-OG1 3.4Å; Q196-T199 PolarHBondContact O-N 2.86Å; Q196-T199 VanDerWaalsContact O-N 3.12Å; Q196-T199 PolarHBondContact O-OG1 2.94Å; Q196-V200 HydrophobicContact CG-CG2 4.49Å; Q196-V200 WeakPolarHBondContact O-CG2 3.46Å; Q196-V200 PolarHBondContact O-N 3.05Å
197	D	78.6	Confident	75.7	Confident	75 Å²	75	100.7 Å²	100.7	40%	0.401	49%	0.492	S	S	.	.	H	α-helix	trans	-59.3	-45.7	177.5	-65.2	-22.2	0	0	0	110.6	L193 T199 V200 I201	L193-D197 WeakPolarHBondContact O-CB 3.1Å; L193-D197 PolarHBondContact O-N 2.92Å; D197-T199 PolarHBondContact O-N 3.43Å; D197-V200 PolarHBondContact O-N 3.4Å; D197-I201 WeakPolarHBondContact O-CB 3.36Å; D197-I201 WeakPolarHBondContact O-CD1 3.33Å; D197-I201 WeakPolarHBondContact O-CG1 3.12Å; D197-I201 PolarHBondContact O-N 3.03Å
198	I	83.4	Confident	77.2	Confident	97 Å²	97	103 Å²	103	50%	0.497	50%	0.496	S	S	.	.	H	α-helix	trans	-60.8	-42.2	176	-66.9	166.5	0	0	0	111.5	N194 Q196 S202	N194-I198 WeakPolarHBondContact O-CD1 3.22Å; N194-I198 WeakPolarHBondContact O-CG1 3.16Å; N194-I198 PolarHBondContact O-N 3.46Å; Q196-I198 VanDerWaalsContact C-N 3.34Å; Q196-I198 PolarHBondContact O-N 2.71Å; I198-S202 WeakPolarHBondContact O-CB 3.42Å; I198-S202 PolarHBondContact O-N 3.23Å; I198-S202 PolarHBondContact O-OG 3.41Å
199	T	84.2	Confident	78.8	Confident	34 Å²	34	96 Å²	96	21%	0.209	48%	0.479	C	S	.	.	H	α-helix	trans	-67.1	-39.9	178.9	53.5	0	0	0	0	112.7	R195 Q196 D197 S202 C203	R195-T199 WeakPolarHBondContact O-CG2 3.46Å; R195-T199 PolarHBondContact O-N 3.28Å; R195-T199 VanDerWaalsContact O-N 3.08Å; R195-T199 PolarHBondContact O-OG1 3.14Å; Q196-T199 WeakPolarHBondContact CA-OG1 3.4Å; Q196-T199 PolarHBondContact O-N 2.86Å; Q196-T199 VanDerWaalsContact O-N 3.12Å; Q196-T199 PolarHBondContact O-OG1 2.94Å; D197-T199 PolarHBondContact O-N 3.43Å; T199-S202 WeakPolarHBondContact CA-OG 3.38Å; T199-S202 PolarHBondContact O-OG 3.43Å; T199-C203 WeakPolarHBondContact O-CB 3.43Å; T199-C203 PolarHBondContact O-N 3.2Å; T199-C203 PolarHBondContact O-SG 2.85Å
200	V	85.5	Confident	80.4	Confident	42 Å²	42	89 Å²	89	26%	0.255	45%	0.445	S	S	.	.	H	α-helix	trans	-70.5	-41.5	179.5	174.2	0	0	0	0	110.6	Q196 D197 C203 S204	Q196-V200 HydrophobicContact CG-CG2 4.49Å; Q196-V200 WeakPolarHBondContact O-CG2 3.46Å; Q196-V200 PolarHBondContact O-N 3.05Å; D197-V200 PolarHBondContact O-N 3.4Å; V200-C203 PolarHBondContact O-N 3.32Å; V200-S204 WeakPolarHBondContact O-CB 3.24Å; V200-S204 PolarHBondContact O-N 3.12Å; V200-S204 PolarHBondContact O-OG 3.09Å
201	I	87	Confident	81.9	Confident	102 Å²	102	82.5 Å²	82.5	52%	0.523	42%	0.422	S	S	.	.	H	α-helix	trans	-62.5	-47.5	175.6	-67.3	164.5	0	0	0	110.5	D197 S204 L205	D197-I201 WeakPolarHBondContact O-CB 3.36Å; D197-I201 WeakPolarHBondContact O-CD1 3.33Å; D197-I201 WeakPolarHBondContact O-CG1 3.12Å; D197-I201 PolarHBondContact O-N 3.03Å; I201-S204 PolarHBondContact O-N 3.28Å; I201-L205 HydrophobicContact CG2-CD1 4.03Å; I201-L205 HydrophobicContact CG2-CG 4.48Å; I201-L205 WeakPolarHBondContact O-CG 3.19Å; I201-L205 PolarHBondContact O-N 3.21Å
202	S	88.8	Confident	83.3	Confident	50 Å²	50	81 Å²	81	35%	0.35	41%	0.408	S	S	.	.	H	α-helix	trans	-64.3	-41.8	179.7	57.9	0	0	0	0	112.6	I198 T199 S204 L205 L206	I198-S202 WeakPolarHBondContact O-CB 3.42Å; I198-S202 PolarHBondContact O-N 3.23Å; I198-S202 PolarHBondContact O-OG 3.41Å; T199-S202 WeakPolarHBondContact CA-OG 3.38Å; T199-S202 PolarHBondContact O-OG 3.43Å; S202-S204 VanDerWaalsContact C-N 3.35Å; S202-S204 PolarHBondContact O-N 3.23Å; S202-L205 PolarHBondContact O-N 2.89Å; S202-L206 WeakPolarHBondContact O-CG 3.42Å; S202-L206 PolarHBondContact O-N 2.86Å
203	C	90.4	Very high	84.7	Confident	12 Å²	12	79.9 Å²	79.9	8%	0.081	41%	0.405	C	S	.	.	H	α-helix	trans	-64.1	-39.9	175.1	-68.2	0	0	0	0	112.1	S177 T199 V200 L206 F207	S177-C203 WeakPolarHBondContact OG-CB 3.46Å; T199-C203 WeakPolarHBondContact O-CB 3.43Å; T199-C203 PolarHBondContact O-N 3.2Å; T199-C203 PolarHBondContact O-SG 2.85Å; V200-C203 PolarHBondContact O-N 3.32Å; C203-L206 PolarHBondContact O-N 3.43Å; C203-F207 WeakPolarHBondContact O-CB 3.41Å; C203-F207 PolarHBondContact O-N 2.77Å
204	S	89.9	Confident	85.8	Confident	51 Å²	51	75.4 Å²	75.4	36%	0.357	38%	0.382	S	S	.	.	H	α-helix	trans	-63.5	-44.6	176.6	-58.3	0	0	0	0	111.5	V200 I201 S202 F207 F208	V200-S204 WeakPolarHBondContact O-CB 3.24Å; V200-S204 PolarHBondContact O-N 3.12Å; V200-S204 PolarHBondContact O-OG 3.09Å; I201-S204 PolarHBondContact O-N 3.28Å; S202-S204 VanDerWaalsContact C-N 3.35Å; S202-S204 PolarHBondContact O-N 3.23Å; S204-F207 WeakPolarHBondContact O-CB 3.23Å; S204-F207 PolarHBondContact O-N 3.39Å; S204-F208 WeakPolarHBondContact O-CD2 3.21Å; S204-F208 PolarHBondContact O-N 3.48Å
205	L	92.5	Very high	86.5	Confident	108 Å²	108	72.9 Å²	72.9	57%	0.565	37%	0.368	S	S	*	.	H	α-helix	trans	-61.6	-44.6	175.9	-72	171.1	0	0	0	112	I201 S202 F207 F208 V209	I201-L205 HydrophobicContact CG2-CD1 4.03Å; I201-L205 HydrophobicContact CG2-CG 4.48Å; I201-L205 WeakPolarHBondContact O-CG 3.19Å; I201-L205 PolarHBondContact O-N 3.21Å; S202-L205 PolarHBondContact O-N 2.89Å; L205-F207 VanDerWaalsContact C-N 3.32Å; L205-F207 PolarHBondContact O-N 2.86Å; L205-F208 PolarHBondContact O-N 3.03Å; L205-V209 WeakPolarHBondContact O-CG2 3.5Å; L205-V209 PolarHBondContact O-N 2.59Å
206	L	90.5	Very high	86.8	Confident	99 Å²	99	69.2 Å²	69.2	52%	0.518	36%	0.358	S	S	.	.	H	α-helix	trans	-62.3	-40.2	176	-73.3	174.3	0	0	0	111.9	S202 C203 A210	S202-L206 WeakPolarHBondContact O-CG 3.42Å; S202-L206 PolarHBondContact O-N 2.86Å; C203-L206 PolarHBondContact O-N 3.43Å; L206-A210 WeakPolarHBondContact O-CB 3.42Å; L206-A210 PolarHBondContact O-N 3.26Å
207	F	91.4	Very high	87.2	Confident	82 Å²	82	68.5 Å²	68.5	36%	0.36	36%	0.355	S	S	.	.	H	α-helix	trans	-60.8	-48.1	174.8	179.1	-90.9	0	0	0	111.5	M170 C203 S204 L205 A210 F211	M170-F207 HydrophobicContact CB-CD2 4.01Å; M170-F207 HydrophobicContact CB-CE2 4.04Å; M170-F207 HydrophobicContact CG-CD2 4.04Å; M170-F207 HydrophobicContact CG-CE2 4.17Å; M170-F207 HydrophobicContact SD-CE2 4.29Å; C203-F207 WeakPolarHBondContact O-CB 3.41Å; C203-F207 PolarHBondContact O-N 2.77Å; S204-F207 WeakPolarHBondContact O-CB 3.23Å; S204-F207 PolarHBondContact O-N 3.39Å; L205-F207 VanDerWaalsContact C-N 3.32Å; L205-F207 PolarHBondContact O-N 2.86Å; F207-A210 PolarHBondContact O-N 3.01Å; F207-F211 VanDerWaalsContact O-CB 3.3Å; F207-F211 WeakPolarHBondContact O-CB 3.47Å; F207-F211 PolarHBondContact O-N 2.87Å
208	F	90.6	Very high	87.3	Confident	121 Å²	121	69.5 Å²	69.5	53%	0.531	36%	0.357	S	S	.	.	H	α-helix	trans	-61.7	-48	177.9	-84.3	-71	0	0	0	112.4	S204 L205 A210 F211 F212	S204-F208 WeakPolarHBondContact O-CD2 3.21Å; S204-F208 PolarHBondContact O-N 3.48Å; L205-F208 PolarHBondContact O-N 3.03Å; F208-A210 VanDerWaalsContact C-N 3.31Å; F208-A210 PolarHBondContact O-N 2.91Å; F208-F211 PolarHBondContact O-N 3.48Å; F208-F212 HydrophobicContact CD1-CE2 4.32Å; F208-F212 WeakPolarHBondContact O-CD2 3.36Å; F208-F212 PolarHBondContact O-N 2.98Å
209	V	90.3	Very high	87	Confident	89 Å²	89	74.5 Å²	74.5	54%	0.539	37%	0.372	S	S	.	.	H	α-helix	trans	-60.1	-44.6	177.5	172.9	0	0	0	0	110.4	L205 F211 F212 V213	L205-V209 WeakPolarHBondContact O-CG2 3.5Å; L205-V209 PolarHBondContact O-N 2.59Å; V209-F211 VanDerWaalsContact C-N 3.34Å; V209-F211 PolarHBondContact O-N 3.27Å; V209-F212 PolarHBondContact O-N 2.83Å; V209-V213 HydrophobicContact CG1-CG2 4.45Å; V209-V213 VanDerWaalsContact O-CG2 3.3Å; V209-V213 WeakPolarHBondContact O-CG2 3.25Å; V209-V213 PolarHBondContact O-N 2.78Å
210	A	89.9	Confident	86.7	Confident	0 Å²	0	81.2 Å²	81.2	0%	0	39%	0.393	C	S	.	.	H	α-helix	trans	-63.9	-39.5	178.5	0	0	0	0	0	113	M166 V169 M170 L206 F207 F208 V213 A214	M166-A210 HydrophobicContact CB-CB 4.35Å; M166-A210 VanDerWaalsContact CE-CA 3.42Å; M166-A210 HydrophobicContact CE-CB 3.64Å; V169-A210 HydrophobicContact CG1-CB 4.2Å; M170-A210 HydrophobicContact CG-CB 3.59Å; L206-A210 WeakPolarHBondContact O-CB 3.42Å; L206-A210 PolarHBondContact O-N 3.26Å; F207-A210 PolarHBondContact O-N 3.01Å; F208-A210 VanDerWaalsContact C-N 3.31Å; F208-A210 PolarHBondContact O-N 2.91Å; A210-V213 PolarHBondContact O-N 2.98Å; A210-A214 VanDerWaalsContact O-CB 3.23Å; A210-A214 WeakPolarHBondContact O-CB 3.12Å; A210-A214 PolarHBondContact O-N 3.48Å
211	F	88.9	Confident	86.2	Confident	84 Å²	84	79.9 Å²	79.9	37%	0.368	39%	0.387	S	S	.	.	H	α-helix	trans	-62.9	-47.8	175.3	178.3	-103.7	0	0	0	112	M170 F207 F208 V209 V213 A214 L215	M170-F211 HydrophobicContact SD-CB 3.94Å; M170-F211 HydrophobicContact SD-CD2 4.28Å; F207-F211 VanDerWaalsContact O-CB 3.3Å; F207-F211 WeakPolarHBondContact O-CB 3.47Å; F207-F211 PolarHBondContact O-N 2.87Å; F208-F211 PolarHBondContact O-N 3.48Å; V209-F211 VanDerWaalsContact C-N 3.34Å; V209-F211 PolarHBondContact O-N 3.27Å; F211-V213 PolarHBondContact O-N 3.14Å; F211-A214 WeakPolarHBondContact O-CB 3.19Å; F211-A214 PolarHBondContact O-N 3.01Å; F211-L215 HydrophobicContact CD1-CD1 3.9Å; F211-L215 HydrophobicContact CD1-CG 4.38Å; F211-L215 HydrophobicContact CE1-CD1 3.28Å; F211-L215 HydrophobicContact CE1-CG 4.01Å; F211-L215 HydrophobicContact CE2-CD1 4.31Å; F211-L215 HydrophobicContact CE2-CD2 4.44Å; F211-L215 HydrophobicContact CE2-CG 4.26Å; F211-L215 HydrophobicContact CZ-CD1 3.52Å; F211-L215 HydrophobicContact CZ-CD2 4.23Å; F211-L215 HydrophobicContact CZ-CG 3.94Å; F211-L215 WeakPolarHBondContact O-CG 3.24Å; F211-L215 PolarHBondContact O-N 3.22Å
212	F	87.9	Confident	85	Confident	131 Å²	131	82.9 Å²	82.9	58%	0.575	40%	0.404	S	S	*	.	H	α-helix	trans	-65.8	-37.6	178.3	-80.2	-70.1	0	0	0	112.8	F208 V209 L215 F216	F208-F212 HydrophobicContact CD1-CE2 4.32Å; F208-F212 WeakPolarHBondContact O-CD2 3.36Å; F208-F212 PolarHBondContact O-N 2.98Å; V209-F212 PolarHBondContact O-N 2.83Å; F212-L215 PolarHBondContact O-N 3.41Å; F212-F216 VanDerWaalsContact O-CB 3.3Å; F212-F216 WeakPolarHBondContact O-CB 3.4Å; F212-F216 PolarHBondContact O-N 3.44Å
213	V	87.2	Confident	84	Confident	55 Å²	55	81.7 Å²	81.7	33%	0.333	39%	0.394	S	S	.	.	H	α-helix	trans	-66.4	-41.3	173.3	175.8	0	0	0	0	110.4	M166 V209 A210 F211 L215 F216 T217	M166-V213 HydrophobicContact CE-CB 4.07Å; M166-V213 HydrophobicContact CE-CG1 4.26Å; M166-V213 HydrophobicContact CE-CG2 4.38Å; M166-V213 HydrophobicContact CG-CB 4.06Å; M166-V213 HydrophobicContact CG-CG1 3.67Å; M166-V213 HydrophobicContact SD-CG1 4.13Å; V209-V213 HydrophobicContact CG1-CG2 4.45Å; V209-V213 VanDerWaalsContact O-CG2 3.3Å; V209-V213 WeakPolarHBondContact O-CG2 3.25Å; V209-V213 PolarHBondContact O-N 2.78Å; A210-V213 PolarHBondContact O-N 2.98Å; F211-V213 PolarHBondContact O-N 3.14Å; V213-L215 VanDerWaalsContact C-N 3.34Å; V213-L215 PolarHBondContact O-N 3.36Å; V213-F216 PolarHBondContact O-N 2.77Å; V213-T217 HydrophobicContact CG1-CG2 4.26Å; V213-T217 WeakPolarHBondContact O-CB 3.27Å; V213-T217 VanDerWaalsContact O-CG2 3.22Å; V213-T217 WeakPolarHBondContact O-CG2 3.43Å; V213-T217 PolarHBondContact O-N 3.4Å; V213-T217 PolarHBondContact O-OG1 2.96Å
214	A	85.9	Confident	83.1	Confident	4 Å²	4	84 Å²	84	3%	0.033	41%	0.41	C	S	.	.	H	α-helix	trans	-61.7	-40.9	174.6	0	0	0	0	0	111.8	F163 M166 M170 A210 F211 T217 Q218	F163-A214 HydrophobicContact CD2-CB 3.97Å; F163-A214 HydrophobicContact CE2-CB 3.83Å; M166-A214 HydrophobicContact CB-CB 4.25Å; M170-A214 HydrophobicContact CE-CB 4.21Å; A210-A214 VanDerWaalsContact O-CB 3.23Å; A210-A214 WeakPolarHBondContact O-CB 3.12Å; A210-A214 PolarHBondContact O-N 3.48Å; F211-A214 WeakPolarHBondContact O-CB 3.19Å; F211-A214 PolarHBondContact O-N 3.01Å; A214-T217 WeakPolarHBondContact CA-OG1 3.49Å; A214-T217 PolarHBondContact O-OG1 2.96Å; A214-Q218 WeakPolarHBondContact O-CB 3.38Å; A214-Q218 VanDerWaalsContact O-CG 3.31Å; A214-Q218 WeakPolarHBondContact O-CG 3.2Å; A214-Q218 PolarHBondContact O-N 2.99Å
215	L	83.4	Confident	82.1	Confident	70 Å²	70	83.1 Å²	83.1	37%	0.366	40%	0.402	S	S	.	.	H	α-helix	trans	-67.3	-43.7	173.9	-74	-176.3	0	0	0	112.4	F211 F212 V213 T217 Q218 Y219	F211-L215 HydrophobicContact CD1-CD1 3.9Å; F211-L215 HydrophobicContact CD1-CG 4.38Å; F211-L215 HydrophobicContact CE1-CD1 3.28Å; F211-L215 HydrophobicContact CE1-CG 4.01Å; F211-L215 HydrophobicContact CE2-CD1 4.31Å; F211-L215 HydrophobicContact CE2-CD2 4.44Å; F211-L215 HydrophobicContact CE2-CG 4.26Å; F211-L215 HydrophobicContact CZ-CD1 3.52Å; F211-L215 HydrophobicContact CZ-CD2 4.23Å; F211-L215 HydrophobicContact CZ-CG 3.94Å; F211-L215 WeakPolarHBondContact O-CG 3.24Å; F211-L215 PolarHBondContact O-N 3.22Å; F212-L215 PolarHBondContact O-N 3.41Å; V213-L215 VanDerWaalsContact C-N 3.34Å; V213-L215 PolarHBondContact O-N 3.36Å; L215-T217 VanDerWaalsContact C-N 3.32Å; L215-T217 PolarHBondContact O-N 3.27Å; L215-Q218 CarbonylContact O-C 3.57Å; L215-Q218 PolarHBondContact O-N 3.4Å; L215-Y219 WeakPolarHBondContact O-CB 3.48Å; L215-Y219 PolarHBondContact O-N 2.78Å
216	F	83.1	Confident	81	Confident	123 Å²	123	82.5 Å²	82.5	54%	0.539	41%	0.405	S	S	.	.	H	α-helix	trans	-63.9	-40.6	178.3	-179	-98.4	0	0	0	111.5	F212 V213 Q218 Y219 R220	F212-F216 VanDerWaalsContact O-CB 3.3Å; F212-F216 WeakPolarHBondContact O-CB 3.4Å; F212-F216 PolarHBondContact O-N 3.44Å; V213-F216 PolarHBondContact O-N 2.77Å; F216-Q218 VanDerWaalsContact C-N 3.35Å; F216-Y219 PolarHBondContact O-N 3.21Å; F216-R220 WeakPolarHBondContact O-CB 3.37Å; F216-R220 PolarHBondContact O-N 3.45Å
217	T	82.6	Confident	80	Confident	9 Å²	9	79.8 Å²	79.8	6%	0.055	39%	0.394	C	S	.	.	H	α-helix	trans	-65.4	-38.1	174.5	53.5	0	0	0	0	111.6	L159 L162 V213 A214 L215 A221	L159-T217 HydrophobicContact CD1-CG2 3.6Å; L162-T217 HydrophobicContact CB-CG2 4.41Å; V213-T217 HydrophobicContact CG1-CG2 4.26Å; V213-T217 WeakPolarHBondContact O-CB 3.27Å; V213-T217 VanDerWaalsContact O-CG2 3.22Å; V213-T217 WeakPolarHBondContact O-CG2 3.43Å; V213-T217 PolarHBondContact O-N 3.4Å; V213-T217 PolarHBondContact O-OG1 2.96Å; A214-T217 WeakPolarHBondContact CA-OG1 3.49Å; A214-T217 PolarHBondContact O-OG1 2.96Å; L215-T217 VanDerWaalsContact C-N 3.32Å; L215-T217 PolarHBondContact O-N 3.27Å; T217-A221 WeakPolarHBondContact O-CB 3.27Å; T217-A221 PolarHBondContact O-N 3.31Å
218	Q	79.1	Confident	78.9	Confident	96 Å²	96	77 Å²	77	45%	0.449	38%	0.383	S	S	.	.	H	α-helix	trans	-67.1	-41.2	171.6	-75.9	-179.3	-10.7	0	0	112.9	F163 A214 L215 F216 R220 A221	F163-Q218 HydrophobicContact CD2-CG 3.87Å; F163-Q218 HydrophobicContact CE2-CG 3.64Å; A214-Q218 WeakPolarHBondContact O-CB 3.38Å; A214-Q218 VanDerWaalsContact O-CG 3.31Å; A214-Q218 WeakPolarHBondContact O-CG 3.2Å; A214-Q218 PolarHBondContact O-N 2.99Å; L215-Q218 CarbonylContact O-C 3.57Å; L215-Q218 PolarHBondContact O-N 3.4Å; F216-Q218 VanDerWaalsContact C-N 3.35Å; Q218-R220 VanDerWaalsContact C-N 3.3Å; Q218-R220 PolarHBondContact O-N 2.93Å; Q218-A221 PolarHBondContact O-N 2.95Å
219	Y	78.8	Confident	77.9	Confident	203 Å²	203	78.2 Å²	78.2	80%	0.796	39%	0.388	S	S	*	.	H	α-helix	trans	-62.6	-38.8	177.9	177	-98.8	0	0	0	111.6	L215 F216	L215-Y219 WeakPolarHBondContact O-CB 3.48Å; L215-Y219 PolarHBondContact O-N 2.78Å; F216-Y219 PolarHBondContact O-N 3.21Å
220	R	77.8	Confident	76.8	Confident	174 Å²	174	76 Å²	76	66%	0.657	38%	0.38	S	S	*	.	H	α-helix	trans	-82.7	-18.4	176.6	-160.3	-175.9	177.7	136	3.9	113.1	F216 Q218 D222	F216-R220 WeakPolarHBondContact O-CB 3.37Å; F216-R220 PolarHBondContact O-N 3.45Å; Q218-R220 VanDerWaalsContact C-N 3.3Å; Q218-R220 PolarHBondContact O-N 2.93Å; R220-D222 PolarHBondContact O-N 2.78Å
221	A	73.3	Confident	75.8	Confident	15 Å²	15	80.6 Å²	80.6	12%	0.124	40%	0.397	C	S	.	.			trans	-78.5	103.8	177.4	0	0	0	0	0	109	L159 T217 Q218 T223	L159-A221 HydrophobicContact CD2-CB 3.5Å; L159-A221 VanDerWaalsContact CD2-CB 3.5Å; L159-A221 HydrophobicContact CG-CB 4.32Å; T217-A221 WeakPolarHBondContact O-CB 3.27Å; T217-A221 PolarHBondContact O-N 3.31Å; Q218-A221 PolarHBondContact O-N 2.95Å; A221-T223 PolarHBondContact O-N 2.64Å
222	D	63.7	Low	74.9	Confident	164 Å²	164	78.4 Å²	78.4	88%	0.877	39%	0.391	S	S	*	.	S	Bend	trans	-57.6	-21.5	171.9	-64.9	-46.6	0	0	0	112.1	R220	R220-D222 PolarHBondContact O-N 2.78Å
223	T	66	Low	74	Confident	25 Å²	25	79.4 Å²	79.4	15%	0.153	39%	0.392	C	S	.	.	S	Bend	trans	-123.4	115.9	171.9	59.4	0	0	0	0	111.3	H160 A221	H160-T223 PolarHBondContact CE1-O 3.41Å; A221-T223 PolarHBondContact O-N 2.64Å
224	S	73.3	Confident	73	Confident	60 Å²	60	82.4 Å²	82.4	42%	0.42	41%	0.405	S	S	.	.			trans	-66	152.8	174.4	68.5	0	0	0	0	111	C226 C227 L228	S224-C226 PolarHBondContact O-N 3.34Å; S224-C226 VanDerWaalsContact O-N 3.16Å; S224-C227 WeakPolarHBondContact O-CA 3.44Å; S224-C227 VanDerWaalsContact O-CB 3.28Å; S224-C227 WeakPolarHBondContact O-CB 3.43Å; S224-C227 PolarHBondContact O-N 3.35Å; S224-C227 PolarHBondContact OG-N 2.86Å; S224-L228 PolarHBondContact O-N 2.94Å
225	L	68.9	Low	72	Confident	33 Å²	33	85.8 Å²	85.8	17%	0.173	42%	0.421	C	S	.	.	H	α-helix	trans	-53.4	-36.2	172.6	-82.5	175.3	0	0	0	112.1	H160 F163 L164 C227 L228 F229	H160-L225 HydrophobicContact CB-CD2 3.77Å; H160-L225 WeakPolarHBondContact ND1-CD2 3.33Å; H160-L225 WeakPolarHBondContact ND1-CG 3.31Å; F163-L225 HydrophobicContact CB-CD1 4.48Å; F163-L225 HydrophobicContact CD1-CD1 3.18Å; F163-L225 HydrophobicContact CD1-CG 4.41Å; F163-L225 HydrophobicContact CE1-CD1 3.59Å; F163-L225 HydrophobicContact CG-CD1 4.03Å; L164-L225 HydrophobicContact CD2-CD1 4.39Å; L225-C227 VanDerWaalsContact C-N 3.32Å; L225-C227 PolarHBondContact O-N 3.38Å; L225-L228 PolarHBondContact O-N 2.97Å; L225-F229 HydrophobicContact CB-CD2 4.43Å; L225-F229 HydrophobicContact CB-CE2 4.47Å; L225-F229 WeakPolarHBondContact O-CD2 3.09Å; L225-F229 PolarHBondContact O-N 3.45Å
226	C	68.6	Low	71.1	Confident	96 Å²	96	82.8 Å²	82.8	65%	0.649	41%	0.406	S	S	*	.	H	α-helix	trans	-61.2	-41.3	174.7	-172.3	0	0	0	0	111.7	S224 F229 A230	S224-C226 PolarHBondContact O-N 3.34Å; S224-C226 VanDerWaalsContact O-N 3.16Å; C226-F229 PolarHBondContact O-N 3.15Å; C226-A230 VanDerWaalsContact O-CB 3.24Å; C226-A230 WeakPolarHBondContact O-CB 3.41Å; C226-A230 PolarHBondContact O-N 3.04Å
227	C	70.3	Confident	70.2	Confident	42 Å²	42	82.5 Å²	82.5	28%	0.284	40%	0.401	S	S	.	.	H	α-helix	trans	-64	-41.9	174.3	-174.7	0	0	0	0	111.3	S224 L225 A230 R231	S224-C227 WeakPolarHBondContact O-CA 3.44Å; S224-C227 VanDerWaalsContact O-CB 3.28Å; S224-C227 WeakPolarHBondContact O-CB 3.43Å; S224-C227 PolarHBondContact O-N 3.35Å; S224-C227 PolarHBondContact OG-N 2.86Å; L225-C227 VanDerWaalsContact C-N 3.32Å; L225-C227 PolarHBondContact O-N 3.38Å; C227-A230 PolarHBondContact O-N 3.18Å; C227-R231 WeakPolarHBondContact O-CB 3.26Å; C227-R231 WeakPolarHBondContact O-CG 3.4Å; C227-R231 PolarHBondContact O-N 2.99Å
228	L	68.5	Low	69.2	Low	24 Å²	24	85.7 Å²	85.7	13%	0.126	42%	0.415	C	S	.	.	H	α-helix	trans	-63	-45	174.1	-77.1	-163	0	0	0	112.7	H160 S224 L225 A230 R231 C232	H160-L228 WeakPolarHBondContact CD2-CD1 3.48Å; H160-L228 WeakPolarHBondContact NE2-CD1 3.35Å; S224-L228 PolarHBondContact O-N 2.94Å; L225-L228 PolarHBondContact O-N 2.97Å; L228-A230 VanDerWaalsContact C-N 3.34Å; L228-R231 PolarHBondContact O-N 3.06Å; L228-C232 WeakPolarHBondContact O-CB 3.43Å; L228-C232 PolarHBondContact O-N 2.86Å
229	F	68.7	Low	68.4	Low	145 Å²	145	82.3 Å²	82.3	64%	0.636	40%	0.398	S	S	*	.	H	α-helix	trans	-63.7	-41.2	175.9	-81.2	-66.7	0	0	0	111.2	L225 C226 C232 W233	L225-F229 HydrophobicContact CB-CD2 4.43Å; L225-F229 HydrophobicContact CB-CE2 4.47Å; L225-F229 WeakPolarHBondContact O-CD2 3.09Å; L225-F229 PolarHBondContact O-N 3.45Å; C226-F229 PolarHBondContact O-N 3.15Å; F229-C232 PolarHBondContact O-N 3.38Å; F229-W233 WeakPolarHBondContact O-CB 3.31Å; F229-W233 PolarHBondContact O-N 3.36Å
230	A	67.9	Low	67.6	Low	44 Å²	44	79 Å²	79	36%	0.364	38%	0.384	S	S	.	.	H	α-helix	trans	-63	-46	175.2	0	0	0	0	0	111.4	C226 C227 L228 W233 I234	C226-A230 VanDerWaalsContact O-CB 3.24Å; C226-A230 WeakPolarHBondContact O-CB 3.41Å; C226-A230 PolarHBondContact O-N 3.04Å; C227-A230 PolarHBondContact O-N 3.18Å; L228-A230 VanDerWaalsContact C-N 3.34Å; A230-W233 WeakPolarHBondContact O-CB 3.49Å; A230-W233 PolarHBondContact O-N 3.09Å; A230-I234 WeakPolarHBondContact O-CB 3.13Å; A230-I234 WeakPolarHBondContact O-CD1 3.09Å; A230-I234 WeakPolarHBondContact O-CG1 3.48Å; A230-I234 PolarHBondContact O-N 3.23Å
231	R	68.9	Low	67.3	Low	96 Å²	96	70.9 Å²	70.9	36%	0.362	35%	0.354	S	S	.	.	H	α-helix	trans	-61.7	-48	175	-77.4	-177.9	177.8	-176.3	2.8	111.4	C227 L228 W233 I234 I235	C227-R231 WeakPolarHBondContact O-CB 3.26Å; C227-R231 WeakPolarHBondContact O-CG 3.4Å; C227-R231 PolarHBondContact O-N 2.99Å; L228-R231 PolarHBondContact O-N 3.06Å; R231-W233 VanDerWaalsContact C-N 3.29Å; R231-W233 PolarHBondContact O-N 2.81Å; R231-I234 PolarHBondContact O-N 3.13Å; R231-I235 WeakPolarHBondContact O-CB 3.01Å; R231-I235 WeakPolarHBondContact O-CD1 3.24Å; R231-I235 WeakPolarHBondContact O-CG1 3.32Å; R231-I235 PolarHBondContact O-N 3.48Å
232	C	68.9	Low	67.2	Low	37 Å²	37	75.3 Å²	75.3	25%	0.25	37%	0.37	C	S	.	.	H	α-helix	trans	-59.8	-42	176.4	-174.1	0	0	0	0	111.1	P150 L228 F229 N236	P150-C232 HydrophobicContact CG-CB 4.46Å; L228-C232 WeakPolarHBondContact O-CB 3.43Å; L228-C232 PolarHBondContact O-N 2.86Å; F229-C232 PolarHBondContact O-N 3.38Å; C232-N236 WeakPolarHBondContact O-CB 3.21Å; C232-N236 PolarHBondContact O-N 3.48Å; C232-N236 PolarHBondContact O-ND2 3.23Å; C232-N236 PolarHBondContact SG-ND2 3.29Å
233	W	68.3	Low	67.8	Low	153 Å²	153	70.8 Å²	70.8	58%	0.58	35%	0.346	S	S	*	.	H	α-helix	trans	-63.3	-45.8	175.8	-175.9	-88.8	0	0	0	111.5	F142 F229 A230 R231 R237	F142-W233 HydrophobicContact CE2-CE3 4.45Å; F229-W233 WeakPolarHBondContact O-CB 3.31Å; F229-W233 PolarHBondContact O-N 3.36Å; A230-W233 WeakPolarHBondContact O-CB 3.49Å; A230-W233 PolarHBondContact O-N 3.09Å; R231-W233 VanDerWaalsContact C-N 3.29Å; R231-W233 PolarHBondContact O-N 2.81Å; W233-R237 VanDerWaalsContact O-CB 3.24Å; W233-R237 WeakPolarHBondContact O-CB 3.34Å; W233-R237 PolarHBondContact O-N 2.87Å
234	I	67.5	Low	68	Low	118 Å²	118	71.1 Å²	71.1	61%	0.605	35%	0.345	S	S	*	.	H	α-helix	trans	-64.4	-46.1	178	-70.4	163.5	0	0	0	110.7	A230 R231 R237	A230-I234 WeakPolarHBondContact O-CB 3.13Å; A230-I234 WeakPolarHBondContact O-CD1 3.09Å; A230-I234 WeakPolarHBondContact O-CG1 3.48Å; A230-I234 PolarHBondContact O-N 3.23Å; R231-I234 PolarHBondContact O-N 3.13Å; I234-R237 WeakPolarHBondContact O-CB 3.41Å; I234-R237 PolarHBondContact O-N 3.06Å
235	I	65.2	Low	67.7	Low	75 Å²	75	73.2 Å²	73.2	39%	0.385	35%	0.351	S	S	.	.	H	α-helix	trans	-63.3	-45.4	179.3	-69.9	164.2	0	0	0	110.5	P150 R231 R237	P150-I235 HydrophobicContact CB-CD1 3.87Å; P150-I235 HydrophobicContact CG-CD1 4.45Å; R231-I235 WeakPolarHBondContact O-CB 3.01Å; R231-I235 WeakPolarHBondContact O-CD1 3.24Å; R231-I235 WeakPolarHBondContact O-CG1 3.32Å; R231-I235 PolarHBondContact O-N 3.48Å; I235-R237 VanDerWaalsContact C-N 3.28Å; I235-R237 PolarHBondContact O-N 3.36Å
236	N	63.5	Low	67.3	Low	7 Å²	7	76.8 Å²	76.8	4%	0.037	37%	0.374	C	S	.	.	H	α-helix	trans	-85.4	1.9	-177.7	-66.2	-56.1	0	0	0	113.7	F142 A147 E148 C232 H238	F142-N236 HydrophobicContact CE2-CB 4.18Å; A147-N236 WeakPolarHBondContact CA-OD1 3.46Å; E148-N236 PolarHBondContact N-OD1 3.06Å; E148-N236 PolarHBondContact O-ND2 3.01Å; E148-N236 PolarHBondContact O-OD1 2.8Å; C232-N236 WeakPolarHBondContact O-CB 3.21Å; C232-N236 PolarHBondContact O-N 3.48Å; C232-N236 PolarHBondContact O-ND2 3.23Å; C232-N236 PolarHBondContact SG-ND2 3.29Å; N236-H238 PolarHBondContact O-N 2.92Å
237	R	63.8	Low	66.6	Low	116 Å²	116	76.7 Å²	76.7	44%	0.438	37%	0.371	S	S	.	.			trans	-75.9	76.3	169.4	-171	172.1	171.8	171.2	-6.3	108.8	H140 W233 I234 I235 W239	H140-R237 PolarHBondContact CD2-NH2 2.86Å; H140-R237 VanDerWaalsContact CD2-NH2 3.34Å; H140-R237 PolarHBondContact CE1-NE 3.38Å; H140-R237 PolarHBondContact CE1-NH2 3.23Å; H140-R237 PolarHBondContact ND1-NE 3.5Å; H140-R237 PolarHBondContact NE2-NH2 3.49Å; W233-R237 VanDerWaalsContact O-CB 3.24Å; W233-R237 WeakPolarHBondContact O-CB 3.34Å; W233-R237 PolarHBondContact O-N 2.87Å; I234-R237 WeakPolarHBondContact O-CB 3.41Å; I234-R237 PolarHBondContact O-N 3.06Å; I235-R237 VanDerWaalsContact C-N 3.28Å; I235-R237 PolarHBondContact O-N 3.36Å; R237-W239 PolarHBondContact O-N 2.8Å
238	H	62	Low	65.4	Low	76 Å²	76	80 Å²	80	35%	0.352	39%	0.392	S	S	.	.			trans	-68.1	123.9	165.2	-67.4	-68.9	0	0	0	109.1	C141 N236	C141-H238 PolarHBondContact N-O 3.22Å; C141-H238 VanDerWaalsContact N-O 3.12Å; C141-H238 VanDerWaalsContact O-O 3.09Å; N236-H238 PolarHBondContact O-N 2.92Å
239	W	62.8	Low	64.2	Low	25 Å²	25	87 Å²	87	10%	0.095	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	137.7	169	59.5	-63.6	0	0	0	107.9	L116 P127 T138 R237 V241	L116-W239 HydrophobicContact CB-CH2 3.99Å; L116-W239 HydrophobicContact CB-CZ2 3.72Å; L116-W239 HydrophobicContact CD1-CH2 3.19Å; L116-W239 HydrophobicContact CD1-CZ2 3.76Å; L116-W239 HydrophobicContact CD1-CZ3 4Å; L116-W239 HydrophobicContact CG-CH2 4.06Å; L116-W239 HydrophobicContact CG-CZ2 4.29Å; P127-W239 HydrophobicContact CB-CH2 3.43Å; P127-W239 VanDerWaalsContact CB-CH2 3.43Å; P127-W239 HydrophobicContact CB-CZ2 4.45Å; P127-W239 HydrophobicContact CB-CZ3 3.86Å; P127-W239 HydrophobicContact CG-CE3 4.15Å; P127-W239 HydrophobicContact CG-CH2 3.29Å; P127-W239 HydrophobicContact CG-CZ2 4.36Å; P127-W239 HydrophobicContact CG-CZ3 3.2Å; T138-W239 HydrophobicContact CG2-CD2 4.42Å; T138-W239 HydrophobicContact CG2-CE3 3.2Å; T138-W239 HydrophobicContact CG2-CZ3 3.34Å; R237-W239 PolarHBondContact O-N 2.8Å; W239-V241 HydrophobicContact CE3-CG2 3.66Å; W239-V241 HydrophobicContact CH2-CG2 4.39Å; W239-V241 HydrophobicContact CZ3-CG2 3.51Å
240	R	62.1	Low	63	Low	135 Å²	135	84.7 Å²	84.7	51%	0.509	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	121.6	172.1	-67.7	-162.4	-55.3	-175.1	0.2	107.9	H139	H139-R240 PolarHBondContact N-O 3.5Å; H139-R240 VanDerWaalsContact N-O 3.14Å; H139-R240 PolarHBondContact O-N 3.48Å
241	V	70.8	Confident	61.9	Low	3 Å²	3	90.8 Å²	90.8	2%	0.018	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	130.7	170.4	-176.2	0	0	0	0	108.4	P97 L112 Y136 W239	P97-V241 HydrophobicContact CB-CG1 3.66Å; L112-V241 HydrophobicContact CD2-CB 3.96Å; L112-V241 HydrophobicContact CD2-CG1 3.85Å; L112-V241 HydrophobicContact CD2-CG2 3.88Å; Y136-V241 HydrophobicContact CD1-CG1 4.3Å; Y136-V241 HydrophobicContact CG-CG1 4.36Å; W239-V241 HydrophobicContact CE3-CG2 3.66Å; W239-V241 HydrophobicContact CH2-CG2 4.39Å; W239-V241 HydrophobicContact CZ3-CG2 3.51Å
242	K	72.3	Confident	60.7	Low	107 Å²	107	91.7 Å²	91.7	47%	0.465	46%	0.464	S	S	.	.	P	Polyproline II helix	trans	-85.8	154	170.7	-81	-174	172	172.2	0	110.3	K137 H139	K137-K242 HydrophobicContact CB-CB 4.33Å; K137-K242 PolarHBondContact O-N 3.46Å; H139-K242 VanDerWaalsContact CD2-CD 3.42Å; H139-K242 WeakPolarHBondContact CD2-CD 3.49Å; H139-K242 WeakPolarHBondContact CD2-CE 3.15Å; H139-K242 PolarHBondContact CD2-NZ 2.95Å; H139-K242 WeakPolarHBondContact NE2-CD 3.47Å; H139-K242 WeakPolarHBondContact NE2-CE 3.44Å; H139-K242 PolarHBondContact NE2-NZ 3.24Å
243	D	75.8	Confident	59.1	Low	69 Å²	69	98.6 Å²	98.6	37%	0.369	50%	0.498	S	S	.	.	P	Polyproline II helix	trans	-59.6	145.1	166.1	-69.4	-65.4	0	0	0	110.5	V95 S96 D245	V95-D243 WeakPolarHBondContact CA-OD1 3.49Å; V95-D243 WeakPolarHBondContact CB-OD1 3.44Å; V95-D243 WeakPolarHBondContact CG1-OD1 3.46Å; S96-D243 PolarHBondContact N-OD1 3.32Å; D243-D245 PolarHBondContact O-N 3.3Å
244	Y	70.4	Confident	57.5	Low	33 Å²	33	104.4 Å²	104.4	13%	0.129	53%	0.527	C	S	.	.			trans	-74.4	105.3	169.1	173.5	-109.5	0	0	0	108.5	S96 R99 Y134 V246	S96-Y244 WeakPolarHBondContact O-CB 3.04Å; S96-Y244 PolarHBondContact O-N 2.95Å; R99-Y244 HydrophobicContact CG-CD1 4.34Å; R99-Y244 HydrophobicContact CG-CD2 4.37Å; R99-Y244 HydrophobicContact CG-CE1 3.85Å; R99-Y244 HydrophobicContact CG-CE2 3.91Å; R99-Y244 PolarHBondContact NH1-OH 3.1Å; R99-Y244 PolarHBondContact NH2-OH 3.19Å; Y134-Y244 AromaticContact CE1-CD2 3.81Å; Y134-Y244 HydrophobicContact CE1-CD2 3.81Å; Y134-Y244 HydrophobicContact CE2-CD2 4.09Å; Y134-Y244 AromaticContact CE2-CE2 3.98Å; Y134-Y244 HydrophobicContact CE2-CE2 3.98Å; Y134-Y244 AromaticContact CZ-CD2 3.5Å; Y134-Y244 AromaticContact CZ-CE2 3.85Å; Y134-Y244 WeakPolarHBondContact OH-CD2 3.36Å; Y244-V246 HydrophobicContact CD1-CG2 3.98Å; Y244-V246 HydrophobicContact CE1-CB 4.36Å; Y244-V246 HydrophobicContact CE1-CG2 3.69Å; Y244-V246 PolarHBondContact O-N 2.77Å
245	D	65.7	Low	57	Low	104 Å²	104	103.7 Å²	103.7	56%	0.556	52%	0.523	S	S	*	.			trans	-71.5	116.6	168.2	-59.8	-41.4	0	0	0	108.8	D243 T247	D243-D245 PolarHBondContact O-N 3.3Å; D245-T247 PolarHBondContact O-N 2.89Å
246	V	62.2	Low	56.6	Low	107 Å²	107	105.2 Å²	105.2	65%	0.648	53%	0.53	S	S	*	.			trans	-74.4	81.5	168.6	-171.4	0	0	0	0	107.1	Y244 P248	Y244-V246 HydrophobicContact CD1-CG2 3.98Å; Y244-V246 HydrophobicContact CE1-CB 4.36Å; Y244-V246 HydrophobicContact CE1-CG2 3.69Å; Y244-V246 PolarHBondContact O-N 2.77Å; V246-P248 WeakPolarHBondContact O-CD 3.3Å
247	T	52.2	Low	56.2	Low	95 Å²	95	110.7 Å²	110.7	58%	0.583	56%	0.558	S	S	*	*			trans	-71.9	121.9	164.5	46.7	0	0	0	0	107.8	D245 E249	D245-T247 PolarHBondContact O-N 2.89Å; T247-E249 PolarHBondContact O-N 3.33Å
248	P	46.7	Very low	55.8	Low	111 Å²	111	110.4 Å²	110.4	72%	0.721	57%	0.565	S	S	*	*			trans	-75	67.5	177.5	32.1	-34.2	0	0	0	110.2	V246	V246-P248 WeakPolarHBondContact O-CD 3.3Å
249	E	43.2	Very low	55.4	Low	172 Å²	172	112.5 Å²	112.5	80%	0.804	58%	0.578	S	S	*	*			trans	-127.1	44.7	-178.3	-69.9	-80.1	142.8	0	0	109.8	T247	T247-E249 PolarHBondContact O-N 3.33Å
250	S	43.8	Very low	54.9	Low	95 Å²	95	118.3 Å²	118.3	66%	0.664	61%	0.61	S	S	*	*			trans	-162.7	52.1	164.9	71.2	0	0	0	0	111
251	H	44.1	Very low	54.4	Low	173 Å²	173	117.1 Å²	117.1	80%	0.801	62%	0.618	S	S	*	*			trans	-97.1	112.1	154	-85.1	-73.3	0	0	0	106.7	L253	H251-L253 PolarHBondContact O-N 3.01Å
252	P	42.7	Very low	53.1	Low	114 Å²	114	125.9 Å²	125.9	74%	0.74	66%	0.664	S	S	*	*			trans	-61.6	127.3	168.7	25.3	-29.2	0	0	0	107.6	K254	P252-K254 PolarHBondContact O-N 2.96Å
253	L	37.1	Very low	51.5	Low	182 Å²	182	127.5 Å²	127.5	95%	0.953	68%	0.68	S	S	*	*			trans	-53.4	106.4	165.5	-73	167	0	0	0	108.3	H251	H251-L253 PolarHBondContact O-N 3.01Å
254	K	34.6	Very low	49.3	Very low	275 Å²	275	132.8 Å²	132.8	100%	1.196	71%	0.709	S	S	*	*			trans	-159	0	155.9	-128.6	177.8	-176.3	-176.5	0	110.8	P252	P252-K254 PolarHBondContact O-N 2.96Å

Retrieved 254 of 254 residues in 226.5 ms (Link to these results)

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