Q99NG8_RAT Loading...

G/T mismatch-specific thymine DNA glycosylase

AlphaFold DB , UniProt , Accession Q99NG8, Species RAT (Rattus norvegicus, Rat), Gene Tdg, Length 386 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	47.8	Very low	43.2	Very low	240 Å²	240	143.6 Å²	143.6	100%	1.182	83%	0.827	S	S	*	*				0	80.4	0	-58.4	176.7	-175.8	0	0	105.6
2	M	45.2	Very low	42.6	Very low	192 Å²	192	139.8 Å²	139.8	95%	0.946	83%	0.825	S	S	*	*				52.3	105.8	53.7	-77.1	-157.7	174.6	0	0	114.3
3	A	42.7	Very low	41.6	Very low	90 Å²	90	133.9 Å²	133.9	74%	0.744	81%	0.812	S	S	*	*			trans	-176.5	102.5	137	0	0	0	0	0	105.8
4	E	39.1	Very low	41	Very low	194 Å²	194	136.4 Å²	136.4	91%	0.907	81%	0.81	S	S	*	*				57.2	130.8	81.6	-74.2	-171.2	133.7	0	0	112.6
5	A	48.9	Very low	40.4	Very low	90 Å²	90	138.1 Å²	138.1	74%	0.744	81%	0.806	S	S	*	*			cis	-161.3	-160.3	38.3	0	0	0	0	0	111.1
6	P	54.3	Low	40.5	Very low	117 Å²	117	139.4 Å²	139.4	76%	0.76	81%	0.805	S	S	*	*				-122.7	150.6	-72.1	32.2	-14.4	0	0	0	112.9
7	N	39.3	Very low	40.8	Very low	142 Å²	142	138.2 Å²	138.2	76%	0.759	80%	0.803	S	S	*	*				55.7	109.1	97.3	-119.2	25.5	0	0	0	116.4
8	M	39.9	Very low	40.3	Very low	156 Å²	156	135 Å²	135	77%	0.768	80%	0.795	S	S	*	*				81	117.3	94.5	-81.2	-80.9	-153.1	0	0	115
9	A	40	Very low	39.8	Very low	94 Å²	94	137.4 Å²	137.4	78%	0.777	80%	0.798	S	S	*	*				170.8	118.8	125.2	0	0	0	0	0	108.1
10	D	37.2	Very low	39.4	Very low	141 Å²	141	135 Å²	135	75%	0.754	80%	0.795	S	S	*	*				98.1	147.4	52.9	-107.9	-36.7	0	0	0	114
11	V	40.8	Very low	39.4	Very low	124 Å²	124	134.4 Å²	134.4	75%	0.752	80%	0.795	S	S	*	*			trans	83.7	97	164.7	-153.9	0	0	0	0	115.2
12	A	36.1	Very low	38.5	Very low	98 Å²	98	127.2 Å²	127.2	81%	0.81	77%	0.774	S	S	*	*				59.5	136.1	78.1	0	0	0	0	0	112.6
13	G	29.8	Very low	37.9	Very low	63 Å²	63	127 Å²	127	65%	0.649	77%	0.77	S	S	*	*			cis	170.6	-173.3	4.5	0	0	0	0	0	107.7
14	Q	32.8	Very low	37.6	Very low	169 Å²	169	129.8 Å²	129.8	79%	0.79	77%	0.773	S	S	*	*			trans	71.7	141.4	160.8	-66.2	176.2	-20.6	0	0	116.5
15	Q	32.2	Very low	37.4	Very low	161 Å²	161	126.6 Å²	126.6	75%	0.752	77%	0.769	S	S	*	*			cis	-167.4	155.3	3.9	-122.3	156.5	-10.3	0	0	108.7
16	M	42	Very low	36.9	Very low	160 Å²	160	128.2 Å²	128.2	79%	0.788	77%	0.769	S	S	*	*			trans	-69	167.1	160.7	-71.3	-153.9	57.9	0	0	112.5
17	P	44.9	Very low	36	Very low	118 Å²	118	128 Å²	128	77%	0.766	77%	0.768	S	S	*	*				-136	139.4	106.4	19.2	1.7	0	0	0	112.2
18	A	32.8	Very low	35.8	Very low	81 Å²	81	130.7 Å²	130.7	67%	0.669	78%	0.776	S	S	*	*				59.5	137	79.9	0	0	0	0	0	113.7
19	E	30.1	Very low	35.8	Very low	181 Å²	181	127.1 Å²	127.1	85%	0.846	77%	0.771	S	S	*	*			cis	-175.3	136.9	-9.2	-178	175.7	179.1	0	0	107.8
20	A	33	Very low	35.6	Very low	88 Å²	88	128.4 Å²	128.4	73%	0.727	77%	0.771	S	S	*	*			trans	52.1	168.1	149.9	0	0	0	0	0	124
21	P	38.4	Very low	35.3	Very low	123 Å²	123	131.8 Å²	131.8	80%	0.799	78%	0.779	S	S	*	*			cis	-134.6	-176.3	-28.6	28.4	-5.7	0	0	0	115.4
22	A	29.7	Very low	34.8	Very low	90 Å²	90	137.4 Å²	137.4	74%	0.744	79%	0.787	S	S	*	*			trans	92.2	134.1	160.6	0	0	0	0	0	116.1
23	Q	32.5	Very low	34.6	Very low	187 Å²	187	144.4 Å²	144.4	87%	0.874	79%	0.793	S	S	*	*			cis	-151.8	149.4	30.9	-67.3	170.6	-1.1	0	0	111.4
24	D	35.2	Very low	34.6	Very low	149 Å²	149	151.3 Å²	151.3	80%	0.797	81%	0.805	S	S	*	*			trans	-63.1	140.5	174.9	-62.2	-60.9	0	0	0	113.5	V26	D24-V26 PolarHBondContact O-N 3.36Å
25	P	36.3	Very low	34.3	Very low	127 Å²	127	154.4 Å²	154.4	83%	0.825	81%	0.809	S	S	*	*			trans	-80.7	109.1	158.4	26.2	-19.5	0	0	0	110
26	V	38.3	Very low	34.2	Very low	124 Å²	124	156.8 Å²	156.8	75%	0.752	82%	0.817	S	S	*	*			trans	-54.2	143.6	172.6	173	0	0	0	0	111.9	D24	D24-V26 PolarHBondContact O-N 3.36Å
27	P	35.8	Very low	33.4	Very low	113 Å²	113	155.2 Å²	155.2	73%	0.734	82%	0.817	S	S	*	*			trans	-69.3	133	175.5	28.2	-35.2	0	0	0	112.2	A29	P27-A29 PolarHBondContact O-N 3.08Å; P27-A29 VanDerWaalsContact O-N 3.08Å
28	E	34.4	Very low	32.6	Very low	198 Å²	198	161.5 Å²	161.5	93%	0.925	83%	0.825	S	S	*	*			trans	-74.3	101.2	172.7	-160.3	175.8	-179.6	0	0	110
29	A	39.8	Very low	32.4	Very low	81 Å²	81	162 Å²	162	67%	0.669	83%	0.829	S	S	*	*			trans	-78.1	154.9	173.7	0	0	0	0	0	111.6	P27	P27-A29 PolarHBondContact O-N 3.08Å; P27-A29 VanDerWaalsContact O-N 3.08Å
30	P	35.7	Very low	32.2	Very low	120 Å²	120	157.9 Å²	157.9	78%	0.779	83%	0.826	S	S	*	*			trans	-73.6	147.7	-166.9	30.2	-34.8	0	0	0	113	R32	P30-R32 PolarHBondContact O-N 2.93Å
31	K	31.6	Very low	32	Very low	212 Å²	212	163.1 Å²	163.1	92%	0.922	84%	0.836	S	S	*	*			trans	-60.4	102.5	169.6	-76.4	178.7	179.2	171.3	0	110.7	R33	K31-R33 PolarHBondContact O-N 3.25Å
32	R	28.8	Very low	31.6	Very low	243 Å²	243	161.8 Å²	161.8	92%	0.917	84%	0.835	S	S	*	*			trans	-53.8	113.6	162.6	-90.7	174	148.5	-161.3	-3.1	110.6	P30	P30-R32 PolarHBondContact O-N 2.93Å
33	R	32.8	Very low	31.6	Very low	244 Å²	244	167 Å²	167	92%	0.921	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-77.7	128.7	151	-90.3	180	167	179.4	-3.4	108.5	K31 R35	K31-R33 PolarHBondContact O-N 3.25Å; R33-R35 PolarHBondContact O-N 3.44Å
34	K	30.4	Very low	31.6	Very low	208 Å²	208	165.3 Å²	165.3	90%	0.904	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-61.9	126.5	-178.6	-73.6	178	176	176.8	0	111.2
35	R	26.3	Very low	31.5	Very low	234 Å²	234	164.1 Å²	164.1	88%	0.883	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-75.1	122.3	165.2	-164.2	175.8	-178.8	-177.4	-0.2	108	R33	R33-R35 PolarHBondContact O-N 3.44Å
36	K	28.9	Very low	31.4	Very low	211 Å²	211	165 Å²	165	92%	0.917	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-97.1	121.2	157.5	-93.2	-173.6	176.5	-178.9	0	107.5
37	T	26	Very low	31.4	Very low	128 Å²	128	167.3 Å²	167.3	79%	0.785	85%	0.847	S	S	*	*	P	Polyproline II helix	trans	-73.9	134.8	167	33.2	0	0	0	0	110.4
38	R	28.2	Very low	31.3	Very low	249 Å²	249	167.9 Å²	167.9	94%	0.94	85%	0.85	S	S	*	*			trans	-146	128.1	143.5	-159.8	171.2	177.4	179.2	-2.1	108
39	A	28	Very low	31.1	Very low	92 Å²	92	168.7 Å²	168.7	76%	0.76	85%	0.851	S	S	*	*			trans	-79.9	153.4	-177.4	0	0	0	0	0	112
40	A	27.1	Very low	30.7	Very low	94 Å²	94	174.5 Å²	174.5	78%	0.777	86%	0.861	S	S	*	*			trans	45.3	119.9	147.7	0	0	0	0	0	120
41	E	28.5	Very low	30.7	Very low	199 Å²	199	174.5 Å²	174.5	93%	0.93	86%	0.861	S	S	*	*				-162.7	143.6	106.7	-105.7	174.1	169.1	0	0	110.9
42	A	28.5	Very low	30.8	Very low	94 Å²	94	169.4 Å²	169.4	78%	0.777	86%	0.858	S	S	*	*			trans	-82.6	143.9	-175.4	0	0	0	0	0	111.5
43	Q	30.3	Very low	30.9	Very low	200 Å²	200	162.8 Å²	162.8	94%	0.935	86%	0.855	S	S	*	*			trans	-141.3	127.5	159.5	-69.8	-167	-7.2	0	0	110.8
44	D	33.7	Very low	30.9	Very low	152 Å²	152	157 Å²	157	81%	0.813	85%	0.852	S	S	*	*	P	Polyproline II helix	trans	-67.4	160.4	-178.2	-75.4	-56.7	0	0	0	114.5
45	P	32.3	Very low	30.9	Very low	123 Å²	123	157.2 Å²	157.2	80%	0.799	85%	0.853	S	S	*	*	P	Polyproline II helix	trans	-80.8	132.4	-177.3	31.8	-32	0	0	0	112.5
46	V	33.9	Very low	31.1	Very low	146 Å²	146	155.9 Å²	155.9	89%	0.885	85%	0.854	S	S	*	*	P	Polyproline II helix	trans	-89.6	120.7	175.7	176.1	0	0	0	0	110.8
47	E	37.8	Very low	31.2	Very low	173 Å²	173	151.7 Å²	151.7	81%	0.808	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-67.9	158.7	171.8	-95.9	-176.1	138.7	0	0	114.4
48	P	33.9	Very low	31.3	Very low	124 Å²	124	149.5 Å²	149.5	81%	0.805	85%	0.854	S	S	*	*	P	Polyproline II helix	trans	-80.9	136.3	-176.6	32.2	-32.5	0	0	0	113.3
49	K	31.1	Very low	31.4	Very low	215 Å²	215	147.6 Å²	147.6	94%	0.935	85%	0.852	S	S	*	*	P	Polyproline II helix	trans	-78.7	128.8	174.3	-76.2	-177.8	176.4	175.7	0	112.4
50	K	31.9	Very low	31.4	Very low	204 Å²	204	148.4 Å²	148.4	89%	0.887	85%	0.852	S	S	*	*	P	Polyproline II helix	trans	-77.1	164.9	167.3	-102.2	-178.6	-179.5	175.3	0	112.4
51	P	34.9	Very low	31.7	Very low	120 Å²	120	150.7 Å²	150.7	78%	0.779	86%	0.857	S	S	*	*	P	Polyproline II helix	trans	-92	158	-150.6	36	-35.9	0	0	0	115.2
52	A	32.8	Very low	31.7	Very low	105 Å²	105	150.6 Å²	150.6	87%	0.868	85%	0.853	S	S	*	*	P	Polyproline II helix	trans	-82.3	141.2	172.8	0	0	0	0	0	112.2
53	A	30.7	Very low	31.9	Very low	103 Å²	103	151.1 Å²	151.1	85%	0.851	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-78.8	146.9	178.7	0	0	0	0	0	113
54	S	32.8	Very low	31.9	Very low	123 Å²	123	151.5 Å²	151.5	86%	0.86	85%	0.85	S	S	*	*			trans	-137.1	145.3	157.7	60.6	0	0	0	0	110.8
55	K	31.8	Very low	32	Very low	213 Å²	213	153.9 Å²	153.9	93%	0.926	86%	0.856	S	S	*	*			trans	-85.4	155.5	-162.4	-75.5	173.5	175.1	173	0	113.7
56	K	29.1	Very low	32	Very low	206 Å²	206	157 Å²	157	90%	0.896	86%	0.857	S	S	*	*			trans	-31	142.4	168.1	-64.1	174	174.3	179.2	0	117.7
57	S	31.2	Very low	32.3	Very low	123 Å²	123	159.4 Å²	159.4	86%	0.86	86%	0.859	S	S	*	*			trans	-142.3	122.5	134.4	59.3	0	0	0	0	109
58	G	29	Very low	32.5	Very low	81 Å²	81	159.4 Å²	159.4	84%	0.835	86%	0.859	S	S	*	*			trans	-85.8	154.3	-176.3	0	0	0	0	0	113.7
59	K	29.2	Very low	32.6	Very low	209 Å²	209	162 Å²	162	91%	0.909	86%	0.857	S	S	*	*			trans	-152.7	122.4	144.8	-150.2	169.1	-176.2	175.8	0	109.6
60	S	28.9	Very low	33.5	Very low	109 Å²	109	159.4 Å²	159.4	76%	0.762	85%	0.852	S	S	*	*			trans	-75.7	137.3	179.8	46.4	0	0	0	0	112.6
61	T	32.4	Very low	34.2	Very low	143 Å²	143	154.3 Å²	154.3	88%	0.877	84%	0.838	S	S	*	*			trans	-155.6	110.1	152.7	19.9	0	0	0	0	112.3
62	K	30.5	Very low	34.7	Very low	197 Å²	197	154.7 Å²	154.7	86%	0.857	83%	0.834	S	S	*	*			trans	23	109.1	148.5	-78.1	179.2	172.2	178.4	0	120.9
63	S	31.8	Very low	35.4	Very low	104 Å²	104	155 Å²	155	73%	0.727	82%	0.824	S	S	*	*				31.3	115.5	121.1	59.4	0	0	0	0	120
64	K	30.8	Very low	36.5	Very low	208 Å²	208	158.7 Å²	158.7	90%	0.904	82%	0.822	S	S	*	*			trans	-150.4	96.4	134.9	-102	-179.9	-178.2	179.6	0	108.3	K66	K64-K66 PolarHBondContact O-N 2.98Å
65	E	35.6	Very low	37.1	Very low	203 Å²	203	161.9 Å²	161.9	95%	0.949	82%	0.82	S	S	*	*			trans	-60.7	115.6	161.5	-86.7	173.3	136.8	0	0	108
66	K	32.1	Very low	37.7	Very low	189 Å²	189	157.6 Å²	157.6	82%	0.822	81%	0.811	S	S	*	*			trans	-103.6	107.8	165	-148.8	178.5	-176.1	-172.7	0	104.7	K64 E68	K64-K66 PolarHBondContact O-N 2.98Å; K66-E68 VanDerWaalsContact C-N 3.34Å; K66-E68 PolarHBondContact O-N 3.13Å
67	Q	39.3	Very low	38.9	Very low	196 Å²	196	156.7 Å²	156.7	92%	0.916	81%	0.808	S	S	*	*			trans	-55.6	100.9	167.1	-91.8	174.6	-47	0	0	107.9	K69	Q67-K69 PolarHBondContact O-N 3.17Å; Q67-K69 VanDerWaalsContact O-N 3.13Å
68	E	42.8	Very low	40.1	Very low	172 Å²	172	162.1 Å²	162.1	80%	0.804	81%	0.809	S	S	*	*			trans	-73	103.1	162	-74.8	-173.2	166.7	0	0	106.8	K66 I70	K66-E68 VanDerWaalsContact C-N 3.34Å; K66-E68 PolarHBondContact O-N 3.13Å; E68-I70 PolarHBondContact O-N 3.29Å
69	K	36.2	Very low	42	Very low	179 Å²	179	168 Å²	168	78%	0.778	81%	0.812	S	S	*	*			trans	-59.9	99.5	172.2	-164.9	-179.6	-174.2	-175.2	0	107.1	Q67 T71	Q67-K69 PolarHBondContact O-N 3.17Å; Q67-K69 VanDerWaalsContact O-N 3.13Å; K69-T71 HydrophobicContact CG-CG2 4.27Å; K69-T71 PolarHBondContact O-N 3.45Å
70	I	49.8	Very low	44.5	Very low	160 Å²	160	164 Å²	164	82%	0.821	81%	0.805	S	S	*	*			trans	-66.8	83.9	168.3	-58.2	170.5	0	0	0	106.7	E68	E68-I70 PolarHBondContact O-N 3.29Å
71	T	45.5	Very low	47.2	Very low	97 Å²	97	163.4 Å²	163.4	60%	0.595	79%	0.793	S	S	*	*			trans	-117.4	55.3	153.2	56.6	0	0	0	0	106.8	K69 T73	K69-T71 HydrophobicContact CG-CG2 4.27Å; K69-T71 PolarHBondContact O-N 3.45Å; T71-T73 PolarHBondContact O-N 2.61Å; T71-T73 VanDerWaalsContact O-N 3.16Å
72	D	46.5	Very low	49.7	Very low	129 Å²	129	163.6 Å²	163.6	69%	0.69	78%	0.777	S	S	*	*			trans	-81.3	83.7	158.3	-155.8	0.7	0	0	0	105.8	F74	D72-F74 PolarHBondContact O-N 3.06Å
73	T	48.1	Very low	52.5	Low	110 Å²	110	154.7 Å²	154.7	68%	0.675	74%	0.739	S	S	*	*			trans	-61.8	94.5	174	-36.2	0	0	0	0	105.9	T71 K75	T71-T73 PolarHBondContact O-N 2.61Å; T71-T73 VanDerWaalsContact O-N 3.16Å; T73-K75 VanDerWaalsContact C-N 3.28Å; T73-K75 PolarHBondContact O-N 3.19Å
74	F	52.3	Low	55.2	Low	181 Å²	181	156.2 Å²	156.2	79%	0.794	74%	0.739	S	S	*	*			trans	-49.7	97.7	169.8	-83.4	-94.3	0	0	0	107.5	D72 V76	D72-F74 PolarHBondContact O-N 3.06Å; F74-V76 PolarHBondContact O-N 3.46Å
75	K	46.9	Very low	58	Low	191 Å²	191	149.4 Å²	149.4	83%	0.83	73%	0.728	S	S	*	*			trans	-69.4	84.2	170	-73.2	-176.2	-179.4	178.8	0	105.8	T73 K77	T73-K75 VanDerWaalsContact C-N 3.28Å; T73-K75 PolarHBondContact O-N 3.19Å; K75-K77 PolarHBondContact O-N 3Å
76	V	44.6	Very low	60.7	Low	122 Å²	122	141.4 Å²	141.4	74%	0.739	69%	0.693	S	S	*	*			trans	-59.7	96.9	164.1	-179.8	0	0	0	0	104.9	F74 R78	F74-V76 PolarHBondContact O-N 3.46Å; V76-R78 PolarHBondContact O-N 2.81Å
77	K	53.4	Low	63.6	Low	188 Å²	188	135.4 Å²	135.4	82%	0.817	67%	0.674	S	S	*	*			trans	-56	108.2	169.5	-76.6	-176.4	176.9	179.4	0	105.3	K75 K79	K75-K77 PolarHBondContact O-N 3Å; K77-K79 PolarHBondContact O-N 3.16Å
78	R	56.6	Low	66.1	Low	237 Å²	237	130.1 Å²	130.1	89%	0.894	65%	0.649	S	S	*	*			trans	-51	119.7	172.7	-81.8	-178.5	168.3	154.3	-3.7	106.2	V76 V80	V76-R78 PolarHBondContact O-N 2.81Å; R78-V80 PolarHBondContact O-N 3.37Å
79	K	69	Low	68.5	Low	204 Å²	204	125.2 Å²	125.2	89%	0.887	64%	0.639	S	S	*	*			trans	-60.2	114.1	174.1	-71.4	-176.4	178.9	-179	0	105.9	K77 D81	K77-K79 PolarHBondContact O-N 3.16Å; K79-D81 PolarHBondContact O-N 2.83Å
80	V	81.7	Confident	71.3	Confident	125 Å²	125	120.7 Å²	120.7	76%	0.758	62%	0.62	S	S	*	*			trans	-65.7	117.1	175.6	178.6	0	0	0	0	106.6	R78 R82	R78-V80 PolarHBondContact O-N 3.37Å; V80-R82 HydrophobicContact CG1-CG 4.28Å; V80-R82 PolarHBondContact O-N 2.64Å; V80-R82 VanDerWaalsContact O-N 3.16Å
81	D	84.3	Confident	73.4	Confident	96 Å²	96	113 Å²	113	51%	0.513	58%	0.581	S	S	.	*			trans	-74.2	104.4	175.4	-178.8	12.7	0	0	0	109.3	K79 F83 N84 G85	K79-D81 PolarHBondContact O-N 2.83Å; D81-F83 PolarHBondContact OD1-N 3.16Å; D81-N84 PolarHBondContact OD1-N 2.94Å; D81-N84 WeakPolarHBondContact OD2-CA 3.2Å; D81-G85 VanDerWaalsContact CG-N 3.28Å; D81-G85 PolarHBondContact OD1-N 3.23Å; D81-G85 VanDerWaalsContact OD1-N 3.08Å; D81-G85 PolarHBondContact OD2-N 2.81Å
82	R	85	Confident	75.7	Confident	147 Å²	147	111.6 Å²	111.6	56%	0.555	57%	0.569	S	S	*	*	S	Bend	trans	-92	-9.8	179.5	-61.9	-171.9	-62.2	163.7	-0.7	113.1	V80	V80-R82 HydrophobicContact CG1-CG 4.28Å; V80-R82 PolarHBondContact O-N 2.64Å; V80-R82 VanDerWaalsContact O-N 3.16Å
83	F	89.4	Confident	78	Confident	11 Å²	11	110.9 Å²	110.9	5%	0.048	57%	0.57	C	S	.	*	S	Bend	trans	-136.3	28.4	-166.3	-53.6	-66	0	0	0	112.3	D81 G85 V86 L91 L115 M116 Y119	D81-F83 PolarHBondContact OD1-N 3.16Å; F83-G85 VanDerWaalsContact C-N 3.31Å; F83-G85 PolarHBondContact O-N 3.06Å; F83-V86 HydrophobicContact CB-CB 4.1Å; F83-V86 WeakPolarHBondContact O-CB 3.42Å; F83-V86 WeakPolarHBondContact O-CG2 3.48Å; F83-V86 PolarHBondContact O-N 3.16Å; F83-L91 HydrophobicContact CB-CD1 4.22Å; F83-L91 HydrophobicContact CD1-CD1 3.71Å; F83-L91 HydrophobicContact CD2-CD1 3.62Å; F83-L91 HydrophobicContact CE1-CD1 3.89Å; F83-L91 HydrophobicContact CE2-CD1 3.8Å; F83-L91 HydrophobicContact CG-CD1 3.58Å; F83-L91 HydrophobicContact CZ-CD1 3.94Å; F83-L115 HydrophobicContact CE1-CB 4.07Å; F83-L115 HydrophobicContact CE2-CB 4.39Å; F83-L115 HydrophobicContact CE2-CD1 4.19Å; F83-L115 HydrophobicContact CZ-CB 3.56Å; F83-L115 HydrophobicContact CZ-CD1 3.97Å; F83-L115 HydrophobicContact CZ-CG 4.42Å; F83-M116 HydrophobicContact CD1-CE 4.22Å; F83-M116 HydrophobicContact CE1-CE 3.87Å; F83-M116 HydrophobicContact CE1-SD 4.36Å; F83-Y119 HydrophobicContact CB-CD2 3.93Å; F83-Y119 HydrophobicContact CB-CE2 4Å; F83-Y119 HydrophobicContact CB-CG 4.35Å; F83-Y119 HydrophobicContact CD1-CD1 4.1Å; F83-Y119 HydrophobicContact CD1-CD2 4.26Å; F83-Y119 AromaticContact CD1-CG 3.83Å; F83-Y119 HydrophobicContact CD1-CG 3.83Å; F83-Y119 HydrophobicContact CG-CD2 4.5Å; F83-Y119 WeakPolarHBondContact O-CE2 3.49Å; F83-Y119 PolarHBondContact O-OH 3.01Å
84	N	89.9	Confident	80.3	Confident	136 Å²	136	109 Å²	109	73%	0.727	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	50	48.6	174.5	-163.1	51	0	0	0	113.1	D81 Y119	D81-N84 PolarHBondContact OD1-N 2.94Å; D81-N84 WeakPolarHBondContact OD2-CA 3.2Å; N84-Y119 VanDerWaalsContact CB-OH 3.3Å; N84-Y119 WeakPolarHBondContact CB-OH 3.33Å
85	G	88.1	Confident	82.5	Confident	65 Å²	65	103.8 Å²	103.8	67%	0.67	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.9	-9	178.5	0	0	0	0	0	115.2	D81 F83	D81-G85 VanDerWaalsContact CG-N 3.28Å; D81-G85 PolarHBondContact OD1-N 3.23Å; D81-G85 VanDerWaalsContact OD1-N 3.08Å; D81-G85 PolarHBondContact OD2-N 2.81Å; F83-G85 VanDerWaalsContact C-N 3.31Å; F83-G85 PolarHBondContact O-N 3.06Å
86	V	92.1	Very high	84.9	Confident	35 Å²	35	95.1 Å²	95.1	21%	0.212	50%	0.498	C	S	.	.			trans	-76.6	128.9	176.9	-178.8	0	0	0	0	110.6	F83 E90 L91 Y119	F83-V86 HydrophobicContact CB-CB 4.1Å; F83-V86 WeakPolarHBondContact O-CB 3.42Å; F83-V86 WeakPolarHBondContact O-CG2 3.48Å; F83-V86 PolarHBondContact O-N 3.16Å; V86-E90 HydrophobicContact CG1-CB 4.26Å; V86-E90 HydrophobicContact CG1-CG 4.44Å; V86-L91 HydrophobicContact CG1-CD2 3.72Å; V86-L91 HydrophobicContact CG1-CG 3.93Å; V86-Y119 HydrophobicContact CB-CD2 4.22Å; V86-Y119 HydrophobicContact CB-CE2 4.08Å; V86-Y119 HydrophobicContact CG1-CD2 4.5Å; V86-Y119 HydrophobicContact CG2-CD2 4.25Å; V86-Y119 HydrophobicContact CG2-CE2 3.76Å
87	S	93.5	Very high	87.5	Confident	62 Å²	62	93.6 Å²	93.6	43%	0.434	49%	0.491	S	S	.	.			trans	-74.1	147.6	-179.4	77.7	0	0	0	0	112.1	A89 E90 L91	S87-A89 PolarHBondContact O-N 3.24Å; S87-E90 WeakPolarHBondContact O-CB 3.16Å; S87-E90 PolarHBondContact O-N 3.28Å; S87-E90 PolarHBondContact OG-N 3.2Å; S87-L91 PolarHBondContact O-N 2.84Å
88	E	92.4	Very high	89.6	Confident	85 Å²	85	87.4 Å²	87.4	40%	0.397	47%	0.467	S	S	.	.	H	α-helix	trans	-59.5	-37	174.5	-175.9	169.6	165.9	0	0	112	E90 L91 L92 L115 P170	E88-E90 VanDerWaalsContact C-N 3.31Å; E88-E90 PolarHBondContact O-N 3.3Å; E88-L91 PolarHBondContact O-N 2.99Å; E88-L91 VanDerWaalsContact O-N 3.11Å; E88-L92 WeakPolarHBondContact O-CG 3.46Å; E88-L92 PolarHBondContact O-N 2.7Å; E88-L115 HydrophobicContact CG-CD1 3.93Å; E88-L115 HydrophobicContact CG-CD2 4.04Å; E88-P170 WeakPolarHBondContact OE1-CG 3.41Å
89	A	93.4	Very high	91.6	Very high	70 Å²	70	77 Å²	77	58%	0.579	43%	0.428	S	S	*	.	H	α-helix	trans	-59.9	-40	177.4	0	0	0	0	0	112.4	S87 L92	S87-A89 PolarHBondContact O-N 3.24Å; A89-L92 PolarHBondContact O-N 3.21Å
90	E	94.4	Very high	93.1	Very high	83 Å²	83	68.5 Å²	68.5	39%	0.388	39%	0.392	S	S	.	.	H	α-helix	trans	-63.9	-44.6	173.8	-171.6	-166.9	133.9	0	0	111	V86 S87 E88 L92 T93 K94	V86-E90 HydrophobicContact CG1-CB 4.26Å; V86-E90 HydrophobicContact CG1-CG 4.44Å; S87-E90 WeakPolarHBondContact O-CB 3.16Å; S87-E90 PolarHBondContact O-N 3.28Å; S87-E90 PolarHBondContact OG-N 3.2Å; E88-E90 VanDerWaalsContact C-N 3.31Å; E88-E90 PolarHBondContact O-N 3.3Å; E90-L92 VanDerWaalsContact C-N 3.28Å; E90-L92 PolarHBondContact O-N 2.89Å; E90-T93 PolarHBondContact O-N 3.26Å; E90-T93 PolarHBondContact O-OG1 3.22Å; E90-K94 WeakPolarHBondContact OE1-CE 3.31Å; E90-K94 IonicContact OE1-NZ 2.92Å; E90-K94 PolarHBondContact OE1-NZ 3.27Å
91	L	93.8	Very high	93.9	Very high	0 Å²	0	65.6 Å²	65.6	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-62.7	-33.4	-179.9	-63.9	-178.8	0	0	0	113.4	F83 V86 S87 E88 T93 K94 L115 Y119	F83-L91 HydrophobicContact CB-CD1 4.22Å; F83-L91 HydrophobicContact CD1-CD1 3.71Å; F83-L91 HydrophobicContact CD2-CD1 3.62Å; F83-L91 HydrophobicContact CE1-CD1 3.89Å; F83-L91 HydrophobicContact CE2-CD1 3.8Å; F83-L91 HydrophobicContact CG-CD1 3.58Å; F83-L91 HydrophobicContact CZ-CD1 3.94Å; V86-L91 HydrophobicContact CG1-CD2 3.72Å; V86-L91 HydrophobicContact CG1-CG 3.93Å; S87-L91 PolarHBondContact O-N 2.84Å; E88-L91 PolarHBondContact O-N 2.99Å; E88-L91 VanDerWaalsContact O-N 3.11Å; L91-T93 PolarHBondContact O-N 3.41Å; L91-K94 HydrophobicContact CD2-CD 4.08Å; L91-K94 PolarHBondContact O-N 3.06Å; L91-K94 VanDerWaalsContact O-N 3.09Å; L91-L115 HydrophobicContact CB-CD2 4.14Å; L91-L115 HydrophobicContact CD1-CB 4.37Å; L91-Y119 HydrophobicContact CD2-CD2 4.05Å; L91-Y119 HydrophobicContact CD2-CG 4.41Å
92	L	94.2	Very high	94.6	Very high	66 Å²	66	66.8 Å²	66.8	35%	0.346	38%	0.376	S	S	.	.	H	α-helix	trans	-65	-20.3	176	-66.8	174.3	0	0	0	113.1	E88 A89 E90 L115 T168	E88-L92 WeakPolarHBondContact O-CG 3.46Å; E88-L92 PolarHBondContact O-N 2.7Å; A89-L92 PolarHBondContact O-N 3.21Å; E90-L92 VanDerWaalsContact C-N 3.28Å; E90-L92 PolarHBondContact O-N 2.89Å; L92-L115 HydrophobicContact CD2-CD2 3.94Å; L92-L115 HydrophobicContact CG-CD2 4.5Å; L92-T168 WeakPolarHBondContact CD2-O 3.37Å
93	T	95.4	Very high	95.2	Very high	114 Å²	114	67.1 Å²	67.1	70%	0.699	39%	0.389	S	S	*	.	H	α-helix	trans	-87.2	-15.1	174.8	70.6	0	0	0	0	113.3	E90 L91	E90-T93 PolarHBondContact O-N 3.26Å; E90-T93 PolarHBondContact O-OG1 3.22Å; L91-T93 PolarHBondContact O-N 3.41Å
94	K	96.8	Very high	95.7	Very high	71 Å²	71	66.7 Å²	66.7	31%	0.309	39%	0.387	S	S	.	.			trans	-80.5	150.2	178.8	-64.3	-173.1	-176.7	179.2	0	110.7	E90 L91 A118 T168	E90-K94 WeakPolarHBondContact OE1-CE 3.31Å; E90-K94 IonicContact OE1-NZ 2.92Å; E90-K94 PolarHBondContact OE1-NZ 3.27Å; L91-K94 HydrophobicContact CD2-CD 4.08Å; L91-K94 PolarHBondContact O-N 3.06Å; L91-K94 VanDerWaalsContact O-N 3.09Å; K94-A118 HydrophobicContact CB-CB 4.17Å; K94-T168 WeakPolarHBondContact O-CB 3.49Å; K94-T168 PolarHBondContact O-OG1 3.24Å
95	T	97.1	Very high	96.1	Very high	71 Å²	71	60.7 Å²	60.7	44%	0.436	36%	0.355	S	S	.	.			trans	-115.3	167.8	170	60.4	0	0	0	0	109.3	E166	T95-E166 HydrophobicContact CG2-CG 3.69Å
96	L	97.9	Very high	96.6	Very high	10 Å²	10	57.7 Å²	57.7	5%	0.052	32%	0.323	C	S	.	.			trans	-113.5	120.2	174.6	-177.8	65.5	0	0	0	108.7	P113 A117 G121 H123	L96-P113 HydrophobicContact CB-CB 3.9Å; L96-P113 HydrophobicContact CB-CG 3.59Å; L96-P113 HydrophobicContact CD2-CB 4.46Å; L96-A117 HydrophobicContact CD2-CB 4.09Å; L96-G121 WeakPolarHBondContact CD1-O 3.36Å; L96-H123 VanDerWaalsContact CD2-CE1 3.45Å; L96-H123 WeakPolarHBondContact CD2-CE1 3.38Å; L96-H123 WeakPolarHBondContact CD2-ND1 3.45Å
97	P	98.4	Very high	96.9	Very high	90 Å²	90	56 Å²	56	58%	0.584	31%	0.313	S	S	*	.			trans	-58.5	139.1	177.5	-26.1	35.7	0	0	0	112.4	H123	P97-H123 PolarHBondContact O-NE2 3.39Å
98	D	98.8	Very high	97.2	Very high	58 Å²	58	53.2 Å²	53.2	31%	0.31	29%	0.293	S	S	.	.			trans	-67.6	147.9	168.7	-70.6	-27.1	0	0	0	110.6	L100 T162 K190	D98-L100 HydrophobicContact CB-CD1 4.04Å; D98-L100 HydrophobicContact CB-CG 4.13Å; D98-T162 VanDerWaalsContact OD1-CA 3.26Å; D98-T162 WeakPolarHBondContact OD1-CA 3.47Å; D98-T162 VanDerWaalsContact OD1-CB 3.28Å; D98-T162 WeakPolarHBondContact OD1-CB 3.4Å; D98-T162 PolarHBondContact OD1-OG1 2.82Å; D98-T162 PolarHBondContact OD2-OG1 3.35Å; D98-K190 IonicContact OD1-NZ 3.26Å; D98-K190 VanDerWaalsContact OD2-CE 3.27Å; D98-K190 WeakPolarHBondContact OD2-CE 3.47Å; D98-K190 IonicContact OD2-NZ 3.03Å; D98-K190 PolarHBondContact OD2-NZ 2.87Å
99	I	98.9	Very high	97.5	Very high	18 Å²	18	49.1 Å²	49.1	9%	0.092	27%	0.274	C	S	.	.	B	Isolated β-bridge	trans	-115.4	87.9	171.3	-57.6	177.6	0	0	0	106.7	D150 P154 G160 F161	I99-D150 HydrophobicContact CD1-CB 3.9Å; I99-P154 HydrophobicContact CG2-CG 3.39Å; I99-G160 CarbonylContact O-C 3.17Å; I99-G160 WeakPolarHBondContact O-CA 3.24Å; I99-F161 HydrophobicContact CB-CB 4.32Å; I99-F161 HydrophobicContact CB-CD2 4.24Å; I99-F161 HydrophobicContact CD1-CD2 4.2Å; I99-F161 PolarHBondContact N-O 3.42Å; I99-F161 PolarHBondContact O-N 3.4Å
100	L	98.9	Very high	97.7	Very high	25 Å²	25	45.9 Å²	45.9	13%	0.131	25%	0.248	C	C	.	.			trans	-129.4	129.6	-175.7	-66.8	172.7	0	0	0	111	D98 L104 V107 K190 Y194	D98-L100 HydrophobicContact CB-CD1 4.04Å; D98-L100 HydrophobicContact CB-CG 4.13Å; L100-L104 HydrophobicContact CD2-CD1 4.47Å; L100-V107 HydrophobicContact CD2-CB 4.39Å; L100-V107 HydrophobicContact CD2-CG1 3.7Å; L100-V107 HydrophobicContact CD2-CG2 3.67Å; L100-K190 HydrophobicContact CD1-CB 4.4Å; L100-K190 HydrophobicContact CD1-CD 4.24Å; L100-Y194 HydrophobicContact CB-CD1 4.24Å; L100-Y194 HydrophobicContact CB-CD2 3.92Å; L100-Y194 HydrophobicContact CB-CE1 4.11Å; L100-Y194 HydrophobicContact CB-CE2 3.82Å; L100-Y194 HydrophobicContact CB-CG 4.14Å; L100-Y194 HydrophobicContact CD1-CD2 3.85Å; L100-Y194 HydrophobicContact CD1-CE2 3.85Å; L100-Y194 HydrophobicContact CG-CD2 4.41Å; L100-Y194 HydrophobicContact CG-CE2 4.49Å
101	T	98.8	Very high	97.7	Very high	64 Å²	64	43 Å²	43	39%	0.393	23%	0.234	S	C	.	.			trans	-131	165.4	171	63.3	0	0	0	0	109.1	L104 P154	T101-L104 WeakPolarHBondContact O-CD1 3.4Å; T101-L104 WeakPolarHBondContact O-CG 3.35Å; T101-P154 HydrophobicContact CG2-CB 4.3Å
102	F	98.8	Very high	97.8	Very high	121 Å²	121	43.9 Å²	43.9	53%	0.531	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	163.7	169.1	-60.8	-83.6	0	0	0	110.5	L104 K193 Y194	F102-L104 VanDerWaalsContact C-N 3.27Å; F102-L104 PolarHBondContact O-N 3.02Å; F102-K193 HydrophobicContact CE1-CG 4.28Å; F102-K193 WeakPolarHBondContact CE1-O 3.42Å; F102-K193 HydrophobicContact CZ-CG 4.39Å; F102-Y194 HydrophobicContact CD1-CD1 4.26Å; F102-Y194 HydrophobicContact CE1-CD1 4.32Å; F102-Y194 HydrophobicContact CE2-CE1 4.41Å; F102-Y194 HydrophobicContact CG-CD1 4.36Å; F102-Y194 HydrophobicContact CZ-CD1 4.47Å; F102-Y194 HydrophobicContact CZ-CE1 4.49Å
103	N	98.5	Very high	97.8	Very high	154 Å²	154	40.9 Å²	40.9	82%	0.824	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.4	25.3	175.2	-52.4	-42.6	0	0	0	115.2
104	L	98.9	Very high	97.7	Very high	3 Å²	3	36.7 Å²	36.7	2%	0.016	20%	0.204	C	C	.	.			trans	-72.5	142.2	173.7	-70.8	173	0	0	0	111.3	L100 T101 F102 V107 P154 P196 R197	L100-L104 HydrophobicContact CD2-CD1 4.47Å; T101-L104 WeakPolarHBondContact O-CD1 3.4Å; T101-L104 WeakPolarHBondContact O-CG 3.35Å; F102-L104 VanDerWaalsContact C-N 3.27Å; F102-L104 PolarHBondContact O-N 3.02Å; L104-V107 HydrophobicContact CB-CG2 4.36Å; L104-V107 HydrophobicContact CD1-CG2 3.68Å; L104-P154 HydrophobicContact CD2-CB 3.96Å; L104-P196 HydrophobicContact CB-CB 4.14Å; L104-P196 CarbonylContact O-C 3.58Å; L104-P196 VanDerWaalsContact O-CA 3.24Å; L104-P196 WeakPolarHBondContact O-CA 3.29Å; L104-R197 PolarHBondContact O-N 3.31Å
105	D	98.9	Very high	97.6	Very high	10 Å²	10	33.9 Å²	33.9	5%	0.053	19%	0.192	C	C	.	.	S	Bend	trans	-75.7	-43.3	170.6	-68.5	-35.8	0	0	0	109.9	G158 R197 I198 R268 K272	D105-G158 PolarHBondContact N-O 3.02Å; D105-R197 WeakPolarHBondContact O-CB 3.45Å; D105-R197 PolarHBondContact O-N 2.8Å; D105-R197 VanDerWaalsContact OD1-CD 3.28Å; D105-R197 WeakPolarHBondContact OD1-CD 3.27Å; D105-R197 IonicContact OD1-NE 3.54Å; D105-R197 PolarHBondContact OD1-NE 2.78Å; D105-I198 PolarHBondContact O-N 3.47Å; D105-R268 HydrophobicContact CB-CG 3.9Å; D105-R268 IonicContact OD2-NH1 3.51Å; D105-K272 IonicContact OD1-NZ 3.99Å; D105-K272 WeakPolarHBondContact OD2-CD 3.38Å; D105-K272 WeakPolarHBondContact OD2-CE 3.19Å; D105-K272 IonicContact OD2-NZ 2.71Å; D105-K272 PolarHBondContact OD2-NZ 3.49Å
106	I	98.9	Very high	97.4	Very high	1 Å²	1	33.7 Å²	33.7	1%	0.005	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	137.5	-174.1	-68.5	163	0	0	0	109.5	I108 L140 G158 I159 G160 I198 V200 L264 R268	I106-I108 HydrophobicContact CG2-CD1 3.6Å; I106-I108 HydrophobicContact CG2-CG1 4.18Å; I106-L140 HydrophobicContact CD1-CD2 4.35Å; I106-G158 PolarHBondContact N-O 2.92Å; I106-I159 HydrophobicContact CB-CG1 4.23Å; I106-I159 HydrophobicContact CG2-CG2 4.3Å; I106-I159 CarbonylContact O-C 3.55Å; I106-I159 WeakPolarHBondContact O-CA 3.44Å; I106-G160 PolarHBondContact O-N 3.31Å; I106-I198 WeakPolarHBondContact CA-O 3.47Å; I106-I198 HydrophobicContact CG1-CB 4.39Å; I106-I198 HydrophobicContact CG1-CD1 4.24Å; I106-V200 HydrophobicContact CG2-CB 4.3Å; I106-V200 HydrophobicContact CG2-CG2 3.65Å; I106-L264 HydrophobicContact CD1-CD1 4.11Å; I106-L264 HydrophobicContact CD1-CD2 4.05Å; I106-L264 HydrophobicContact CD1-CG 3.91Å; I106-L264 HydrophobicContact CG1-CD1 4.3Å; I106-R268 HydrophobicContact CD1-CB 4.25Å; I106-R268 HydrophobicContact CD1-CG 3.98Å; I106-R268 HydrophobicContact CG1-CG 4.35Å
107	V	98.9	Very high	97.3	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	119.7	161.2	169.7	0	0	0	0	108.8	L100 L104 I109 G160 T162 L191 P196 I198 V200	L100-V107 HydrophobicContact CD2-CB 4.39Å; L100-V107 HydrophobicContact CD2-CG1 3.7Å; L100-V107 HydrophobicContact CD2-CG2 3.67Å; L104-V107 HydrophobicContact CB-CG2 4.36Å; L104-V107 HydrophobicContact CD1-CG2 3.68Å; V107-I109 HydrophobicContact CG1-CG1 4.09Å; V107-G160 WeakPolarHBondContact CA-O 3.42Å; V107-T162 HydrophobicContact CG1-CG2 3.82Å; V107-L191 HydrophobicContact CG1-CD2 4.48Å; V107-P196 HydrophobicContact CB-CB 4.2Å; V107-P196 HydrophobicContact CB-CG 4.01Å; V107-P196 HydrophobicContact CG2-CB 3.58Å; V107-P196 HydrophobicContact CG2-CG 3.68Å; V107-I198 PolarHBondContact N-O 2.96Å; V107-V200 PolarHBondContact O-N 2.91Å
108	I	98.9	Very high	97.2	Very high	3 Å²	3	29.6 Å²	29.6	2%	0.015	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	122.4	173.5	-52.7	-63.1	0	0	0	108.6	I106 Y124 F131 I159 G160 F161 T162 V200 N202	I106-I108 HydrophobicContact CG2-CD1 3.6Å; I106-I108 HydrophobicContact CG2-CG1 4.18Å; I108-Y124 HydrophobicContact CG2-CE2 3.84Å; I108-Y124 WeakPolarHBondContact CG2-OH 3.25Å; I108-F131 HydrophobicContact CB-CE2 4.43Å; I108-F131 HydrophobicContact CD1-CE2 4.08Å; I108-F131 HydrophobicContact CG1-CE2 3.81Å; I108-F131 HydrophobicContact CG1-CZ 4.06Å; I108-F131 HydrophobicContact CG2-CE2 3.98Å; I108-I159 HydrophobicContact CG1-CG2 3.93Å; I108-G160 PolarHBondContact N-O 2.67Å; I108-F161 HydrophobicContact CB-CD1 3.83Å; I108-F161 HydrophobicContact CB-CE1 4.03Å; I108-F161 HydrophobicContact CG1-CD1 4.29Å; I108-F161 HydrophobicContact CG1-CE1 4.03Å; I108-F161 HydrophobicContact CG2-CD1 4.39Å; I108-F161 HydrophobicContact CG2-CE1 4.5Å; I108-F161 WeakPolarHBondContact O-CA 3.28Å; I108-T162 PolarHBondContact O-N 2.97Å; I108-V200 HydrophobicContact CD1-CB 3.95Å; I108-V200 HydrophobicContact CD1-CG1 3.86Å; I108-V200 HydrophobicContact CD1-CG2 4.45Å; I108-N202 HydrophobicContact CG2-CB 4.15Å
109	I	98.8	Very high	97	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	104.9	-177.8	-55.7	166.7	0	0	0	107.7	V107 T162 L187 L191 A199 V200 F201 N202 I206	V107-I109 HydrophobicContact CG1-CG1 4.09Å; I109-T162 WeakPolarHBondContact CA-O 3.48Å; I109-T162 HydrophobicContact CG1-CG2 4Å; I109-L187 HydrophobicContact CD1-CD1 4.22Å; I109-L187 HydrophobicContact CD1-CD2 4.29Å; I109-L187 HydrophobicContact CG1-CD1 4.34Å; I109-L187 HydrophobicContact CG2-CD1 4.13Å; I109-L187 HydrophobicContact CG2-CD2 3.75Å; I109-L191 HydrophobicContact CD1-CD1 4.03Å; I109-L191 HydrophobicContact CD1-CD2 4.39Å; I109-A199 HydrophobicContact CD1-CB 3.82Å; I109-V200 WeakPolarHBondContact CB-O 3.48Å; I109-V200 PolarHBondContact N-O 2.88Å; I109-F201 HydrophobicContact CD1-CD1 4.5Å; I109-F201 HydrophobicContact CD1-CE1 4.21Å; I109-F201 HydrophobicContact CD1-CE2 4.24Å; I109-F201 HydrophobicContact CD1-CZ 4.07Å; I109-F201 HydrophobicContact CG2-CD1 4.46Å; I109-N202 WeakPolarHBondContact O-CB 3.18Å; I109-N202 PolarHBondContact O-N 3.17Å; I109-I206 HydrophobicContact CG2-CD1 4.39Å; I109-I206 WeakPolarHBondContact O-CD1 3.3Å
110	G	97.6	Very high	96.9	Very high	2 Å²	2	33.5 Å²	33.5	2%	0.021	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	174.9	171.7	0	0	0	0	0	112.8	Y124 T162 N163 M164	G110-Y124 WeakPolarHBondContact CA-OH 3.5Å; G110-Y124 PolarHBondContact N-OH 2.97Å; G110-T162 PolarHBondContact N-O 3.31Å; G110-N163 VanDerWaalsContact C-OD1 3.23Å; G110-N163 WeakPolarHBondContact CA-OD1 3.36Å; G110-N163 WeakPolarHBondContact O-CA 3.17Å; G110-M164 PolarHBondContact O-N 3.43Å
111	I	94.2	Very high	96.8	Very high	21 Å²	21	33.9 Å²	33.9	11%	0.108	18%	0.184	C	C	.	.	S	Bend	trans	-73.4	-63.6	175.3	-50.2	179.1	0	0	0	109.7	M164 V165 L175 F180 I206	I111-M164 PolarHBondContact O-N 2.66Å; I111-V165 PolarHBondContact O-N 2.91Å; I111-L175 HydrophobicContact CG2-CD1 3.86Å; I111-F180 HydrophobicContact CG2-CE1 3.84Å; I111-F180 HydrophobicContact CG2-CZ 4.16Å; I111-I206 HydrophobicContact CB-CG2 3.91Å; I111-I206 HydrophobicContact CD1-CG2 4.46Å; I111-I206 HydrophobicContact CG1-CD1 4.42Å; I111-I206 HydrophobicContact CG1-CG2 3.6Å; I111-I206 HydrophobicContact CG2-CG2 3.79Å
112	N	95.5	Very high	96.8	Very high	20 Å²	20	32.2 Å²	32.2	11%	0.107	17%	0.172	C	C	.	.	S	Bend	trans	-164.8	164.5	177.3	72.5	-61.6	0	0	0	108.9	G114 V165 R167 T169 L175	N112-G114 PolarHBondContact O-N 3.38Å; N112-V165 VanDerWaalsContact CA-O 3.27Å; N112-V165 WeakPolarHBondContact CA-O 3.33Å; N112-V165 HydrophobicContact CB-CB 4.08Å; N112-V165 VanDerWaalsContact CB-O 3.23Å; N112-V165 WeakPolarHBondContact CB-O 3.49Å; N112-R167 WeakPolarHBondContact CB-O 3.23Å; N112-R167 PolarHBondContact ND2-O 2.92Å; N112-T169 PolarHBondContact ND2-N 3.16Å; N112-T169 PolarHBondContact ND2-OG1 2.93Å; N112-L175 HydrophobicContact CB-CD1 3.98Å
113	P	95.2	Very high	96.8	Very high	3 Å²	3	26.6 Å²	26.6	2%	0.019	15%	0.147	C	C	.	.			trans	-63.4	131.1	177.4	-20.7	33.7	0	0	0	111.3	L96 A117 E166 T168 T169	L96-P113 HydrophobicContact CB-CB 3.9Å; L96-P113 HydrophobicContact CB-CG 3.59Å; L96-P113 HydrophobicContact CD2-CB 4.46Å; P113-A117 HydrophobicContact CB-CB 4.4Å; P113-E166 WeakPolarHBondContact CD-O 3.49Å; P113-T168 WeakPolarHBondContact O-CA 3.27Å; P113-T169 PolarHBondContact O-N 3.02Å; P113-T169 VanDerWaalsContact O-N 3.12Å
114	G	93.8	Very high	96.8	Very high	26 Å²	26	20.5 Å²	20.5	27%	0.268	11%	0.113	S	C	.	.			trans	-78.6	163.2	165.8	0	0	0	0	0	111.2	N112 M116 A117 A118 T169	N112-G114 PolarHBondContact O-N 3.38Å; G114-M116 VanDerWaalsContact C-N 3.27Å; G114-M116 PolarHBondContact O-N 2.94Å; G114-M116 VanDerWaalsContact O-N 3.16Å; G114-A117 WeakPolarHBondContact O-CA 3.35Å; G114-A117 WeakPolarHBondContact O-CB 3.24Å; G114-A117 PolarHBondContact O-N 3.42Å; G114-A118 PolarHBondContact O-N 3.16Å; G114-T169 WeakPolarHBondContact CA-O 3.24Å
115	L	93.4	Very high	96.6	Very high	12 Å²	12	21 Å²	21	6%	0.063	12%	0.116	C	C	.	.	H	α-helix	trans	-51.9	-41.7	179.7	-62.7	176.9	0	0	0	113.7	F83 E88 L91 L92 A117 A118 Y119 T168 P170	F83-L115 HydrophobicContact CE1-CB 4.07Å; F83-L115 HydrophobicContact CE2-CB 4.39Å; F83-L115 HydrophobicContact CE2-CD1 4.19Å; F83-L115 HydrophobicContact CZ-CB 3.56Å; F83-L115 HydrophobicContact CZ-CD1 3.97Å; F83-L115 HydrophobicContact CZ-CG 4.42Å; E88-L115 HydrophobicContact CG-CD1 3.93Å; E88-L115 HydrophobicContact CG-CD2 4.04Å; L91-L115 HydrophobicContact CB-CD2 4.14Å; L91-L115 HydrophobicContact CD1-CB 4.37Å; L92-L115 HydrophobicContact CD2-CD2 3.94Å; L92-L115 HydrophobicContact CG-CD2 4.5Å; L115-A117 VanDerWaalsContact C-N 3.35Å; L115-A118 PolarHBondContact O-N 3.28Å; L115-Y119 VanDerWaalsContact O-CB 3.28Å; L115-Y119 WeakPolarHBondContact O-CB 3.43Å; L115-Y119 PolarHBondContact O-N 3.19Å; L115-T168 HydrophobicContact CD2-CG2 4.14Å; L115-P170 HydrophobicContact CD1-CB 4.22Å; L115-P170 HydrophobicContact CD1-CG 4.13Å; L115-P170 HydrophobicContact CD2-CG 4.42Å; L115-P170 HydrophobicContact CG-CB 4.45Å; L115-P170 HydrophobicContact CG-CG 4.34Å
116	M	94.1	Very high	95.8	Very high	66 Å²	66	22.1 Å²	22.1	33%	0.325	13%	0.13	S	C	.	.	H	α-helix	trans	-68.1	-35.3	178.7	-168.9	60.1	69.5	0	0	112.2	F83 G114 Y119 K120 P125	F83-M116 HydrophobicContact CD1-CE 4.22Å; F83-M116 HydrophobicContact CE1-CE 3.87Å; F83-M116 HydrophobicContact CE1-SD 4.36Å; G114-M116 VanDerWaalsContact C-N 3.27Å; G114-M116 PolarHBondContact O-N 2.94Å; G114-M116 VanDerWaalsContact O-N 3.16Å; M116-Y119 PolarHBondContact O-N 3.39Å; M116-Y119 HydrophobicContact SD-CD1 3.9Å; M116-K120 HydrophobicContact CG-CG 4.4Å; M116-K120 WeakPolarHBondContact O-CB 3.26Å; M116-K120 WeakPolarHBondContact O-CG 3.22Å; M116-K120 PolarHBondContact O-N 3.17Å; M116-K120 HydrophobicContact SD-CG 4.12Å; M116-P125 VanDerWaalsContact C-CG 3.49Å; M116-P125 HydrophobicContact CB-CG 4.1Å; M116-P125 HydrophobicContact CG-CB 4Å; M116-P125 HydrophobicContact CG-CG 3.74Å; M116-P125 WeakPolarHBondContact O-CG 3.29Å
117	A	95.6	Very high	95	Very high	9 Å²	9	27.6 Å²	27.6	7%	0.074	17%	0.165	C	C	.	.	H	α-helix	trans	-66.2	-45	175.6	0	0	0	0	0	110.9	L96 P113 G114 L115 Y119 K120 G121 H122 P125	L96-A117 HydrophobicContact CD2-CB 4.09Å; P113-A117 HydrophobicContact CB-CB 4.4Å; G114-A117 WeakPolarHBondContact O-CA 3.35Å; G114-A117 WeakPolarHBondContact O-CB 3.24Å; G114-A117 PolarHBondContact O-N 3.42Å; L115-A117 VanDerWaalsContact C-N 3.35Å; A117-Y119 VanDerWaalsContact C-N 3.34Å; A117-Y119 PolarHBondContact O-N 2.97Å; A117-K120 PolarHBondContact O-N 3.03Å; A117-G121 WeakPolarHBondContact O-CA 3.28Å; A117-G121 PolarHBondContact O-N 3.19Å; A117-H122 PolarHBondContact O-N 3.45Å; A117-P125 VanDerWaalsContact CA-CG 3.47Å; A117-P125 HydrophobicContact CB-CG 4.09Å
118	A	95.3	Very high	94.4	Very high	5 Å²	5	29.7 Å²	29.7	4%	0.041	19%	0.187	C	C	.	.	H	α-helix	trans	-65.7	-35	174.9	0	0	0	0	0	113.2	K94 G114 L115 T168	K94-A118 HydrophobicContact CB-CB 4.17Å; G114-A118 PolarHBondContact O-N 3.16Å; L115-A118 PolarHBondContact O-N 3.28Å; A118-T168 HydrophobicContact CB-CG2 3.42Å; A118-T168 VanDerWaalsContact CB-CG2 3.42Å; A118-T168 WeakPolarHBondContact CB-OG1 3.4Å
119	Y	95.4	Very high	94.2	Very high	62 Å²	62	31.1 Å²	31.1	24%	0.243	20%	0.195	C	C	.	.	H	α-helix	trans	-68.9	-45.7	176	173.8	-109.3	0	0	0	112.2	F83 N84 V86 L91 L115 M116 A117	F83-Y119 HydrophobicContact CB-CD2 3.93Å; F83-Y119 HydrophobicContact CB-CE2 4Å; F83-Y119 HydrophobicContact CB-CG 4.35Å; F83-Y119 HydrophobicContact CD1-CD1 4.1Å; F83-Y119 HydrophobicContact CD1-CD2 4.26Å; F83-Y119 AromaticContact CD1-CG 3.83Å; F83-Y119 HydrophobicContact CD1-CG 3.83Å; F83-Y119 HydrophobicContact CG-CD2 4.5Å; F83-Y119 WeakPolarHBondContact O-CE2 3.49Å; F83-Y119 PolarHBondContact O-OH 3.01Å; N84-Y119 VanDerWaalsContact CB-OH 3.3Å; N84-Y119 WeakPolarHBondContact CB-OH 3.33Å; V86-Y119 HydrophobicContact CB-CD2 4.22Å; V86-Y119 HydrophobicContact CB-CE2 4.08Å; V86-Y119 HydrophobicContact CG1-CD2 4.5Å; V86-Y119 HydrophobicContact CG2-CD2 4.25Å; V86-Y119 HydrophobicContact CG2-CE2 3.76Å; L91-Y119 HydrophobicContact CD2-CD2 4.05Å; L91-Y119 HydrophobicContact CD2-CG 4.41Å; L115-Y119 VanDerWaalsContact O-CB 3.28Å; L115-Y119 WeakPolarHBondContact O-CB 3.43Å; L115-Y119 PolarHBondContact O-N 3.19Å; M116-Y119 PolarHBondContact O-N 3.39Å; M116-Y119 HydrophobicContact SD-CD1 3.9Å; A117-Y119 VanDerWaalsContact C-N 3.34Å; A117-Y119 PolarHBondContact O-N 2.97Å
120	K	95.9	Very high	94.2	Very high	97 Å²	97	32.2 Å²	32.2	42%	0.422	20%	0.2	S	C	.	.	H	α-helix	trans	-81.1	-25.3	-178.3	-68.3	-66	-172.9	173.5	0	113.5	M116 A117 H122 P125	M116-K120 HydrophobicContact CG-CG 4.4Å; M116-K120 WeakPolarHBondContact O-CB 3.26Å; M116-K120 WeakPolarHBondContact O-CG 3.22Å; M116-K120 PolarHBondContact O-N 3.17Å; M116-K120 HydrophobicContact SD-CG 4.12Å; A117-K120 PolarHBondContact O-N 3.03Å; K120-H122 VanDerWaalsContact C-N 3.28Å; K120-H122 HydrophobicContact CB-CB 4.45Å; K120-H122 PolarHBondContact O-CD2 3.36Å; K120-P125 HydrophobicContact CB-CB 4.41Å; K120-P125 HydrophobicContact CB-CG 4.32Å; K120-P125 HydrophobicContact CG-CB 4.18Å; K120-P125 HydrophobicContact CG-CG 4.37Å
121	G	97.7	Very high	94.2	Very high	32 Å²	32	32.1 Å²	32.1	33%	0.33	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.9	21.7	-172	0	0	0	0	0	113.5	L96 A117	L96-G121 WeakPolarHBondContact CD1-O 3.36Å; A117-G121 WeakPolarHBondContact O-CA 3.28Å; A117-G121 PolarHBondContact O-N 3.19Å
122	H	98.6	Very high	94.4	Very high	30 Å²	30	31.9 Å²	31.9	14%	0.139	20%	0.197	C	C	.	.	S	Bend	trans	-132.3	157.1	-176.2	-73	-77.3	0	0	0	111.9	A117 K120 P125 H147 D150 H151	A117-H122 PolarHBondContact O-N 3.45Å; K120-H122 VanDerWaalsContact C-N 3.28Å; K120-H122 HydrophobicContact CB-CB 4.45Å; K120-H122 PolarHBondContact O-CD2 3.36Å; H122-P125 VanDerWaalsContact O-CD 3.25Å; H122-P125 WeakPolarHBondContact O-CD 3.39Å; H122-H147 HydrophobicContact CB-CB 3.94Å; H122-H147 WeakPolarHBondContact CB-O 3.35Å; H122-H147 PolarHBondContact ND1-O 2.78Å; H122-D150 VanDerWaalsContact CA-OD2 3.27Å; H122-D150 WeakPolarHBondContact CA-OD2 3.5Å; H122-D150 WeakPolarHBondContact CB-OD2 3.35Å; H122-D150 IonicContact CE1-OD1 2.87Å; H122-D150 IonicContact CG-OD2 3.25Å; H122-D150 IonicContact ND1-OD1 2.99Å; H122-D150 PolarHBondContact ND1-OD1 3.37Å; H122-D150 IonicContact ND1-OD2 3.26Å; H122-D150 PolarHBondContact ND1-OD2 3Å; H122-H151 AromaticContact CE1-CE1 3.71Å; H122-H151 AromaticContact CE1-ND1 3.78Å; H122-H151 AromaticContact ND1-CE1 3.74Å; H122-H151 AromaticContact ND1-ND1 3.82Å
123	H	98.6	Very high	94.5	Very high	3 Å²	3	35.6 Å²	35.6	1%	0.014	21%	0.212	C	C	.	.	S	Bend	trans	-78.9	132.8	-178	-70.2	-90.4	0	0	0	112.6	L96 P97 P125 W132 H147 D150 F161	L96-H123 VanDerWaalsContact CD2-CE1 3.45Å; L96-H123 WeakPolarHBondContact CD2-CE1 3.38Å; L96-H123 WeakPolarHBondContact CD2-ND1 3.45Å; P97-H123 PolarHBondContact O-NE2 3.39Å; H123-P125 VanDerWaalsContact C-CD 3.43Å; H123-W132 PolarHBondContact O-NE1 3.12Å; H123-H147 WeakPolarHBondContact O-CB 3.27Å; H123-D150 HydrophobicContact CB-CB 4.34Å; H123-D150 IonicContact CD2-OD2 3.88Å; H123-D150 PolarHBondContact N-OD2 2.92Å; H123-F161 HydrophobicContact CB-CD1 4.09Å; H123-F161 HydrophobicContact CB-CE1 4.4Å; H123-F161 HydrophobicContact CB-CG 4.15Å; H123-F161 VanDerWaalsContact CE1-CB 3.46Å; H123-F161 WeakPolarHBondContact CE1-CB 3.48Å; H123-F161 AromaticContact CG-CG 3.8Å; H123-F161 WeakPolarHBondContact ND1-CB 3.46Å; H123-F161 AromaticContact ND1-CG 3.97Å
124	Y	97.8	Very high	94.7	Very high	26 Å²	26	35.5 Å²	35.5	10%	0.102	21%	0.211	C	C	.	.	S	Bend	trans	50.5	47.7	176.4	-53.7	-64.9	0	0	0	117.1	I108 G110 N129 F131 W132 F161 N202	I108-Y124 HydrophobicContact CG2-CE2 3.84Å; I108-Y124 WeakPolarHBondContact CG2-OH 3.25Å; G110-Y124 WeakPolarHBondContact CA-OH 3.5Å; G110-Y124 PolarHBondContact N-OH 2.97Å; Y124-N129 WeakPolarHBondContact CD1-ND2 3.15Å; Y124-F131 HydrophobicContact CD1-CB 4.42Å; Y124-F131 HydrophobicContact CD2-CB 3.96Å; Y124-F131 AromaticContact CD2-CD1 3.59Å; Y124-F131 HydrophobicContact CD2-CD1 3.59Å; Y124-F131 AromaticContact CD2-CD2 3.91Å; Y124-F131 HydrophobicContact CD2-CD2 3.91Å; Y124-F131 HydrophobicContact CD2-CE1 4.09Å; Y124-F131 HydrophobicContact CD2-CE2 4.38Å; Y124-F131 AromaticContact CD2-CG 3.51Å; Y124-F131 HydrophobicContact CD2-CG 3.51Å; Y124-F131 HydrophobicContact CD2-CZ 4.47Å; Y124-F131 HydrophobicContact CE2-CD1 4.38Å; Y124-F131 AromaticContact CE2-CD2 3.98Å; Y124-F131 HydrophobicContact CE2-CD2 3.98Å; Y124-F131 HydrophobicContact CE2-CE2 4.26Å; Y124-F131 HydrophobicContact CE2-CG 4.07Å; Y124-F131 HydrophobicContact CG-CB 3.8Å; Y124-F131 HydrophobicContact CG-CD1 4.15Å; Y124-F131 AromaticContact CG-CG 3.9Å; Y124-F131 HydrophobicContact CG-CG 3.9Å; Y124-W132 VanDerWaalsContact O-CD1 3.25Å; Y124-W132 PolarHBondContact O-NE1 3.23Å; Y124-F161 HydrophobicContact CD2-CD1 4.36Å; Y124-F161 HydrophobicContact CD2-CE1 4.06Å; Y124-F161 AromaticContact CE2-CD1 3.87Å; Y124-F161 HydrophobicContact CE2-CD1 3.87Å; Y124-F161 AromaticContact CE2-CE1 3.87Å; Y124-F161 HydrophobicContact CE2-CE1 3.87Å; Y124-N202 WeakPolarHBondContact CE1-ND2 3.04Å; Y124-N202 VanDerWaalsContact CZ-ND2 3.28Å; Y124-N202 PolarHBondContact OH-ND2 3.44Å; Y124-N202 VanDerWaalsContact OH-ND2 3.11Å
125	P	95.7	Very high	94.9	Very high	13 Å²	13	34.3 Å²	34.3	8%	0.084	20%	0.199	C	C	.	.			trans	-75.2	153.3	178.4	31.6	-36.4	0	0	0	113.3	M116 A117 K120 H122 H123 H147	M116-P125 VanDerWaalsContact C-CG 3.49Å; M116-P125 HydrophobicContact CB-CG 4.1Å; M116-P125 HydrophobicContact CG-CB 4Å; M116-P125 HydrophobicContact CG-CG 3.74Å; M116-P125 WeakPolarHBondContact O-CG 3.29Å; A117-P125 VanDerWaalsContact CA-CG 3.47Å; A117-P125 HydrophobicContact CB-CG 4.09Å; K120-P125 HydrophobicContact CB-CB 4.41Å; K120-P125 HydrophobicContact CB-CG 4.32Å; K120-P125 HydrophobicContact CG-CB 4.18Å; K120-P125 HydrophobicContact CG-CG 4.37Å; H122-P125 VanDerWaalsContact O-CD 3.25Å; H122-P125 WeakPolarHBondContact O-CD 3.39Å; H123-P125 VanDerWaalsContact C-CD 3.43Å; P125-H147 HydrophobicContact CB-CB 3.81Å
126	G	82.6	Confident	95.2	Very high	33 Å²	33	37.8 Å²	37.8	34%	0.34	21%	0.213	S	C	.	.	S	Bend	trans	93	167.2	165.2	0	0	0	0	0	115.2	G128 N129	G126-G128 PolarHBondContact O-N 3.21Å; G126-N129 PolarHBondContact O-N 3.39Å
127	P	80.8	Confident	95.4	Very high	116 Å²	116	38.5 Å²	38.5	75%	0.753	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-20.7	-175.6	27.6	-35.3	0	0	0	113	N129	P127-N129 PolarHBondContact O-N 2.99Å; P127-N129 VanDerWaalsContact O-N 3.12Å
128	G	86.6	Confident	95.5	Very high	44 Å²	44	38.3 Å²	38.3	45%	0.454	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	10.7	177.9	0	0	0	0	0	115.3	G126 A246	G126-G128 PolarHBondContact O-N 3.21Å; G128-A246 WeakPolarHBondContact O-CB 3.22Å; G128-A246 PolarHBondContact O-N 3.25Å
129	N	95.5	Very high	95.6	Very high	34 Å²	34	40 Å²	40	18%	0.182	23%	0.233	C	C	.	.	B	Isolated β-bridge	trans	-136.6	131.7	-179.9	-156.5	-62.5	0	0	0	111.9	Y124 G126 P127 F131 S244	Y124-N129 WeakPolarHBondContact CD1-ND2 3.15Å; G126-N129 PolarHBondContact O-N 3.39Å; P127-N129 PolarHBondContact O-N 2.99Å; P127-N129 VanDerWaalsContact O-N 3.12Å; N129-F131 VanDerWaalsContact OD1-CB 3.23Å; N129-F131 WeakPolarHBondContact OD1-CB 3.36Å; N129-F131 PolarHBondContact OD1-N 3.36Å; N129-S244 PolarHBondContact ND2-OG 3.21Å; N129-S244 VanDerWaalsContact OD1-CB 3.28Å; N129-S244 WeakPolarHBondContact OD1-CB 3.34Å; N129-S244 PolarHBondContact OD1-OG 3.17Å
130	H	97.9	Very high	95.7	Very high	22 Å²	22	37.4 Å²	37.4	10%	0.102	22%	0.223	C	C	.	.			trans	-90.3	-3.6	-177.9	-56.2	161.9	0	0	0	113.7	W132 K133 C134 S244 P252 R253 A254 K257	H130-W132 PolarHBondContact O-N 3.38Å; H130-K133 PolarHBondContact O-N 2.63Å; H130-C134 WeakPolarHBondContact O-CB 3.31Å; H130-C134 PolarHBondContact O-N 3.38Å; H130-C134 PolarHBondContact O-SG 2.76Å; H130-S244 WeakPolarHBondContact CB-O 3.4Å; H130-S244 PolarHBondContact N-O 3.21Å; H130-P252 PolarHBondContact CE1-O 2.86Å; H130-R253 VanDerWaalsContact CE1-C 3.44Å; H130-A254 HydrophobicContact CB-CB 3.8Å; H130-A254 PolarHBondContact CE1-N 3.21Å; H130-A254 PolarHBondContact ND1-N 2.93Å; H130-K257 WeakPolarHBondContact ND1-CE 3.19Å; H130-K257 PolarHBondContact ND1-NZ 3.17Å; H130-K257 VanDerWaalsContact ND1-NZ 3.17Å
131	F	98.6	Very high	95.8	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-52.5	-57.6	-170.6	175.1	-96.7	0	0	0	112.6	I108 Y124 N129 K133 C134 L135 F161 Y261	I108-F131 HydrophobicContact CB-CE2 4.43Å; I108-F131 HydrophobicContact CD1-CE2 4.08Å; I108-F131 HydrophobicContact CG1-CE2 3.81Å; I108-F131 HydrophobicContact CG1-CZ 4.06Å; I108-F131 HydrophobicContact CG2-CE2 3.98Å; Y124-F131 HydrophobicContact CD1-CB 4.42Å; Y124-F131 HydrophobicContact CD2-CB 3.96Å; Y124-F131 AromaticContact CD2-CD1 3.59Å; Y124-F131 HydrophobicContact CD2-CD1 3.59Å; Y124-F131 AromaticContact CD2-CD2 3.91Å; Y124-F131 HydrophobicContact CD2-CD2 3.91Å; Y124-F131 HydrophobicContact CD2-CE1 4.09Å; Y124-F131 HydrophobicContact CD2-CE2 4.38Å; Y124-F131 AromaticContact CD2-CG 3.51Å; Y124-F131 HydrophobicContact CD2-CG 3.51Å; Y124-F131 HydrophobicContact CD2-CZ 4.47Å; Y124-F131 HydrophobicContact CE2-CD1 4.38Å; Y124-F131 AromaticContact CE2-CD2 3.98Å; Y124-F131 HydrophobicContact CE2-CD2 3.98Å; Y124-F131 HydrophobicContact CE2-CE2 4.26Å; Y124-F131 HydrophobicContact CE2-CG 4.07Å; Y124-F131 HydrophobicContact CG-CB 3.8Å; Y124-F131 HydrophobicContact CG-CD1 4.15Å; Y124-F131 AromaticContact CG-CG 3.9Å; Y124-F131 HydrophobicContact CG-CG 3.9Å; N129-F131 VanDerWaalsContact OD1-CB 3.23Å; N129-F131 WeakPolarHBondContact OD1-CB 3.36Å; N129-F131 PolarHBondContact OD1-N 3.36Å; F131-K133 VanDerWaalsContact C-N 3.3Å; F131-K133 PolarHBondContact O-N 3.15Å; F131-C134 PolarHBondContact O-N 3.31Å; F131-L135 HydrophobicContact CE1-CD2 4.31Å; F131-L135 HydrophobicContact CZ-CD1 4.32Å; F131-L135 WeakPolarHBondContact O-CB 3.35Å; F131-L135 PolarHBondContact O-N 3.09Å; F131-F161 AromaticContact CE1-CE1 3.66Å; F131-F161 HydrophobicContact CE1-CE1 3.66Å; F131-F161 AromaticContact CE1-CZ 3.73Å; F131-F161 HydrophobicContact CE1-CZ 3.73Å; F131-F161 HydrophobicContact CE2-CE1 4.16Å; F131-F161 AromaticContact CZ-CE1 3.43Å; F131-F161 HydrophobicContact CZ-CE1 3.43Å; F131-F161 VanDerWaalsContact CZ-CE1 3.43Å; F131-F161 AromaticContact CZ-CZ 3.72Å; F131-F161 HydrophobicContact CZ-CZ 3.72Å; F131-Y261 HydrophobicContact CD2-CE1 4.11Å; F131-Y261 WeakPolarHBondContact CD2-OH 3.08Å; F131-Y261 HydrophobicContact CE2-CE1 4.12Å
132	W	98.5	Very high	95.8	Very high	17 Å²	17	36.6 Å²	36.6	6%	0.064	21%	0.213	C	C	.	.	H	α-helix	trans	-64.5	-34.4	-177.3	-66.2	110.1	0	0	0	113.1	H123 Y124 H130 L135 F136 Q144 L145 S146 D150 L153 F161	H123-W132 PolarHBondContact O-NE1 3.12Å; Y124-W132 VanDerWaalsContact O-CD1 3.25Å; Y124-W132 PolarHBondContact O-NE1 3.23Å; H130-W132 PolarHBondContact O-N 3.38Å; W132-L135 HydrophobicContact CE3-CD2 3.87Å; W132-L135 HydrophobicContact CZ3-CD2 3.81Å; W132-F136 PolarHBondContact O-N 3.12Å; W132-Q144 PolarHBondContact O-NE2 3.33Å; W132-L145 HydrophobicContact CE3-CB 3.73Å; W132-L145 HydrophobicContact CZ3-CB 3.9Å; W132-L145 HydrophobicContact CZ3-CD1 4.22Å; W132-S146 VanDerWaalsContact CE2-C 3.48Å; W132-S146 WeakPolarHBondContact CH2-O 3.31Å; W132-S146 WeakPolarHBondContact CZ2-O 3.34Å; W132-D150 HydrophobicContact CH2-CB 4.01Å; W132-D150 HydrophobicContact CZ2-CB 3.92Å; W132-L153 HydrophobicContact CH2-CD1 3.96Å; W132-L153 HydrophobicContact CH2-CD2 3.72Å; W132-L153 HydrophobicContact CZ3-CD1 3.89Å; W132-L153 HydrophobicContact CZ3-CD2 3.76Å; W132-F161 HydrophobicContact CH2-CZ 4.19Å; W132-F161 HydrophobicContact CZ2-CZ 4.45Å
133	K	98	Very high	95.8	Very high	98 Å²	98	38.9 Å²	38.9	43%	0.426	23%	0.228	S	C	.	.	H	α-helix	trans	-69.2	-44.5	175.7	-171.8	166.9	-178	171.4	0	111.2	H130 F131 F136 M137 A254	H130-K133 PolarHBondContact O-N 2.63Å; F131-K133 VanDerWaalsContact C-N 3.3Å; F131-K133 PolarHBondContact O-N 3.15Å; K133-F136 PolarHBondContact O-N 3.05Å; K133-M137 HydrophobicContact CD-SD 4.43Å; K133-M137 HydrophobicContact CG-CG 4.39Å; K133-M137 HydrophobicContact CG-SD 3.69Å; K133-M137 WeakPolarHBondContact O-CB 3.44Å; K133-M137 WeakPolarHBondContact O-CG 3.48Å; K133-M137 PolarHBondContact O-N 2.9Å; K133-A254 HydrophobicContact CB-CB 4.28Å; K133-A254 HydrophobicContact CD-CB 3.8Å; K133-A254 HydrophobicContact CG-CB 3.95Å
134	C	98.6	Very high	95.7	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-66.3	-36.4	175.6	-66.8	0	0	0	0	112.5	H130 F131 F136 S138 A254 Y261	H130-C134 WeakPolarHBondContact O-CB 3.31Å; H130-C134 PolarHBondContact O-N 3.38Å; H130-C134 PolarHBondContact O-SG 2.76Å; F131-C134 PolarHBondContact O-N 3.31Å; C134-F136 VanDerWaalsContact C-N 3.33Å; C134-F136 PolarHBondContact O-N 3.3Å; C134-S138 VanDerWaalsContact O-CB 3.31Å; C134-S138 WeakPolarHBondContact O-CB 3.4Å; C134-S138 PolarHBondContact O-N 3.03Å; C134-S138 PolarHBondContact O-OG 3.49Å; C134-A254 PolarHBondContact SG-O 2.78Å; C134-Y261 HydrophobicContact CB-CD1 4.04Å; C134-Y261 HydrophobicContact CB-CD2 3.73Å; C134-Y261 HydrophobicContact CB-CE1 4Å; C134-Y261 HydrophobicContact CB-CE2 3.7Å; C134-Y261 HydrophobicContact CB-CG 3.92Å
135	L	98.7	Very high	95.8	Very high	2 Å²	2	42.9 Å²	42.9	1%	0.01	25%	0.249	C	C	.	.	H	α-helix	trans	-59	-46	176.8	-167.8	74.4	0	0	0	111	F131 W132 S138 L140 S141 L145 L153 I159	F131-L135 HydrophobicContact CE1-CD2 4.31Å; F131-L135 HydrophobicContact CZ-CD1 4.32Å; F131-L135 WeakPolarHBondContact O-CB 3.35Å; F131-L135 PolarHBondContact O-N 3.09Å; W132-L135 HydrophobicContact CE3-CD2 3.87Å; W132-L135 HydrophobicContact CZ3-CD2 3.81Å; L135-S138 PolarHBondContact O-OG 2.84Å; L135-L140 HydrophobicContact CD1-CB 3.6Å; L135-L140 HydrophobicContact CD1-CD1 4.01Å; L135-L140 HydrophobicContact CD1-CG 4.44Å; L135-L140 HydrophobicContact CG-CB 4.13Å; L135-L140 WeakPolarHBondContact O-CB 3.24Å; L135-L140 PolarHBondContact O-N 2.94Å; L135-L140 VanDerWaalsContact O-N 3.1Å; L135-S141 PolarHBondContact O-N 3.27Å; L135-L145 HydrophobicContact CD2-CD1 4.42Å; L135-L153 HydrophobicContact CD2-CD2 4.14Å; L135-I159 HydrophobicContact CD1-CD1 3.97Å
136	F	98.6	Very high	95.9	Very high	84 Å²	84	44.4 Å²	44.4	37%	0.368	26%	0.26	S	S	.	.	H	α-helix	trans	-70.4	-51	176	173.8	-121.5	0	0	0	112.7	W132 K133 C134 S138 G139 S141 V143 Q144	W132-F136 PolarHBondContact O-N 3.12Å; K133-F136 PolarHBondContact O-N 3.05Å; C134-F136 VanDerWaalsContact C-N 3.33Å; C134-F136 PolarHBondContact O-N 3.3Å; F136-S138 PolarHBondContact O-N 3.49Å; F136-S138 VanDerWaalsContact O-N 3.12Å; F136-G139 PolarHBondContact O-N 3.47Å; F136-S141 WeakPolarHBondContact CA-OG 3.46Å; F136-S141 PolarHBondContact N-OG 2.85Å; F136-V143 WeakPolarHBondContact CD2-O 3.23Å; F136-Q144 HydrophobicContact CB-CB 4.44Å; F136-Q144 HydrophobicContact CD1-CB 3.88Å; F136-Q144 HydrophobicContact CD1-CG 4.48Å; F136-Q144 HydrophobicContact CD2-CB 4.49Å; F136-Q144 HydrophobicContact CE1-CB 4.24Å; F136-Q144 HydrophobicContact CG-CB 4.01Å
137	M	98.1	Very high	96.6	Very high	81 Å²	81	44.6 Å²	44.6	40%	0.399	25%	0.251	S	S	.	.	H	α-helix	trans	-61.1	-26.6	-176.5	-70	173.8	62.7	0	0	113.7	K133 G139 A254 Q255 V258	K133-M137 HydrophobicContact CD-SD 4.43Å; K133-M137 HydrophobicContact CG-CG 4.39Å; K133-M137 HydrophobicContact CG-SD 3.69Å; K133-M137 WeakPolarHBondContact O-CB 3.44Å; K133-M137 WeakPolarHBondContact O-CG 3.48Å; K133-M137 PolarHBondContact O-N 2.9Å; M137-G139 VanDerWaalsContact C-N 3.32Å; M137-A254 HydrophobicContact SD-CB 4.47Å; M137-Q255 HydrophobicContact CE-CB 3.86Å; M137-V258 HydrophobicContact CB-CG2 3.62Å
138	S	98.1	Very high	97.4	Very high	5 Å²	5	44.3 Å²	44.3	4%	0.035	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-11.6	175.3	58.9	0	0	0	0	114	C134 L135 F136 L140 Y261 K265	C134-S138 VanDerWaalsContact O-CB 3.31Å; C134-S138 WeakPolarHBondContact O-CB 3.4Å; C134-S138 PolarHBondContact O-N 3.03Å; C134-S138 PolarHBondContact O-OG 3.49Å; L135-S138 PolarHBondContact O-OG 2.84Å; F136-S138 PolarHBondContact O-N 3.49Å; F136-S138 VanDerWaalsContact O-N 3.12Å; S138-L140 VanDerWaalsContact C-N 3.3Å; S138-L140 PolarHBondContact OG-N 3.08Å; S138-Y261 VanDerWaalsContact CB-CB 3.46Å; S138-Y261 WeakPolarHBondContact OG-CB 3.39Å; S138-K265 PolarHBondContact O-NZ 2.82Å
139	G	97.4	Very high	98	Very high	41 Å²	41	44.5 Å²	44.5	42%	0.423	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.2	22.7	-171	0	0	0	0	0	113.5	F136 M137 S141 K265	F136-G139 PolarHBondContact O-N 3.47Å; M137-G139 VanDerWaalsContact C-N 3.32Å; G139-S141 VanDerWaalsContact C-N 3.28Å; G139-K265 WeakPolarHBondContact O-CD 3.29Å
140	L	98.1	Very high	98.1	Very high	8 Å²	8	42.9 Å²	42.9	4%	0.042	22%	0.223	C	C	.	.	S	Bend	trans	-72.1	-27.1	166.8	-82.5	166.1	0	0	0	111.4	I106 L135 S138 Y157 Y261 L264 K265	I106-L140 HydrophobicContact CD1-CD2 4.35Å; L135-L140 HydrophobicContact CD1-CB 3.6Å; L135-L140 HydrophobicContact CD1-CD1 4.01Å; L135-L140 HydrophobicContact CD1-CG 4.44Å; L135-L140 HydrophobicContact CG-CB 4.13Å; L135-L140 WeakPolarHBondContact O-CB 3.24Å; L135-L140 PolarHBondContact O-N 2.94Å; L135-L140 VanDerWaalsContact O-N 3.1Å; S138-L140 VanDerWaalsContact C-N 3.3Å; S138-L140 PolarHBondContact OG-N 3.08Å; L140-Y157 WeakPolarHBondContact O-CD1 3.49Å; L140-Y261 HydrophobicContact CD1-CD1 3.92Å; L140-L264 HydrophobicContact CD1-CD2 4.34Å; L140-K265 HydrophobicContact CD2-CB 3.76Å; L140-K265 HydrophobicContact CD2-CG 3.9Å; L140-K265 HydrophobicContact CG-CB 4Å; L140-K265 HydrophobicContact CG-CG 4.32Å
141	S	98.3	Very high	98.2	Very high	2 Å²	2	47.5 Å²	47.5	1%	0.014	25%	0.245	C	C	.	.	S	Bend	trans	-117.4	143.6	165.4	65.5	0	0	0	0	111.5	L135 F136 G139 V143	L135-S141 PolarHBondContact O-N 3.27Å; F136-S141 WeakPolarHBondContact CA-OG 3.46Å; F136-S141 PolarHBondContact N-OG 2.85Å; G139-S141 VanDerWaalsContact C-N 3.28Å; S141-V143 VanDerWaalsContact C-N 3.31Å; S141-V143 PolarHBondContact O-N 3.35Å; S141-V143 PolarHBondContact OG-O 3.23Å
142	E	97.1	Very high	98.2	Very high	110 Å²	110	50.6 Å²	50.6	51%	0.514	26%	0.264	S	S	.	.	S	Bend	trans	-72.7	-22.9	179	62.9	-83.1	176	0	0	114	K156 Y157	E142-K156 WeakPolarHBondContact OE1-CE 3.48Å; E142-K156 IonicContact OE1-NZ 3.96Å; E142-K156 PolarHBondContact OE1-NZ 2.89Å; E142-Y157 PolarHBondContact OE1-OH 2.69Å; E142-Y157 WeakPolarHBondContact OE2-CE1 3.42Å; E142-Y157 PolarHBondContact OE2-OH 3.33Å
143	V	97.7	Very high	98.2	Very high	77 Å²	77	49.8 Å²	49.8	47%	0.467	26%	0.261	S	S	.	.	S	Bend	trans	-131.7	162.9	178.5	-65.1	0	0	0	0	110.8	F136 S141 L145	F136-V143 WeakPolarHBondContact CD2-O 3.23Å; S141-V143 VanDerWaalsContact C-N 3.31Å; S141-V143 PolarHBondContact O-N 3.35Å; S141-V143 PolarHBondContact OG-O 3.23Å; V143-L145 HydrophobicContact CG2-CD2 3.81Å; V143-L145 HydrophobicContact CG2-CG 4.46Å; V143-L145 PolarHBondContact O-N 3.41Å; V143-L145 VanDerWaalsContact O-N 3.14Å
144	Q	97.9	Very high	98.2	Very high	95 Å²	95	46.2 Å²	46.2	44%	0.444	25%	0.248	S	C	.	.			trans	-69.5	107.7	172.4	-178.6	59.9	75.5	0	0	109.7	W132 F136	W132-Q144 PolarHBondContact O-NE2 3.33Å; F136-Q144 HydrophobicContact CB-CB 4.44Å; F136-Q144 HydrophobicContact CD1-CB 3.88Å; F136-Q144 HydrophobicContact CD1-CG 4.48Å; F136-Q144 HydrophobicContact CD2-CB 4.49Å; F136-Q144 HydrophobicContact CE1-CB 4.24Å; F136-Q144 HydrophobicContact CG-CB 4.01Å
145	L	98.1	Very high	98.2	Very high	19 Å²	19	50 Å²	50	10%	0.099	29%	0.286	C	S	.	.			trans	-91.7	173.4	175.3	-60.2	177.7	0	0	0	111.7	W132 L135 V143 D149 L153 Y157	W132-L145 HydrophobicContact CE3-CB 3.73Å; W132-L145 HydrophobicContact CZ3-CB 3.9Å; W132-L145 HydrophobicContact CZ3-CD1 4.22Å; L135-L145 HydrophobicContact CD2-CD1 4.42Å; V143-L145 HydrophobicContact CG2-CD2 3.81Å; V143-L145 HydrophobicContact CG2-CG 4.46Å; V143-L145 PolarHBondContact O-N 3.41Å; V143-L145 VanDerWaalsContact O-N 3.14Å; L145-D149 HydrophobicContact CB-CB 4.15Å; L145-D149 HydrophobicContact CD1-CB 4.49Å; L145-D149 HydrophobicContact CD2-CB 4.15Å; L145-D149 HydrophobicContact CG-CB 4.5Å; L145-L153 HydrophobicContact CD1-CD1 3.9Å; L145-Y157 HydrophobicContact CD1-CD2 4.5Å; L145-Y157 HydrophobicContact CD1-CE2 3.61Å
146	S	97.8	Very high	98.2	Very high	45 Å²	45	55.9 Å²	55.9	32%	0.315	31%	0.312	S	S	.	.			trans	-132.7	176.4	176.8	77.9	0	0	0	0	111.3	W132 M148 D149	W132-S146 VanDerWaalsContact CE2-C 3.48Å; W132-S146 WeakPolarHBondContact CH2-O 3.31Å; W132-S146 WeakPolarHBondContact CZ2-O 3.34Å; S146-M148 PolarHBondContact O-N 2.78Å; S146-M148 VanDerWaalsContact O-N 3.16Å; S146-M148 PolarHBondContact OG-N 2.9Å; S146-D149 WeakPolarHBondContact CA-OD2 3.45Å; S146-D149 PolarHBondContact N-OD2 3.01Å; S146-D149 WeakPolarHBondContact O-CB 3.49Å; S146-D149 PolarHBondContact O-N 3.43Å; S146-D149 PolarHBondContact OG-OD2 2.59Å
147	H	98.3	Very high	98.2	Very high	36 Å²	36	52.7 Å²	52.7	17%	0.167	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-58.8	-24.8	174.8	63.7	-81.3	0	0	0	114	H122 H123 P125 D149 D150	H122-H147 HydrophobicContact CB-CB 3.94Å; H122-H147 WeakPolarHBondContact CB-O 3.35Å; H122-H147 PolarHBondContact ND1-O 2.78Å; H123-H147 WeakPolarHBondContact O-CB 3.27Å; P125-H147 HydrophobicContact CB-CB 3.81Å; H147-D149 PolarHBondContact O-N 3.15Å; H147-D150 PolarHBondContact O-N 2.93Å; H147-D150 VanDerWaalsContact O-OD1 3.12Å
148	M	98.3	Very high	98.2	Very high	110 Å²	110	49.4 Å²	49.4	54%	0.542	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-69.3	-15.8	177.3	-60.7	-57.4	-59.1	0	0	112.6	S146	S146-M148 PolarHBondContact O-N 2.78Å; S146-M148 VanDerWaalsContact O-N 3.16Å; S146-M148 PolarHBondContact OG-N 2.9Å
149	D	98.4	Very high	98.3	Very high	49 Å²	49	49.2 Å²	49.2	26%	0.262	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-94.9	-3.8	-175.2	-54.7	-70.3	0	0	0	112.9	L145 S146 H147 H151 T152 L153	L145-D149 HydrophobicContact CB-CB 4.15Å; L145-D149 HydrophobicContact CD1-CB 4.49Å; L145-D149 HydrophobicContact CD2-CB 4.15Å; L145-D149 HydrophobicContact CG-CB 4.5Å; S146-D149 WeakPolarHBondContact CA-OD2 3.45Å; S146-D149 PolarHBondContact N-OD2 3.01Å; S146-D149 WeakPolarHBondContact O-CB 3.49Å; S146-D149 PolarHBondContact O-N 3.43Å; S146-D149 PolarHBondContact OG-OD2 2.59Å; H147-D149 PolarHBondContact O-N 3.15Å; D149-H151 VanDerWaalsContact C-N 3.3Å; D149-H151 PolarHBondContact O-N 3.06Å; D149-T152 WeakPolarHBondContact O-CB 3.22Å; D149-T152 PolarHBondContact O-N 3.29Å; D149-T152 PolarHBondContact O-OG1 2.88Å; D149-L153 VanDerWaalsContact O-CD1 3.27Å; D149-L153 WeakPolarHBondContact O-CD1 3.48Å
150	D	98.7	Very high	98.3	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-54.8	-36.8	-173.6	59.2	-5.8	0	0	0	114.9	I99 H122 H123 W132 H147 T152 L153 F161	I99-D150 HydrophobicContact CD1-CB 3.9Å; H122-D150 VanDerWaalsContact CA-OD2 3.27Å; H122-D150 WeakPolarHBondContact CA-OD2 3.5Å; H122-D150 WeakPolarHBondContact CB-OD2 3.35Å; H122-D150 IonicContact CE1-OD1 2.87Å; H122-D150 IonicContact CG-OD2 3.25Å; H122-D150 IonicContact ND1-OD1 2.99Å; H122-D150 PolarHBondContact ND1-OD1 3.37Å; H122-D150 IonicContact ND1-OD2 3.26Å; H122-D150 PolarHBondContact ND1-OD2 3Å; H123-D150 HydrophobicContact CB-CB 4.34Å; H123-D150 IonicContact CD2-OD2 3.88Å; H123-D150 PolarHBondContact N-OD2 2.92Å; W132-D150 HydrophobicContact CH2-CB 4.01Å; W132-D150 HydrophobicContact CZ2-CB 3.92Å; H147-D150 PolarHBondContact O-N 2.93Å; H147-D150 VanDerWaalsContact O-OD1 3.12Å; D150-T152 PolarHBondContact O-N 2.99Å; D150-L153 WeakPolarHBondContact O-CB 2.97Å; D150-L153 PolarHBondContact O-N 3.26Å; D150-F161 HydrophobicContact CB-CD2 4.49Å; D150-F161 HydrophobicContact CB-CE2 4.1Å
151	H	98.6	Very high	98.4	Very high	118 Å²	118	46.9 Å²	46.9	55%	0.546	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-68.1	-20.7	177.4	-65	79.1	0	0	0	113.2	H122 D149	H122-H151 AromaticContact CE1-CE1 3.71Å; H122-H151 AromaticContact CE1-ND1 3.78Å; H122-H151 AromaticContact ND1-CE1 3.74Å; H122-H151 AromaticContact ND1-ND1 3.82Å; D149-H151 VanDerWaalsContact C-N 3.3Å; D149-H151 PolarHBondContact O-N 3.06Å
152	T	98.6	Very high	98.4	Very high	66 Å²	66	46.8 Å²	46.8	41%	0.405	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-82.1	-18.6	178.9	74.7	0	0	0	0	112.6	D149 D150 G155 K156	D149-T152 WeakPolarHBondContact O-CB 3.22Å; D149-T152 PolarHBondContact O-N 3.29Å; D149-T152 PolarHBondContact O-OG1 2.88Å; D150-T152 PolarHBondContact O-N 2.99Å; T152-G155 PolarHBondContact O-N 3.31Å; T152-K156 WeakPolarHBondContact O-CB 3.4Å; T152-K156 PolarHBondContact O-N 3.12Å
153	L	98.8	Very high	98.5	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-64.1	-39.2	-171	-95.8	64.1	0	0	0	115.3	W132 L135 L145 D149 D150 G155 Y157 G158 I159 F161	W132-L153 HydrophobicContact CH2-CD1 3.96Å; W132-L153 HydrophobicContact CH2-CD2 3.72Å; W132-L153 HydrophobicContact CZ3-CD1 3.89Å; W132-L153 HydrophobicContact CZ3-CD2 3.76Å; L135-L153 HydrophobicContact CD2-CD2 4.14Å; L145-L153 HydrophobicContact CD1-CD1 3.9Å; D149-L153 VanDerWaalsContact O-CD1 3.27Å; D149-L153 WeakPolarHBondContact O-CD1 3.48Å; D150-L153 WeakPolarHBondContact O-CB 2.97Å; D150-L153 PolarHBondContact O-N 3.26Å; L153-G155 VanDerWaalsContact C-N 3.34Å; L153-G155 PolarHBondContact O-N 2.89Å; L153-Y157 HydrophobicContact CD1-CD2 4.02Å; L153-Y157 HydrophobicContact CD1-CE2 4.27Å; L153-Y157 HydrophobicContact CG-CD2 3.88Å; L153-Y157 CarbonylContact O-C 3.51Å; L153-Y157 WeakPolarHBondContact O-CA 3.03Å; L153-Y157 WeakPolarHBondContact O-CB 3.26Å; L153-Y157 PolarHBondContact O-N 2.9Å; L153-G158 PolarHBondContact O-N 3.38Å; L153-I159 CarbonylContact C-O 3.29Å; L153-I159 HydrophobicContact CB-CB 4.16Å; L153-I159 WeakPolarHBondContact CB-O 3.26Å; L153-I159 HydrophobicContact CD2-CB 4.23Å; L153-I159 HydrophobicContact CD2-CG2 4.1Å; L153-I159 HydrophobicContact CG-CB 4.4Å; L153-I159 PolarHBondContact O-N 2.96Å; L153-I159 VanDerWaalsContact O-N 3.16Å; L153-F161 HydrophobicContact CB-CE2 4.08Å; L153-F161 HydrophobicContact CD2-CE2 3.48Å; L153-F161 VanDerWaalsContact CD2-CE2 3.48Å; L153-F161 HydrophobicContact CD2-CZ 3.33Å; L153-F161 HydrophobicContact CG-CE2 4.39Å
154	P	98.8	Very high	98.4	Very high	23 Å²	23	38.8 Å²	38.8	15%	0.149	22%	0.218	C	C	.	.	H	α-helix	trans	-57.6	-47	175.2	-30.1	37	0	0	0	112.5	I99 T101 L104 G158 I159	I99-P154 HydrophobicContact CG2-CG 3.39Å; T101-P154 HydrophobicContact CG2-CB 4.3Å; L104-P154 HydrophobicContact CD2-CB 3.96Å; P154-G158 WeakPolarHBondContact O-CA 3.44Å; P154-G158 PolarHBondContact O-N 3.21Å; P154-I159 WeakPolarHBondContact CA-O 3.23Å; P154-I159 VanDerWaalsContact CD-O 3.26Å; P154-I159 WeakPolarHBondContact CD-O 3.37Å; P154-I159 WeakPolarHBondContact CG-O 3.46Å
155	G	98.4	Very high	98.3	Very high	79 Å²	79	34.7 Å²	34.7	81%	0.814	20%	0.2	S	C	*	.	H	α-helix	trans	-75.6	-42.7	-176.1	0	0	0	0	0	113.4	T152 L153	T152-G155 PolarHBondContact O-N 3.31Å; L153-G155 VanDerWaalsContact C-N 3.34Å; L153-G155 PolarHBondContact O-N 2.89Å
156	K	98.3	Very high	98.2	Very high	126 Å²	126	40 Å²	40	55%	0.548	22%	0.224	S	C	.	.	H	α-helix	trans	-86.6	-35.7	-173.1	-164.9	175.5	-166.7	-165.9	0	113.5	E142 T152	E142-K156 WeakPolarHBondContact OE1-CE 3.48Å; E142-K156 IonicContact OE1-NZ 3.96Å; E142-K156 PolarHBondContact OE1-NZ 2.89Å; T152-K156 WeakPolarHBondContact O-CB 3.4Å; T152-K156 PolarHBondContact O-N 3.12Å
157	Y	98.6	Very high	98.1	Very high	16 Å²	16	42.4 Å²	42.4	6%	0.063	23%	0.226	C	C	.	.	H	α-helix	trans	-121.2	-9.9	-170.5	-60	-77.1	0	0	0	114.1	L140 E142 L145 L153 I159	L140-Y157 WeakPolarHBondContact O-CD1 3.49Å; E142-Y157 PolarHBondContact OE1-OH 2.69Å; E142-Y157 WeakPolarHBondContact OE2-CE1 3.42Å; E142-Y157 PolarHBondContact OE2-OH 3.33Å; L145-Y157 HydrophobicContact CD1-CD2 4.5Å; L145-Y157 HydrophobicContact CD1-CE2 3.61Å; L153-Y157 HydrophobicContact CD1-CD2 4.02Å; L153-Y157 HydrophobicContact CD1-CE2 4.27Å; L153-Y157 HydrophobicContact CG-CD2 3.88Å; L153-Y157 CarbonylContact O-C 3.51Å; L153-Y157 WeakPolarHBondContact O-CA 3.03Å; L153-Y157 WeakPolarHBondContact O-CB 3.26Å; L153-Y157 PolarHBondContact O-N 2.9Å; Y157-I159 VanDerWaalsContact C-N 3.29Å
158	G	98.7	Very high	98	Very high	12 Å²	12	40.7 Å²	40.7	12%	0.124	22%	0.218	C	C	.	.	S	Bend	trans	68.1	29.1	-172.9	0	0	0	0	0	112.8	D105 I106 L153 P154	D105-G158 PolarHBondContact N-O 3.02Å; I106-G158 PolarHBondContact N-O 2.92Å; L153-G158 PolarHBondContact O-N 3.38Å; P154-G158 WeakPolarHBondContact O-CA 3.44Å; P154-G158 PolarHBondContact O-N 3.21Å
159	I	98.9	Very high	97.7	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.005	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	126.6	-176.9	-57.4	176.6	0	0	0	109.9	I106 I108 L135 L153 P154 Y157 F161	I106-I159 HydrophobicContact CB-CG1 4.23Å; I106-I159 HydrophobicContact CG2-CG2 4.3Å; I106-I159 CarbonylContact O-C 3.55Å; I106-I159 WeakPolarHBondContact O-CA 3.44Å; I108-I159 HydrophobicContact CG1-CG2 3.93Å; L135-I159 HydrophobicContact CD1-CD1 3.97Å; L153-I159 CarbonylContact C-O 3.29Å; L153-I159 HydrophobicContact CB-CB 4.16Å; L153-I159 WeakPolarHBondContact CB-O 3.26Å; L153-I159 HydrophobicContact CD2-CB 4.23Å; L153-I159 HydrophobicContact CD2-CG2 4.1Å; L153-I159 HydrophobicContact CG-CB 4.4Å; L153-I159 PolarHBondContact O-N 2.96Å; L153-I159 VanDerWaalsContact O-N 3.16Å; P154-I159 WeakPolarHBondContact CA-O 3.23Å; P154-I159 VanDerWaalsContact CD-O 3.26Å; P154-I159 WeakPolarHBondContact CD-O 3.37Å; P154-I159 WeakPolarHBondContact CG-O 3.46Å; Y157-I159 VanDerWaalsContact C-N 3.29Å; I159-F161 HydrophobicContact CG2-CZ 4.35Å
160	G	98.9	Very high	97.2	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	175.1	172.4	0	0	0	0	0	113.2	I99 I106 V107 I108	I99-G160 CarbonylContact O-C 3.17Å; I99-G160 WeakPolarHBondContact O-CA 3.24Å; I106-G160 PolarHBondContact O-N 3.31Å; V107-G160 WeakPolarHBondContact CA-O 3.42Å; I108-G160 PolarHBondContact N-O 2.67Å
161	F	98.9	Very high	96.4	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	138	-175.1	-61.6	-81.7	0	0	0	112.6	I99 I108 H123 Y124 F131 W132 D150 L153 I159	I99-F161 HydrophobicContact CB-CB 4.32Å; I99-F161 HydrophobicContact CB-CD2 4.24Å; I99-F161 HydrophobicContact CD1-CD2 4.2Å; I99-F161 PolarHBondContact N-O 3.42Å; I99-F161 PolarHBondContact O-N 3.4Å; I108-F161 HydrophobicContact CB-CD1 3.83Å; I108-F161 HydrophobicContact CB-CE1 4.03Å; I108-F161 HydrophobicContact CG1-CD1 4.29Å; I108-F161 HydrophobicContact CG1-CE1 4.03Å; I108-F161 HydrophobicContact CG2-CD1 4.39Å; I108-F161 HydrophobicContact CG2-CE1 4.5Å; I108-F161 WeakPolarHBondContact O-CA 3.28Å; H123-F161 HydrophobicContact CB-CD1 4.09Å; H123-F161 HydrophobicContact CB-CE1 4.4Å; H123-F161 HydrophobicContact CB-CG 4.15Å; H123-F161 VanDerWaalsContact CE1-CB 3.46Å; H123-F161 WeakPolarHBondContact CE1-CB 3.48Å; H123-F161 AromaticContact CG-CG 3.8Å; H123-F161 WeakPolarHBondContact ND1-CB 3.46Å; H123-F161 AromaticContact ND1-CG 3.97Å; Y124-F161 HydrophobicContact CD2-CD1 4.36Å; Y124-F161 HydrophobicContact CD2-CE1 4.06Å; Y124-F161 AromaticContact CE2-CD1 3.87Å; Y124-F161 HydrophobicContact CE2-CD1 3.87Å; Y124-F161 AromaticContact CE2-CE1 3.87Å; Y124-F161 HydrophobicContact CE2-CE1 3.87Å; F131-F161 AromaticContact CE1-CE1 3.66Å; F131-F161 HydrophobicContact CE1-CE1 3.66Å; F131-F161 AromaticContact CE1-CZ 3.73Å; F131-F161 HydrophobicContact CE1-CZ 3.73Å; F131-F161 HydrophobicContact CE2-CE1 4.16Å; F131-F161 AromaticContact CZ-CE1 3.43Å; F131-F161 HydrophobicContact CZ-CE1 3.43Å; F131-F161 VanDerWaalsContact CZ-CE1 3.43Å; F131-F161 AromaticContact CZ-CZ 3.72Å; F131-F161 HydrophobicContact CZ-CZ 3.72Å; W132-F161 HydrophobicContact CH2-CZ 4.19Å; W132-F161 HydrophobicContact CZ2-CZ 4.45Å; D150-F161 HydrophobicContact CB-CD2 4.49Å; D150-F161 HydrophobicContact CB-CE2 4.1Å; L153-F161 HydrophobicContact CB-CE2 4.08Å; L153-F161 HydrophobicContact CD2-CE2 3.48Å; L153-F161 VanDerWaalsContact CD2-CE2 3.48Å; L153-F161 HydrophobicContact CD2-CZ 3.33Å; L153-F161 HydrophobicContact CG-CE2 4.39Å; I159-F161 HydrophobicContact CG2-CZ 4.35Å
162	T	98.8	Very high	95.6	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153	178.6	166	-168.6	0	0	0	0	110.4	D98 V107 I108 I109 G110 L187	D98-T162 VanDerWaalsContact OD1-CA 3.26Å; D98-T162 WeakPolarHBondContact OD1-CA 3.47Å; D98-T162 VanDerWaalsContact OD1-CB 3.28Å; D98-T162 WeakPolarHBondContact OD1-CB 3.4Å; D98-T162 PolarHBondContact OD1-OG1 2.82Å; D98-T162 PolarHBondContact OD2-OG1 3.35Å; V107-T162 HydrophobicContact CG1-CG2 3.82Å; I108-T162 PolarHBondContact O-N 2.97Å; I109-T162 WeakPolarHBondContact CA-O 3.48Å; I109-T162 HydrophobicContact CG1-CG2 4Å; G110-T162 PolarHBondContact N-O 3.31Å; T162-L187 HydrophobicContact CG2-CD1 3.72Å
163	N	98.4	Very high	95	Very high	15 Å²	15	39.1 Å²	39.1	8%	0.08	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	154.3	174.5	-69.6	-77	0	0	0	111.3	G110 V165	G110-N163 VanDerWaalsContact C-OD1 3.23Å; G110-N163 WeakPolarHBondContact CA-OD1 3.36Å; G110-N163 WeakPolarHBondContact O-CA 3.17Å; N163-V165 WeakPolarHBondContact CB-O 3.43Å
164	M	96.2	Very high	94.5	Very high	4 Å²	4	43.2 Å²	43.2	2%	0.02	24%	0.236	C	C	.	.	S	Bend	trans	-61.4	-46	170.8	-176.2	66.7	76.1	0	0	111.2	G110 I111 F180 G183 G184 L187 F201 I206 F210	G110-M164 PolarHBondContact O-N 3.43Å; I111-M164 PolarHBondContact O-N 2.66Å; M164-F180 HydrophobicContact CG-CD1 4.05Å; M164-G183 CarbonylContact O-C 3.56Å; M164-G183 WeakPolarHBondContact O-CA 3.38Å; M164-G184 WeakPolarHBondContact SD-CA 3.46Å; M164-G184 PolarHBondContact SD-N 3.35Å; M164-G184 VanDerWaalsContact SD-N 3.41Å; M164-L187 HydrophobicContact CE-CD2 3.59Å; M164-L187 HydrophobicContact SD-CB 4.33Å; M164-L187 HydrophobicContact SD-CD2 3.65Å; M164-F201 HydrophobicContact CE-CE1 4.22Å; M164-I206 HydrophobicContact CB-CG2 4.3Å; M164-I206 HydrophobicContact CE-CB 4.26Å; M164-F210 HydrophobicContact CE-CB 3.71Å; M164-F210 HydrophobicContact CE-CD2 3.78Å; M164-F210 HydrophobicContact CE-CG 4.19Å
165	V	96.1	Very high	94	Very high	9 Å²	9	42.9 Å²	42.9	6%	0.055	23%	0.233	C	C	.	.			trans	-120.8	133.2	-179.9	179.7	0	0	0	0	109.5	I111 N112 N163 R167 L175 E179 F180	I111-V165 PolarHBondContact O-N 2.91Å; N112-V165 VanDerWaalsContact CA-O 3.27Å; N112-V165 WeakPolarHBondContact CA-O 3.33Å; N112-V165 HydrophobicContact CB-CB 4.08Å; N112-V165 VanDerWaalsContact CB-O 3.23Å; N112-V165 WeakPolarHBondContact CB-O 3.49Å; N163-V165 WeakPolarHBondContact CB-O 3.43Å; V165-R167 HydrophobicContact CG1-CB 4.3Å; V165-L175 HydrophobicContact CB-CD1 4.12Å; V165-L175 HydrophobicContact CG1-CD1 4.41Å; V165-L175 HydrophobicContact CG1-CD2 3.92Å; V165-L175 HydrophobicContact CG2-CD1 4.15Å; V165-E179 HydrophobicContact CG1-CB 4.29Å; V165-E179 HydrophobicContact CG2-CB 4.39Å; V165-F180 HydrophobicContact CG2-CD1 3.9Å; V165-F180 HydrophobicContact CG2-CE1 4.26Å; V165-F180 HydrophobicContact CG2-CG 4.43Å
166	E	96.1	Very high	93.7	Very high	132 Å²	132	41.7 Å²	41.7	62%	0.617	21%	0.212	S	C	*	.			trans	-76.3	-33.5	-176.9	-176.5	178.7	-125.9	0	0	113	T95 P113 T168	T95-E166 HydrophobicContact CG2-CG 3.69Å; P113-E166 WeakPolarHBondContact CD-O 3.49Å; E166-T168 PolarHBondContact O-N 2.85Å
167	R	96.5	Very high	93.3	Very high	95 Å²	95	39.5 Å²	39.5	36%	0.358	21%	0.212	S	C	.	.	S	Bend	trans	-65.2	129.6	-174.6	-173.2	174.6	64.9	91.8	-2.9	112.1	N112 V165 T169 D174 E179	N112-R167 WeakPolarHBondContact CB-O 3.23Å; N112-R167 PolarHBondContact ND2-O 2.92Å; V165-R167 HydrophobicContact CG1-CB 4.3Å; R167-T169 VanDerWaalsContact NH1-CG2 3.29Å; R167-D174 PolarHBondContact NH2-O 2.92Å; R167-E179 IonicContact CZ-OE1 2.72Å; R167-E179 VanDerWaalsContact CZ-OE1 3.25Å; R167-E179 IonicContact NE-OE1 2.99Å; R167-E179 PolarHBondContact NE-OE1 2.82Å; R167-E179 IonicContact NH2-OE1 3.22Å; R167-E179 PolarHBondContact NH2-OE1 3.13Å; R167-E179 IonicContact NH2-OE2 3.38Å; R167-E179 PolarHBondContact NH2-OE2 3.27Å
168	T	96.1	Very high	93	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.241	C	C	.	.			trans	-69.8	134.1	174.4	-63.3	0	0	0	0	111.7	L92 K94 P113 L115 A118 E166	L92-T168 WeakPolarHBondContact CD2-O 3.37Å; K94-T168 WeakPolarHBondContact O-CB 3.49Å; K94-T168 PolarHBondContact O-OG1 3.24Å; P113-T168 WeakPolarHBondContact O-CA 3.27Å; L115-T168 HydrophobicContact CD2-CG2 4.14Å; A118-T168 HydrophobicContact CB-CG2 3.42Å; A118-T168 VanDerWaalsContact CB-CG2 3.42Å; A118-T168 WeakPolarHBondContact CB-OG1 3.4Å; E166-T168 PolarHBondContact O-N 2.85Å
169	T	91.9	Very high	92.7	Very high	1 Å²	1	47.8 Å²	47.8	1%	0.006	25%	0.246	C	C	.	.			trans	-142.3	162	170.8	68.8	0	0	0	0	112.1	N112 P113 G114 R167 G171 D174 L175	N112-T169 PolarHBondContact ND2-N 3.16Å; N112-T169 PolarHBondContact ND2-OG1 2.93Å; P113-T169 PolarHBondContact O-N 3.02Å; P113-T169 VanDerWaalsContact O-N 3.12Å; G114-T169 WeakPolarHBondContact CA-O 3.24Å; R167-T169 VanDerWaalsContact NH1-CG2 3.29Å; T169-G171 VanDerWaalsContact C-N 3.29Å; T169-G171 PolarHBondContact O-N 2.85Å; T169-G171 PolarHBondContact OG1-O 2.91Å; T169-D174 HydrophobicContact CG2-CB 4.09Å; T169-L175 HydrophobicContact CG2-CD2 3.7Å; T169-L175 HydrophobicContact CG2-CG 4.45Å
170	P	87.1	Confident	92.3	Very high	47 Å²	47	48.6 Å²	48.6	31%	0.305	25%	0.25	S	C	.	.	S	Bend	trans	-62.3	-36.5	171.9	-22.2	35	0	0	0	112.7	E88 L115 R247	E88-P170 WeakPolarHBondContact OE1-CG 3.41Å; L115-P170 HydrophobicContact CD1-CB 4.22Å; L115-P170 HydrophobicContact CD1-CG 4.13Å; L115-P170 HydrophobicContact CD2-CG 4.42Å; L115-P170 HydrophobicContact CG-CB 4.45Å; L115-P170 HydrophobicContact CG-CG 4.34Å; P170-R247 PolarHBondContact O-NH1 2.98Å; P170-R247 PolarHBondContact O-NH2 2.96Å
171	G	81.3	Confident	91.9	Very high	15 Å²	15	54.2 Å²	54.2	16%	0.155	27%	0.271	C	S	.	.	S	Bend	trans	-153.8	166.9	175	0	0	0	0	0	114.1	T169 K173 D174	T169-G171 VanDerWaalsContact C-N 3.29Å; T169-G171 PolarHBondContact O-N 2.85Å; T169-G171 PolarHBondContact OG1-O 2.91Å; G171-K173 PolarHBondContact O-N 2.79Å; G171-K173 VanDerWaalsContact O-N 3.17Å; G171-D174 PolarHBondContact N-OD2 2.9Å; G171-D174 PolarHBondContact O-N 3.26Å
172	S	82.5	Confident	91.6	Very high	45 Å²	45	58.5 Å²	58.5	32%	0.315	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-66.5	-16.3	-177.7	53.9	0	0	0	0	114.4	D174 L175	S172-D174 PolarHBondContact O-N 2.83Å; S172-L175 PolarHBondContact O-N 3.35Å
173	K	85.9	Confident	91.4	Very high	201 Å²	201	58.8 Å²	58.8	87%	0.874	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	-69.2	-18.9	176.5	-65.4	-175.7	179	-177.7	0	113	G171 L175	G171-K173 PolarHBondContact O-N 2.79Å; G171-K173 VanDerWaalsContact O-N 3.17Å; K173-L175 VanDerWaalsContact C-N 3.25Å; K173-L175 PolarHBondContact O-N 2.9Å
174	D	87.4	Confident	91.2	Very high	87 Å²	87	58.1 Å²	58.1	47%	0.465	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-88	7	-178.4	-51.3	-49.3	0	0	0	112.8	R167 T169 G171 S172	R167-D174 PolarHBondContact NH2-O 2.92Å; T169-D174 HydrophobicContact CG2-CB 4.09Å; G171-D174 PolarHBondContact N-OD2 2.9Å; G171-D174 PolarHBondContact O-N 3.26Å; S172-D174 PolarHBondContact O-N 2.83Å
175	L	89.3	Confident	91.1	Very high	16 Å²	16	63.4 Å²	63.4	8%	0.084	31%	0.31	C	S	.	.			trans	-101.2	133.6	179	-62.5	179.2	0	0	0	110.5	I111 N112 V165 T169 S172 K173 F180	I111-L175 HydrophobicContact CG2-CD1 3.86Å; N112-L175 HydrophobicContact CB-CD1 3.98Å; V165-L175 HydrophobicContact CB-CD1 4.12Å; V165-L175 HydrophobicContact CG1-CD1 4.41Å; V165-L175 HydrophobicContact CG1-CD2 3.92Å; V165-L175 HydrophobicContact CG2-CD1 4.15Å; T169-L175 HydrophobicContact CG2-CD2 3.7Å; T169-L175 HydrophobicContact CG2-CG 4.45Å; S172-L175 PolarHBondContact O-N 3.35Å; K173-L175 VanDerWaalsContact C-N 3.25Å; K173-L175 PolarHBondContact O-N 2.9Å; L175-F180 HydrophobicContact CB-CD2 4.25Å; L175-F180 HydrophobicContact CB-CE2 3.5Å; L175-F180 HydrophobicContact CB-CZ 3.7Å; L175-F180 HydrophobicContact CD1-CE1 3.85Å; L175-F180 HydrophobicContact CD1-CE2 4.23Å; L175-F180 HydrophobicContact CD1-CZ 3.55Å; L175-F180 HydrophobicContact CG-CZ 4.28Å
176	S	92.2	Very high	91.1	Very high	54 Å²	54	65.9 Å²	65.9	38%	0.378	32%	0.323	S	S	.	.			trans	-79.7	154.9	176.5	68.4	0	0	0	0	111.9	K178 E179 F180	S176-K178 PolarHBondContact O-N 3.48Å; S176-E179 WeakPolarHBondContact CB-OE2 3.33Å; S176-E179 PolarHBondContact N-OE2 2.81Å; S176-E179 PolarHBondContact O-N 2.78Å; S176-E179 VanDerWaalsContact O-N 3.12Å; S176-E179 WeakPolarHBondContact OG-CG 3.41Å; S176-E179 PolarHBondContact OG-N 2.91Å; S176-E179 PolarHBondContact OG-OE2 3.35Å; S176-F180 VanDerWaalsContact O-CD2 3.27Å; S176-F180 WeakPolarHBondContact O-CD2 3.37Å; S176-F180 PolarHBondContact O-N 3.43Å
177	S	88.9	Confident	91.2	Very high	79 Å²	79	59.6 Å²	59.6	55%	0.552	29%	0.293	S	S	*	.	H	α-helix	trans	-56.7	-34.3	172.2	172.5	0	0	0	0	112.2	F180 R181	S177-F180 PolarHBondContact O-N 3.25Å; S177-R181 VanDerWaalsContact O-CG 3.31Å; S177-R181 WeakPolarHBondContact O-CG 3.19Å; S177-R181 PolarHBondContact O-N 3Å; S177-R181 VanDerWaalsContact O-N 3.08Å
178	K	92.1	Very high	91.3	Very high	153 Å²	153	55.9 Å²	55.9	67%	0.665	28%	0.281	S	S	*	.	H	α-helix	trans	-63.1	-42.3	177.6	-173.3	-177	176.4	-173	0	111.7	S176 F180 R181 E182	S176-K178 PolarHBondContact O-N 3.48Å; K178-F180 VanDerWaalsContact C-N 3.35Å; K178-R181 PolarHBondContact O-N 2.91Å; K178-E182 PolarHBondContact O-N 3.34Å
179	E	93.8	Very high	91.4	Very high	50 Å²	50	60.8 Å²	60.8	23%	0.234	30%	0.304	C	S	.	.	H	α-helix	trans	-63.4	-41.2	177.2	-73.9	167	103.3	0	0	111.7	V165 R167 S176 R181 E182 G183	V165-E179 HydrophobicContact CG1-CB 4.29Å; V165-E179 HydrophobicContact CG2-CB 4.39Å; R167-E179 IonicContact CZ-OE1 2.72Å; R167-E179 VanDerWaalsContact CZ-OE1 3.25Å; R167-E179 IonicContact NE-OE1 2.99Å; R167-E179 PolarHBondContact NE-OE1 2.82Å; R167-E179 IonicContact NH2-OE1 3.22Å; R167-E179 PolarHBondContact NH2-OE1 3.13Å; R167-E179 IonicContact NH2-OE2 3.38Å; R167-E179 PolarHBondContact NH2-OE2 3.27Å; S176-E179 WeakPolarHBondContact CB-OE2 3.33Å; S176-E179 PolarHBondContact N-OE2 2.81Å; S176-E179 PolarHBondContact O-N 2.78Å; S176-E179 VanDerWaalsContact O-N 3.12Å; S176-E179 WeakPolarHBondContact OG-CG 3.41Å; S176-E179 PolarHBondContact OG-N 2.91Å; S176-E179 PolarHBondContact OG-OE2 3.35Å; E179-R181 VanDerWaalsContact C-N 3.35Å; E179-R181 PolarHBondContact O-N 2.98Å; E179-E182 PolarHBondContact O-N 2.99Å; E179-G183 PolarHBondContact O-N 2.89Å
180	F	90.7	Very high	91.7	Very high	18 Å²	18	63.1 Å²	63.1	8%	0.079	31%	0.314	C	S	.	.	H	α-helix	trans	-64.5	-38.1	175.7	-74.1	-70.1	0	0	0	113.3	I111 M164 V165 L175 S176 S177 K178 G183 G184 I206 I209	I111-F180 HydrophobicContact CG2-CE1 3.84Å; I111-F180 HydrophobicContact CG2-CZ 4.16Å; M164-F180 HydrophobicContact CG-CD1 4.05Å; V165-F180 HydrophobicContact CG2-CD1 3.9Å; V165-F180 HydrophobicContact CG2-CE1 4.26Å; V165-F180 HydrophobicContact CG2-CG 4.43Å; L175-F180 HydrophobicContact CB-CD2 4.25Å; L175-F180 HydrophobicContact CB-CE2 3.5Å; L175-F180 HydrophobicContact CB-CZ 3.7Å; L175-F180 HydrophobicContact CD1-CE1 3.85Å; L175-F180 HydrophobicContact CD1-CE2 4.23Å; L175-F180 HydrophobicContact CD1-CZ 3.55Å; L175-F180 HydrophobicContact CG-CZ 4.28Å; S176-F180 VanDerWaalsContact O-CD2 3.27Å; S176-F180 WeakPolarHBondContact O-CD2 3.37Å; S176-F180 PolarHBondContact O-N 3.43Å; S177-F180 PolarHBondContact O-N 3.25Å; K178-F180 VanDerWaalsContact C-N 3.35Å; F180-G183 PolarHBondContact O-N 2.9Å; F180-G184 PolarHBondContact O-N 3.33Å; F180-I206 HydrophobicContact CE1-CG2 4.21Å; F180-I209 HydrophobicContact CB-CD1 4.12Å; F180-I209 HydrophobicContact CB-CG2 3.7Å; F180-I209 HydrophobicContact CD1-CD1 3.73Å; F180-I209 HydrophobicContact CD2-CD1 3.8Å; F180-I209 HydrophobicContact CE1-CD1 3.99Å; F180-I209 HydrophobicContact CE2-CD1 4.06Å; F180-I209 HydrophobicContact CG-CD1 3.63Å; F180-I209 HydrophobicContact CG-CG2 4.4Å; F180-I209 HydrophobicContact CZ-CD1 4.14Å
181	R	88.9	Confident	92.3	Very high	118 Å²	118	61 Å²	61	45%	0.445	30%	0.3	S	S	.	.	H	α-helix	trans	-65.3	-47	177.9	-68.5	-166.4	-79.9	121.5	-2.4	111.8	S177 K178 E179 G184 R185 E213	S177-R181 VanDerWaalsContact O-CG 3.31Å; S177-R181 WeakPolarHBondContact O-CG 3.19Å; S177-R181 PolarHBondContact O-N 3Å; S177-R181 VanDerWaalsContact O-N 3.08Å; K178-R181 PolarHBondContact O-N 2.91Å; E179-R181 VanDerWaalsContact C-N 3.35Å; E179-R181 PolarHBondContact O-N 2.98Å; R181-G184 PolarHBondContact O-N 2.92Å; R181-R185 PolarHBondContact O-N 2.81Å; R181-E213 VanDerWaalsContact CD-OE1 3.22Å; R181-E213 WeakPolarHBondContact CD-OE1 3.37Å; R181-E213 WeakPolarHBondContact CD-OE2 3.44Å; R181-E213 HydrophobicContact CG-CG 3.85Å; R181-E213 WeakPolarHBondContact CG-OE1 3.37Å; R181-E213 VanDerWaalsContact CG-OE2 3.29Å; R181-E213 WeakPolarHBondContact CG-OE2 3.47Å
182	E	93.8	Very high	93.1	Very high	89 Å²	89	63.1 Å²	63.1	42%	0.416	31%	0.306	S	S	.	.	H	α-helix	trans	-64.4	-43.6	176.4	-176.7	54.9	-153.6	0	0	111.4	K178 E179 G184 R185 I186	K178-E182 PolarHBondContact O-N 3.34Å; E179-E182 PolarHBondContact O-N 2.99Å; E182-G184 VanDerWaalsContact C-N 3.33Å; E182-G184 PolarHBondContact O-N 3.34Å; E182-R185 WeakPolarHBondContact O-CB 3.42Å; E182-R185 PolarHBondContact O-N 3.32Å; E182-R185 IonicContact OE1-CZ 2.61Å; E182-R185 IonicContact OE1-NE 2.7Å; E182-R185 PolarHBondContact OE1-NE 3.22Å; E182-R185 IonicContact OE1-NH2 3.71Å; E182-R185 PolarHBondContact OE1-NH2 3.26Å; E182-R185 IonicContact OE2-NE 3.39Å; E182-I186 HydrophobicContact CG-CD1 4.05Å; E182-I186 WeakPolarHBondContact O-CG1 3.33Å; E182-I186 PolarHBondContact O-N 2.72Å
183	G	94.3	Very high	93.9	Very high	7 Å²	7	66.6 Å²	66.6	7%	0.072	32%	0.316	C	S	.	.	H	α-helix	trans	-56.5	-44.2	174.3	0	0	0	0	0	113.1	M164 E179 F180 R185 I186 L187	M164-G183 CarbonylContact O-C 3.56Å; M164-G183 WeakPolarHBondContact O-CA 3.38Å; E179-G183 PolarHBondContact O-N 2.89Å; F180-G183 PolarHBondContact O-N 2.9Å; G183-R185 PolarHBondContact O-N 2.72Å; G183-I186 PolarHBondContact O-N 3.34Å; G183-L187 VanDerWaalsContact O-CB 3.22Å; G183-L187 WeakPolarHBondContact O-CB 3.27Å; G183-L187 PolarHBondContact O-N 3.27Å
184	G	93.7	Very high	94.5	Very high	1 Å²	1	59.3 Å²	59.3	1%	0.01	28%	0.283	C	S	.	.	H	α-helix	trans	-59.6	-44.3	176	0	0	0	0	0	112.8	M164 F180 R181 E182 L187 V188	M164-G184 WeakPolarHBondContact SD-CA 3.46Å; M164-G184 PolarHBondContact SD-N 3.35Å; M164-G184 VanDerWaalsContact SD-N 3.41Å; F180-G184 PolarHBondContact O-N 3.33Å; R181-G184 PolarHBondContact O-N 2.92Å; E182-G184 VanDerWaalsContact C-N 3.33Å; E182-G184 PolarHBondContact O-N 3.34Å; G184-L187 PolarHBondContact O-N 3.3Å; G184-V188 WeakPolarHBondContact O-CG2 3.31Å; G184-V188 PolarHBondContact O-N 2.92Å
185	R	94.2	Very high	95.1	Very high	114 Å²	114	60.6 Å²	60.6	43%	0.43	29%	0.286	S	S	.	.	H	α-helix	trans	-61.5	-46.7	176.8	-169.4	-163.9	65.1	67.5	2.4	111.6	R181 E182 G183 V188 Q189	R181-R185 PolarHBondContact O-N 2.81Å; E182-R185 WeakPolarHBondContact O-CB 3.42Å; E182-R185 PolarHBondContact O-N 3.32Å; E182-R185 IonicContact OE1-CZ 2.61Å; E182-R185 IonicContact OE1-NE 2.7Å; E182-R185 PolarHBondContact OE1-NE 3.22Å; E182-R185 IonicContact OE1-NH2 3.71Å; E182-R185 PolarHBondContact OE1-NH2 3.26Å; E182-R185 IonicContact OE2-NE 3.39Å; G183-R185 PolarHBondContact O-N 2.72Å; R185-V188 PolarHBondContact O-N 2.72Å; R185-Q189 WeakPolarHBondContact O-CG 3.25Å; R185-Q189 PolarHBondContact O-N 2.59Å
186	I	97.2	Very high	95.5	Very high	61 Å²	61	59.9 Å²	59.9	31%	0.313	28%	0.282	S	S	.	.	H	α-helix	trans	-64.6	-41.9	178.2	-65.9	167.2	0	0	0	110.6	E182 G183 Q189 K190	E182-I186 HydrophobicContact CG-CD1 4.05Å; E182-I186 WeakPolarHBondContact O-CG1 3.33Å; E182-I186 PolarHBondContact O-N 2.72Å; G183-I186 PolarHBondContact O-N 3.34Å; I186-Q189 WeakPolarHBondContact O-CB 3.02Å; I186-Q189 PolarHBondContact O-N 2.63Å; I186-K190 HydrophobicContact CG2-CD 4.38Å; I186-K190 WeakPolarHBondContact O-CG 3.22Å; I186-K190 PolarHBondContact O-N 2.88Å
187	L	98.2	Very high	95.8	Very high	1 Å²	1	63 Å²	63	1%	0.005	29%	0.286	C	S	.	.	H	α-helix	trans	-61.5	-45.2	179	178.1	63.8	0	0	0	111.5	I109 T162 M164 G183 G184 Q189 K190 L191 F201 F210	I109-L187 HydrophobicContact CD1-CD1 4.22Å; I109-L187 HydrophobicContact CD1-CD2 4.29Å; I109-L187 HydrophobicContact CG1-CD1 4.34Å; I109-L187 HydrophobicContact CG2-CD1 4.13Å; I109-L187 HydrophobicContact CG2-CD2 3.75Å; T162-L187 HydrophobicContact CG2-CD1 3.72Å; M164-L187 HydrophobicContact CE-CD2 3.59Å; M164-L187 HydrophobicContact SD-CB 4.33Å; M164-L187 HydrophobicContact SD-CD2 3.65Å; G183-L187 VanDerWaalsContact O-CB 3.22Å; G183-L187 WeakPolarHBondContact O-CB 3.27Å; G183-L187 PolarHBondContact O-N 3.27Å; G184-L187 PolarHBondContact O-N 3.3Å; L187-Q189 VanDerWaalsContact C-N 3.3Å; L187-Q189 PolarHBondContact O-N 2.86Å; L187-K190 PolarHBondContact O-N 3.48Å; L187-L191 HydrophobicContact CD1-CD1 4.09Å; L187-L191 HydrophobicContact CD1-CG 4.16Å; L187-L191 HydrophobicContact CG-CD1 3.94Å; L187-L191 HydrophobicContact CG-CG 4.4Å; L187-L191 WeakPolarHBondContact O-CG 3.32Å; L187-L191 PolarHBondContact O-N 2.71Å; L187-F201 HydrophobicContact CD2-CE1 4.28Å; L187-F210 HydrophobicContact CD2-CD2 3.93Å; L187-F210 HydrophobicContact CD2-CE2 3.95Å; L187-F210 HydrophobicContact CG-CE2 4.32Å
188	V	98.1	Very high	96.3	Very high	16 Å²	16	59.3 Å²	59.3	10%	0.097	26%	0.26	C	S	.	.	H	α-helix	trans	-57.3	-45.3	175.2	171.8	0	0	0	0	110.8	G184 R185 K190 L191 Q192 F210 V214	G184-V188 WeakPolarHBondContact O-CG2 3.31Å; G184-V188 PolarHBondContact O-N 2.92Å; R185-V188 PolarHBondContact O-N 2.72Å; V188-K190 VanDerWaalsContact C-N 3.32Å; V188-K190 PolarHBondContact O-N 3.19Å; V188-L191 PolarHBondContact O-N 2.67Å; V188-L191 VanDerWaalsContact O-N 3.16Å; V188-Q192 HydrophobicContact CG1-CG 4.09Å; V188-Q192 WeakPolarHBondContact O-CB 3.01Å; V188-Q192 VanDerWaalsContact O-CG 3.31Å; V188-Q192 WeakPolarHBondContact O-CG 3.41Å; V188-Q192 PolarHBondContact O-N 3.42Å; V188-F210 HydrophobicContact CG2-CE2 3.58Å; V188-F210 HydrophobicContact CG2-CZ 3.71Å; V188-V214 HydrophobicContact CG2-CB 4.21Å; V188-V214 HydrophobicContact CG2-CG1 3.64Å; V188-V214 HydrophobicContact CG2-CG2 3.45Å; V188-V214 VanDerWaalsContact CG2-CG2 3.45Å
189	Q	98.3	Very high	96.6	Very high	103 Å²	103	52 Å²	52	48%	0.481	23%	0.228	S	C	.	.	H	α-helix	trans	-60.7	-40.4	178.2	-69.2	-179.7	-24.9	0	0	112.3	R185 I186 L187 K193	R185-Q189 WeakPolarHBondContact O-CG 3.25Å; R185-Q189 PolarHBondContact O-N 2.59Å; I186-Q189 WeakPolarHBondContact O-CB 3.02Å; I186-Q189 PolarHBondContact O-N 2.63Å; L187-Q189 VanDerWaalsContact C-N 3.3Å; L187-Q189 PolarHBondContact O-N 2.86Å; Q189-K193 WeakPolarHBondContact O-CB 3.27Å; Q189-K193 PolarHBondContact O-N 3.24Å
190	K	98.8	Very high	96.9	Very high	51 Å²	51	49.6 Å²	49.6	22%	0.222	22%	0.217	C	C	.	.	H	α-helix	trans	-63.4	-46.1	174.3	-69.7	175.9	-177.1	175.8	0	111.2	D98 L100 I186 L187 V188 K193 Y194	D98-K190 IonicContact OD1-NZ 3.26Å; D98-K190 VanDerWaalsContact OD2-CE 3.27Å; D98-K190 WeakPolarHBondContact OD2-CE 3.47Å; D98-K190 IonicContact OD2-NZ 3.03Å; D98-K190 PolarHBondContact OD2-NZ 2.87Å; L100-K190 HydrophobicContact CD1-CB 4.4Å; L100-K190 HydrophobicContact CD1-CD 4.24Å; I186-K190 HydrophobicContact CG2-CD 4.38Å; I186-K190 WeakPolarHBondContact O-CG 3.22Å; I186-K190 PolarHBondContact O-N 2.88Å; L187-K190 PolarHBondContact O-N 3.48Å; V188-K190 VanDerWaalsContact C-N 3.32Å; V188-K190 PolarHBondContact O-N 3.19Å; K190-K193 WeakPolarHBondContact O-CB 3.39Å; K190-K193 PolarHBondContact O-N 3.1Å; K190-Y194 VanDerWaalsContact O-CD2 3.24Å; K190-Y194 WeakPolarHBondContact O-CD2 3.46Å; K190-Y194 PolarHBondContact O-N 3.16Å
191	L	98.8	Very high	97.3	Very high	3 Å²	3	48.8 Å²	48.8	2%	0.016	21%	0.213	C	C	.	.	H	α-helix	trans	-67.9	-36.4	-179	-65.1	174	0	0	0	112.1	V107 I109 L187 V188 K193 Q195 P196 A199 I231	V107-L191 HydrophobicContact CG1-CD2 4.48Å; I109-L191 HydrophobicContact CD1-CD1 4.03Å; I109-L191 HydrophobicContact CD1-CD2 4.39Å; L187-L191 HydrophobicContact CD1-CD1 4.09Å; L187-L191 HydrophobicContact CD1-CG 4.16Å; L187-L191 HydrophobicContact CG-CD1 3.94Å; L187-L191 HydrophobicContact CG-CG 4.4Å; L187-L191 WeakPolarHBondContact O-CG 3.32Å; L187-L191 PolarHBondContact O-N 2.71Å; V188-L191 PolarHBondContact O-N 2.67Å; V188-L191 VanDerWaalsContact O-N 3.16Å; L191-K193 VanDerWaalsContact C-N 3.3Å; L191-K193 PolarHBondContact O-N 3.47Å; L191-Q195 VanDerWaalsContact O-CA 3.24Å; L191-Q195 WeakPolarHBondContact O-CA 2.93Å; L191-Q195 PolarHBondContact O-N 2.9Å; L191-P196 HydrophobicContact CD2-CG 3.94Å; L191-A199 HydrophobicContact CD1-CB 4.08Å; L191-A199 HydrophobicContact CD2-CB 4.27Å; L191-I231 HydrophobicContact CB-CG1 4.39Å; L191-I231 HydrophobicContact CB-CG2 3.92Å; L191-I231 HydrophobicContact CD1-CD1 3.57Å; L191-I231 HydrophobicContact CD1-CG1 3.96Å
192	Q	98.7	Very high	97.7	Very high	59 Å²	59	43.3 Å²	43.3	28%	0.276	19%	0.193	S	C	.	.	H	α-helix	trans	-64.7	-33.1	171.7	-74.3	178.5	-32.1	0	0	112.9	V188 Q195 I231 P232 D233 T234	V188-Q192 HydrophobicContact CG1-CG 4.09Å; V188-Q192 WeakPolarHBondContact O-CB 3.01Å; V188-Q192 VanDerWaalsContact O-CG 3.31Å; V188-Q192 WeakPolarHBondContact O-CG 3.41Å; V188-Q192 PolarHBondContact O-N 3.42Å; Q192-Q195 WeakPolarHBondContact O-CG 3.33Å; Q192-Q195 PolarHBondContact O-NE2 2.69Å; Q192-I231 HydrophobicContact CG-CG2 4.47Å; Q192-P232 WeakPolarHBondContact CG-O 3.48Å; Q192-P232 PolarHBondContact NE2-O 2.93Å; Q192-D233 PolarHBondContact NE2-OD2 3Å; Q192-D233 VanDerWaalsContact NE2-OD2 3.13Å; Q192-T234 HydrophobicContact CB-CG2 4.36Å; Q192-T234 HydrophobicContact CG-CG2 4Å
193	K	98.8	Very high	97.7	Very high	118 Å²	118	39.1 Å²	39.1	51%	0.513	17%	0.173	S	C	.	.	H	α-helix	trans	-73.6	-55.7	175.4	-179.3	-177.3	177.7	-172.2	0	111.9	F102 Q189 K190 L191	F102-K193 HydrophobicContact CE1-CG 4.28Å; F102-K193 WeakPolarHBondContact CE1-O 3.42Å; F102-K193 HydrophobicContact CZ-CG 4.39Å; Q189-K193 WeakPolarHBondContact O-CB 3.27Å; Q189-K193 PolarHBondContact O-N 3.24Å; K190-K193 WeakPolarHBondContact O-CB 3.39Å; K190-K193 PolarHBondContact O-N 3.1Å; L191-K193 VanDerWaalsContact C-N 3.3Å; L191-K193 PolarHBondContact O-N 3.47Å
194	Y	98.9	Very high	97.6	Very high	47 Å²	47	42.2 Å²	42.2	18%	0.184	19%	0.185	C	C	.	.	H	α-helix	trans	-86.3	-21.4	-169.9	-68.5	-73.4	0	0	0	114	L100 F102 K190	L100-Y194 HydrophobicContact CB-CD1 4.24Å; L100-Y194 HydrophobicContact CB-CD2 3.92Å; L100-Y194 HydrophobicContact CB-CE1 4.11Å; L100-Y194 HydrophobicContact CB-CE2 3.82Å; L100-Y194 HydrophobicContact CB-CG 4.14Å; L100-Y194 HydrophobicContact CD1-CD2 3.85Å; L100-Y194 HydrophobicContact CD1-CE2 3.85Å; L100-Y194 HydrophobicContact CG-CD2 4.41Å; L100-Y194 HydrophobicContact CG-CE2 4.49Å; F102-Y194 HydrophobicContact CD1-CD1 4.26Å; F102-Y194 HydrophobicContact CE1-CD1 4.32Å; F102-Y194 HydrophobicContact CE2-CE1 4.41Å; F102-Y194 HydrophobicContact CG-CD1 4.36Å; F102-Y194 HydrophobicContact CZ-CD1 4.47Å; F102-Y194 HydrophobicContact CZ-CE1 4.49Å; K190-Y194 VanDerWaalsContact O-CD2 3.24Å; K190-Y194 WeakPolarHBondContact O-CD2 3.46Å; K190-Y194 PolarHBondContact O-N 3.16Å
195	Q	98.8	Very high	97.4	Very high	114 Å²	114	44.6 Å²	44.6	53%	0.533	20%	0.201	S	C	.	.			trans	43.4	58.8	174.8	-56.4	-175	30.2	0	0	113.6	L191 Q192 T234	L191-Q195 VanDerWaalsContact O-CA 3.24Å; L191-Q195 WeakPolarHBondContact O-CA 2.93Å; L191-Q195 PolarHBondContact O-N 2.9Å; Q192-Q195 WeakPolarHBondContact O-CG 3.33Å; Q192-Q195 PolarHBondContact O-NE2 2.69Å; Q195-T234 HydrophobicContact CG-CG2 4.04Å
196	P	98.9	Very high	97.3	Very high	1 Å²	1	39.1 Å²	39.1	1%	0.006	18%	0.18	C	C	.	.			trans	-63.9	157.2	173.7	32.2	-36.2	0	0	0	110	L104 V107 L191 I198 T236	L104-P196 HydrophobicContact CB-CB 4.14Å; L104-P196 CarbonylContact O-C 3.58Å; L104-P196 VanDerWaalsContact O-CA 3.24Å; L104-P196 WeakPolarHBondContact O-CA 3.29Å; V107-P196 HydrophobicContact CB-CB 4.2Å; V107-P196 HydrophobicContact CB-CG 4.01Å; V107-P196 HydrophobicContact CG2-CB 3.58Å; V107-P196 HydrophobicContact CG2-CG 3.68Å; L191-P196 HydrophobicContact CD2-CG 3.94Å; P196-I198 VanDerWaalsContact C-N 3.27Å; P196-I198 PolarHBondContact O-N 3.11Å; P196-T236 HydrophobicContact CG-CG2 3.93Å; P196-T236 VanDerWaalsContact O-CB 3.26Å; P196-T236 WeakPolarHBondContact O-CB 3.45Å; P196-T236 VanDerWaalsContact O-CG2 3.22Å; P196-T236 WeakPolarHBondContact O-CG2 3.44Å; P196-T236 PolarHBondContact O-OG1 2.95Å
197	R	98.9	Very high	97.2	Very high	121 Å²	121	36.3 Å²	36.3	46%	0.457	17%	0.166	S	C	.	.	S	Bend	trans	-62.5	-39.1	175.5	-56.5	177.6	-178.6	-84.5	-5.9	111.4	L104 D105 L237 L271	L104-R197 PolarHBondContact O-N 3.31Å; D105-R197 WeakPolarHBondContact O-CB 3.45Å; D105-R197 PolarHBondContact O-N 2.8Å; D105-R197 VanDerWaalsContact OD1-CD 3.28Å; D105-R197 WeakPolarHBondContact OD1-CD 3.27Å; D105-R197 IonicContact OD1-NE 3.54Å; D105-R197 PolarHBondContact OD1-NE 2.78Å; R197-L237 PolarHBondContact O-N 3.37Å; R197-L271 HydrophobicContact CB-CD1 4.26Å
198	I	98.9	Very high	97	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	121.6	-176.4	-45.3	169.5	0	0	0	110.6	D105 I106 V107 P196 V200 L264 L267 R268 L271	D105-I198 PolarHBondContact O-N 3.47Å; I106-I198 WeakPolarHBondContact CA-O 3.47Å; I106-I198 HydrophobicContact CG1-CB 4.39Å; I106-I198 HydrophobicContact CG1-CD1 4.24Å; V107-I198 PolarHBondContact N-O 2.96Å; P196-I198 VanDerWaalsContact C-N 3.27Å; P196-I198 PolarHBondContact O-N 3.11Å; I198-V200 HydrophobicContact CB-CG2 4.34Å; I198-V200 HydrophobicContact CG2-CG2 3.69Å; I198-L264 HydrophobicContact CD1-CD1 3.93Å; I198-L264 HydrophobicContact CG2-CD1 4.07Å; I198-L267 HydrophobicContact CD1-CB 4.29Å; I198-L267 HydrophobicContact CD1-CD2 3.88Å; I198-L267 HydrophobicContact CD1-CG 3.81Å; I198-L267 HydrophobicContact CG1-CD2 4.37Å; I198-L267 HydrophobicContact CG2-CD2 4.4Å; I198-R268 HydrophobicContact CD1-CB 4.27Å; I198-L271 HydrophobicContact CD1-CD1 3.98Å; I198-L271 HydrophobicContact CG1-CD1 3.84Å
199	A	98.9	Very high	96.6	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	111.1	165.5	0	0	0	0	0	109.5	I109 L191 F201 I231 T236 L237 Y239	I109-A199 HydrophobicContact CD1-CB 3.82Å; L191-A199 HydrophobicContact CD1-CB 4.08Å; L191-A199 HydrophobicContact CD2-CB 4.27Å; A199-F201 HydrophobicContact CB-CE2 4.23Å; A199-I231 HydrophobicContact CB-CD1 4.34Å; A199-I231 HydrophobicContact CB-CG1 4.28Å; A199-T236 HydrophobicContact CB-CG2 3.67Å; A199-L237 PolarHBondContact N-O 3.34Å; A199-Y239 PolarHBondContact O-N 2.8Å
200	V	98.9	Very high	96.5	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	108.4	-173	177.6	0	0	0	0	110.5	I106 V107 I108 I109 I198 N202 Y239 M241 L264	I106-V200 HydrophobicContact CG2-CB 4.3Å; I106-V200 HydrophobicContact CG2-CG2 3.65Å; V107-V200 PolarHBondContact O-N 2.91Å; I108-V200 HydrophobicContact CD1-CB 3.95Å; I108-V200 HydrophobicContact CD1-CG1 3.86Å; I108-V200 HydrophobicContact CD1-CG2 4.45Å; I109-V200 WeakPolarHBondContact CB-O 3.48Å; I109-V200 PolarHBondContact N-O 2.88Å; I198-V200 HydrophobicContact CB-CG2 4.34Å; I198-V200 HydrophobicContact CG2-CG2 3.69Å; V200-N202 PolarHBondContact O-N 3.45Å; V200-Y239 CarbonylContact C-O 3.47Å; V200-Y239 WeakPolarHBondContact CA-O 3.32Å; V200-Y239 HydrophobicContact CG1-CD1 4.3Å; V200-M241 HydrophobicContact CG1-CE 3.5Å; V200-M241 HydrophobicContact CG1-CG 4.3Å; V200-M241 HydrophobicContact CG1-SD 4.31Å; V200-L264 HydrophobicContact CG1-CD2 4.07Å; V200-L264 HydrophobicContact CG2-CD1 3.6Å; V200-L264 HydrophobicContact CG2-CD2 3.82Å; V200-L264 HydrophobicContact CG2-CG 4.37Å
201	F	98.6	Very high	96.3	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	107.5	178	-65.5	-97.2	0	0	0	110.2	I109 M164 L187 A199 G203 I206 Y207 F210 C238 Y239 V240 M241	I109-F201 HydrophobicContact CD1-CD1 4.5Å; I109-F201 HydrophobicContact CD1-CE1 4.21Å; I109-F201 HydrophobicContact CD1-CE2 4.24Å; I109-F201 HydrophobicContact CD1-CZ 4.07Å; I109-F201 HydrophobicContact CG2-CD1 4.46Å; M164-F201 HydrophobicContact CE-CE1 4.22Å; L187-F201 HydrophobicContact CD2-CE1 4.28Å; A199-F201 HydrophobicContact CB-CE2 4.23Å; F201-G203 PolarHBondContact O-N 3.28Å; F201-I206 HydrophobicContact CB-CD1 4.2Å; F201-I206 HydrophobicContact CB-CG1 4.34Å; F201-I206 HydrophobicContact CD1-CD1 4.17Å; F201-I206 HydrophobicContact CD1-CG1 4.25Å; F201-Y207 HydrophobicContact CD1-CD2 4.07Å; F201-Y207 AromaticContact CD2-CD2 3.58Å; F201-Y207 HydrophobicContact CD2-CD2 3.58Å; F201-Y207 HydrophobicContact CD2-CE2 4.28Å; F201-Y207 HydrophobicContact CD2-CG 4.47Å; F201-Y207 HydrophobicContact CE1-CD2 4.14Å; F201-Y207 AromaticContact CE2-CD2 3.67Å; F201-Y207 HydrophobicContact CE2-CD2 3.67Å; F201-Y207 HydrophobicContact CE2-CE2 4.07Å; F201-Y207 AromaticContact CG-CD2 3.8Å; F201-Y207 HydrophobicContact CG-CD2 3.8Å; F201-Y207 HydrophobicContact CG-CG 4.34Å; F201-Y207 AromaticContact CZ-CD2 3.95Å; F201-Y207 HydrophobicContact CZ-CD2 3.95Å; F201-Y207 HydrophobicContact CZ-CE2 4.46Å; F201-F210 HydrophobicContact CE1-CB 3.8Å; F201-F210 AromaticContact CE1-CD1 3.93Å; F201-F210 HydrophobicContact CE1-CD1 3.93Å; F201-F210 AromaticContact CE1-CD2 3.93Å; F201-F210 HydrophobicContact CE1-CD2 3.93Å; F201-F210 HydrophobicContact CE1-CE2 4.47Å; F201-F210 AromaticContact CE1-CG 3.6Å; F201-F210 HydrophobicContact CE1-CG 3.6Å; F201-F210 HydrophobicContact CZ-CB 4.33Å; F201-F210 AromaticContact CZ-CD1 3.56Å; F201-F210 HydrophobicContact CZ-CD1 3.56Å; F201-F210 HydrophobicContact CZ-CD2 4.07Å; F201-F210 AromaticContact CZ-CE1 3.8Å; F201-F210 HydrophobicContact CZ-CE1 3.8Å; F201-F210 HydrophobicContact CZ-CE2 4.24Å; F201-F210 AromaticContact CZ-CG 3.71Å; F201-F210 HydrophobicContact CZ-CG 3.71Å; F201-F210 HydrophobicContact CZ-CZ 4.13Å; F201-C238 HydrophobicContact CE2-CB 4.11Å; F201-Y239 PolarHBondContact N-O 2.96Å; F201-V240 HydrophobicContact CB-CG2 4.37Å; F201-M241 PolarHBondContact O-N 3.28Å
202	N	98	Very high	96	Very high	3 Å²	3	39.6 Å²	39.6	2%	0.016	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	66.8	177.1	-174.3	2	0	0	0	111.1	I108 I109 Y124 V200 P242 S243 S244	I108-N202 HydrophobicContact CG2-CB 4.15Å; I109-N202 WeakPolarHBondContact O-CB 3.18Å; I109-N202 PolarHBondContact O-N 3.17Å; Y124-N202 WeakPolarHBondContact CE1-ND2 3.04Å; Y124-N202 VanDerWaalsContact CZ-ND2 3.28Å; Y124-N202 PolarHBondContact OH-ND2 3.44Å; Y124-N202 VanDerWaalsContact OH-ND2 3.11Å; V200-N202 PolarHBondContact O-N 3.45Å; N202-P242 PolarHBondContact OD1-O 3.47Å; N202-S243 WeakPolarHBondContact OD1-CA 3.47Å; N202-S244 PolarHBondContact ND2-OG 3.37Å; N202-S244 PolarHBondContact OD1-N 3.33Å
203	G	93.5	Very high	95.5	Very high	1 Å²	1	40.4 Å²	40.4	1%	0.01	18%	0.183	C	C	.	.	S	Bend	trans	140.4	132.4	178.6	0	0	0	0	0	112.3	F201 C205 I206 M241	F201-G203 PolarHBondContact O-N 3.28Å; G203-C205 VanDerWaalsContact C-N 3.31Å; G203-C205 PolarHBondContact O-N 2.92Å; G203-I206 WeakPolarHBondContact O-CG1 3.37Å; G203-I206 PolarHBondContact O-N 3.41Å; G203-M241 CarbonylContact C-O 3.55Å; G203-M241 VanDerWaalsContact CA-O 3.25Å; G203-M241 WeakPolarHBondContact CA-O 3.46Å; G203-M241 PolarHBondContact N-O 3.47Å
204	K	92.8	Very high	95.2	Very high	72 Å²	72	36.6 Å²	36.6	31%	0.313	17%	0.17	S	C	.	.	H	α-helix	trans	-56	-44.1	177.5	-165.3	175.6	-177.8	173.7	0	113.1	I206 Y207 E208 L222 F224	K204-I206 VanDerWaalsContact C-N 3.32Å; K204-I206 PolarHBondContact O-N 2.93Å; K204-Y207 PolarHBondContact O-N 3.16Å; K204-Y207 VanDerWaalsContact O-N 3.12Å; K204-E208 WeakPolarHBondContact CE-OE1 3.42Å; K204-E208 HydrophobicContact CG-CG 4.47Å; K204-E208 WeakPolarHBondContact O-CG 3.49Å; K204-E208 PolarHBondContact O-N 3.14Å; K204-L222 HydrophobicContact CD-CD2 4.23Å; K204-L222 HydrophobicContact CD-CG 4.46Å; K204-L222 VanDerWaalsContact CE-CB 3.45Å; K204-L222 WeakPolarHBondContact CE-O 3.41Å; K204-L222 HydrophobicContact CG-CD2 3.39Å; K204-L222 HydrophobicContact CG-CG 4.05Å; K204-L222 PolarHBondContact NZ-O 2.98Å; K204-F224 HydrophobicContact CB-CE1 3.97Å; K204-F224 HydrophobicContact CB-CZ 4.35Å; K204-F224 HydrophobicContact CD-CE1 4.49Å; K204-F224 HydrophobicContact CD-CZ 4.33Å; K204-F224 HydrophobicContact CG-CE1 4.48Å
205	C	89.4	Confident	94.9	Very high	51 Å²	51	36.4 Å²	36.4	35%	0.345	17%	0.17	S	C	.	.	H	α-helix	trans	-57.7	-37.8	-175.5	62	0	0	0	0	114.2	G203 I209	G203-C205 VanDerWaalsContact C-N 3.31Å; G203-C205 PolarHBondContact O-N 2.92Å; C205-I209 WeakPolarHBondContact O-CG1 3.16Å; C205-I209 PolarHBondContact O-N 3.2Å
206	I	91.9	Very high	94.6	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-75.3	-32.5	179.8	48.2	168.4	0	0	0	112.1	I109 I111 M164 F180 F201 G203 K204 F210	I109-I206 HydrophobicContact CG2-CD1 4.39Å; I109-I206 WeakPolarHBondContact O-CD1 3.3Å; I111-I206 HydrophobicContact CB-CG2 3.91Å; I111-I206 HydrophobicContact CD1-CG2 4.46Å; I111-I206 HydrophobicContact CG1-CD1 4.42Å; I111-I206 HydrophobicContact CG1-CG2 3.6Å; I111-I206 HydrophobicContact CG2-CG2 3.79Å; M164-I206 HydrophobicContact CB-CG2 4.3Å; M164-I206 HydrophobicContact CE-CB 4.26Å; F180-I206 HydrophobicContact CE1-CG2 4.21Å; F201-I206 HydrophobicContact CB-CD1 4.2Å; F201-I206 HydrophobicContact CB-CG1 4.34Å; F201-I206 HydrophobicContact CD1-CD1 4.17Å; F201-I206 HydrophobicContact CD1-CG1 4.25Å; G203-I206 WeakPolarHBondContact O-CG1 3.37Å; G203-I206 PolarHBondContact O-N 3.41Å; K204-I206 VanDerWaalsContact C-N 3.32Å; K204-I206 PolarHBondContact O-N 2.93Å; I206-F210 VanDerWaalsContact O-CB 3.23Å; I206-F210 WeakPolarHBondContact O-CB 3.42Å; I206-F210 PolarHBondContact O-N 2.81Å
207	Y	96.1	Very high	94.2	Very high	1 Å²	1	36.8 Å²	36.8	0%	0.004	19%	0.193	C	C	.	.	H	α-helix	trans	-71.4	-36.9	174.9	-174.9	-101.2	0	0	0	111.9	F201 K204 I209 F210 S211 F215 L222 Q227 C238 V240	F201-Y207 HydrophobicContact CD1-CD2 4.07Å; F201-Y207 AromaticContact CD2-CD2 3.58Å; F201-Y207 HydrophobicContact CD2-CD2 3.58Å; F201-Y207 HydrophobicContact CD2-CE2 4.28Å; F201-Y207 HydrophobicContact CD2-CG 4.47Å; F201-Y207 HydrophobicContact CE1-CD2 4.14Å; F201-Y207 AromaticContact CE2-CD2 3.67Å; F201-Y207 HydrophobicContact CE2-CD2 3.67Å; F201-Y207 HydrophobicContact CE2-CE2 4.07Å; F201-Y207 AromaticContact CG-CD2 3.8Å; F201-Y207 HydrophobicContact CG-CD2 3.8Å; F201-Y207 HydrophobicContact CG-CG 4.34Å; F201-Y207 AromaticContact CZ-CD2 3.95Å; F201-Y207 HydrophobicContact CZ-CD2 3.95Å; F201-Y207 HydrophobicContact CZ-CE2 4.46Å; K204-Y207 PolarHBondContact O-N 3.16Å; K204-Y207 VanDerWaalsContact O-N 3.12Å; Y207-I209 VanDerWaalsContact C-N 3.29Å; Y207-I209 PolarHBondContact O-N 3.43Å; Y207-F210 HydrophobicContact CD2-CD1 4.44Å; Y207-F210 HydrophobicContact CE2-CD1 4.41Å; Y207-F210 PolarHBondContact O-N 3.19Å; Y207-S211 VanDerWaalsContact O-CB 3.24Å; Y207-S211 WeakPolarHBondContact O-CB 3.49Å; Y207-S211 PolarHBondContact O-N 3.22Å; Y207-F215 HydrophobicContact CE2-CE2 4.48Å; Y207-L222 HydrophobicContact CD1-CD1 3.49Å; Y207-L222 VanDerWaalsContact CD1-CD1 3.49Å; Y207-L222 HydrophobicContact CD1-CD2 3.69Å; Y207-L222 HydrophobicContact CD1-CG 4.25Å; Y207-L222 HydrophobicContact CE1-CD1 3.55Å; Y207-Q227 HydrophobicContact CE1-CB 4.44Å; Y207-Q227 HydrophobicContact CE1-CG 3.8Å; Y207-Q227 VanDerWaalsContact CE1-OE1 3.27Å; Y207-Q227 HydrophobicContact CE2-CB 4.47Å; Y207-Q227 HydrophobicContact CE2-CG 4.02Å; Y207-Q227 VanDerWaalsContact OH-CB 3.23Å; Y207-Q227 WeakPolarHBondContact OH-CB 3.39Å; Y207-Q227 WeakPolarHBondContact OH-CG 3.44Å; Y207-C238 HydrophobicContact CE2-CB 3.84Å; Y207-V240 HydrophobicContact CD1-CG2 3.61Å; Y207-V240 HydrophobicContact CD2-CG2 3.76Å; Y207-V240 HydrophobicContact CE1-CG2 4.12Å; Y207-V240 HydrophobicContact CE2-CG2 4.27Å; Y207-V240 HydrophobicContact CG-CG2 3.39Å
208	E	92.8	Very high	93.8	Very high	82 Å²	82	39.2 Å²	39.2	38%	0.383	21%	0.207	S	C	.	.	H	α-helix	trans	-58.3	-43.3	174.4	-70	173	174.1	0	0	111.7	K204 K212 L222	K204-E208 WeakPolarHBondContact CE-OE1 3.42Å; K204-E208 HydrophobicContact CG-CG 4.47Å; K204-E208 WeakPolarHBondContact O-CG 3.49Å; K204-E208 PolarHBondContact O-N 3.14Å; E208-K212 WeakPolarHBondContact O-CB 3.46Å; E208-K212 PolarHBondContact O-N 3.03Å; E208-L222 HydrophobicContact CG-CD2 3.39Å
209	I	91	Very high	93.2	Very high	43 Å²	43	41.2 Å²	41.2	22%	0.221	22%	0.22	C	C	.	.	H	α-helix	trans	-70.1	-48.1	177.3	-58.5	163.7	0	0	0	110	F180 C205 Y207 S211 K212 E213	F180-I209 HydrophobicContact CB-CD1 4.12Å; F180-I209 HydrophobicContact CB-CG2 3.7Å; F180-I209 HydrophobicContact CD1-CD1 3.73Å; F180-I209 HydrophobicContact CD2-CD1 3.8Å; F180-I209 HydrophobicContact CE1-CD1 3.99Å; F180-I209 HydrophobicContact CE2-CD1 4.06Å; F180-I209 HydrophobicContact CG-CD1 3.63Å; F180-I209 HydrophobicContact CG-CG2 4.4Å; F180-I209 HydrophobicContact CZ-CD1 4.14Å; C205-I209 WeakPolarHBondContact O-CG1 3.16Å; C205-I209 PolarHBondContact O-N 3.2Å; Y207-I209 VanDerWaalsContact C-N 3.29Å; Y207-I209 PolarHBondContact O-N 3.43Å; I209-S211 VanDerWaalsContact C-N 3.35Å; I209-S211 PolarHBondContact O-N 2.72Å; I209-K212 PolarHBondContact O-N 3.35Å; I209-E213 HydrophobicContact CG2-CG 4.11Å; I209-E213 VanDerWaalsContact O-CG 3.31Å; I209-E213 WeakPolarHBondContact O-CG 3.4Å; I209-E213 PolarHBondContact O-N 2.66Å
210	F	94.3	Very high	92.4	Very high	1 Å²	1	50.4 Å²	50.4	0%	0.004	26%	0.259	C	S	.	.	H	α-helix	trans	-54.4	-49.5	177.2	-175	-94.8	0	0	0	112.1	M164 L187 V188 F201 I206 Y207 K212 E213 V214 F215 I231	M164-F210 HydrophobicContact CE-CB 3.71Å; M164-F210 HydrophobicContact CE-CD2 3.78Å; M164-F210 HydrophobicContact CE-CG 4.19Å; L187-F210 HydrophobicContact CD2-CD2 3.93Å; L187-F210 HydrophobicContact CD2-CE2 3.95Å; L187-F210 HydrophobicContact CG-CE2 4.32Å; V188-F210 HydrophobicContact CG2-CE2 3.58Å; V188-F210 HydrophobicContact CG2-CZ 3.71Å; F201-F210 HydrophobicContact CE1-CB 3.8Å; F201-F210 AromaticContact CE1-CD1 3.93Å; F201-F210 HydrophobicContact CE1-CD1 3.93Å; F201-F210 AromaticContact CE1-CD2 3.93Å; F201-F210 HydrophobicContact CE1-CD2 3.93Å; F201-F210 HydrophobicContact CE1-CE2 4.47Å; F201-F210 AromaticContact CE1-CG 3.6Å; F201-F210 HydrophobicContact CE1-CG 3.6Å; F201-F210 HydrophobicContact CZ-CB 4.33Å; F201-F210 AromaticContact CZ-CD1 3.56Å; F201-F210 HydrophobicContact CZ-CD1 3.56Å; F201-F210 HydrophobicContact CZ-CD2 4.07Å; F201-F210 AromaticContact CZ-CE1 3.8Å; F201-F210 HydrophobicContact CZ-CE1 3.8Å; F201-F210 HydrophobicContact CZ-CE2 4.24Å; F201-F210 AromaticContact CZ-CG 3.71Å; F201-F210 HydrophobicContact CZ-CG 3.71Å; F201-F210 HydrophobicContact CZ-CZ 4.13Å; I206-F210 VanDerWaalsContact O-CB 3.23Å; I206-F210 WeakPolarHBondContact O-CB 3.42Å; I206-F210 PolarHBondContact O-N 2.81Å; Y207-F210 HydrophobicContact CD2-CD1 4.44Å; Y207-F210 HydrophobicContact CE2-CD1 4.41Å; Y207-F210 PolarHBondContact O-N 3.19Å; F210-K212 VanDerWaalsContact C-N 3.3Å; F210-K212 PolarHBondContact O-N 3.19Å; F210-E213 PolarHBondContact O-N 3.04Å; F210-V214 HydrophobicContact CD1-CB 4.39Å; F210-V214 HydrophobicContact CD1-CG2 4.34Å; F210-V214 HydrophobicContact CD2-CG2 3.77Å; F210-V214 HydrophobicContact CE1-CB 4.1Å; F210-V214 HydrophobicContact CE1-CG1 4.18Å; F210-V214 HydrophobicContact CE1-CG2 4.16Å; F210-V214 HydrophobicContact CE2-CB 4.42Å; F210-V214 HydrophobicContact CE2-CG2 3.61Å; F210-V214 HydrophobicContact CG-CG2 4.15Å; F210-V214 HydrophobicContact CZ-CB 4.1Å; F210-V214 HydrophobicContact CZ-CG1 4.01Å; F210-V214 HydrophobicContact CZ-CG2 3.79Å; F210-V214 VanDerWaalsContact O-CB 3.25Å; F210-V214 WeakPolarHBondContact O-CB 3.31Å; F210-V214 WeakPolarHBondContact O-CG2 3.47Å; F210-V214 PolarHBondContact O-N 3.25Å; F210-F215 HydrophobicContact CD1-CE2 4.11Å; F210-F215 HydrophobicContact CD1-CZ 4.46Å; F210-F215 AromaticContact CE1-CE2 3.88Å; F210-F215 HydrophobicContact CE1-CE2 3.88Å; F210-F215 AromaticContact CE1-CZ 3.78Å; F210-F215 HydrophobicContact CE1-CZ 3.78Å; F210-I231 HydrophobicContact CE1-CD1 3.7Å; F210-I231 HydrophobicContact CE2-CD1 4.49Å; F210-I231 HydrophobicContact CZ-CD1 3.41Å; F210-I231 VanDerWaalsContact CZ-CD1 3.41Å
211	S	95.1	Very high	92	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-61.7	-39.2	-179.2	-178.3	0	0	0	0	112.1	Y207 I209 F215 G216 V217 V219	Y207-S211 VanDerWaalsContact O-CB 3.24Å; Y207-S211 WeakPolarHBondContact O-CB 3.49Å; Y207-S211 PolarHBondContact O-N 3.22Å; I209-S211 VanDerWaalsContact C-N 3.35Å; I209-S211 PolarHBondContact O-N 2.72Å; S211-F215 CarbonylContact O-C 3.38Å; S211-F215 WeakPolarHBondContact O-CA 3.43Å; S211-F215 VanDerWaalsContact O-CB 3.3Å; S211-F215 WeakPolarHBondContact O-CB 3.07Å; S211-F215 PolarHBondContact O-N 3.32Å; S211-G216 PolarHBondContact O-N 3.48Å; S211-V217 CarbonylContact C-O 3.56Å; S211-V217 VanDerWaalsContact C-O 3.29Å; S211-V217 PolarHBondContact O-N 3.01Å; S211-V217 VanDerWaalsContact O-N 3.16Å; S211-V217 PolarHBondContact OG-O 3.42Å; S211-V217 VanDerWaalsContact OG-O 3.09Å; S211-V219 VanDerWaalsContact OG-CG2 3.29Å; S211-V219 WeakPolarHBondContact OG-CG2 3.49Å
212	K	92.4	Very high	91.7	Very high	117 Å²	117	57.7 Å²	57.7	51%	0.509	30%	0.298	S	S	.	.	H	α-helix	trans	-67.8	-44.1	177.9	-174.6	-169.2	173.2	-158.8	0	111.4	E208 I209 F210 G216 V217	E208-K212 WeakPolarHBondContact O-CB 3.46Å; E208-K212 PolarHBondContact O-N 3.03Å; I209-K212 PolarHBondContact O-N 3.35Å; F210-K212 VanDerWaalsContact C-N 3.3Å; F210-K212 PolarHBondContact O-N 3.19Å; K212-G216 WeakPolarHBondContact O-CA 3.22Å; K212-G216 PolarHBondContact O-N 3.09Å; K212-V217 WeakPolarHBondContact CA-O 3.42Å; K212-V217 PolarHBondContact N-O 3.27Å
213	E	89.6	Confident	91.6	Very high	76 Å²	76	64.8 Å²	64.8	36%	0.355	33%	0.331	S	S	.	.	H	α-helix	trans	-79.2	-36.9	-173.9	-63.8	-60.9	147.1	0	0	112.9	R181 I209 F210	R181-E213 VanDerWaalsContact CD-OE1 3.22Å; R181-E213 WeakPolarHBondContact CD-OE1 3.37Å; R181-E213 WeakPolarHBondContact CD-OE2 3.44Å; R181-E213 HydrophobicContact CG-CG 3.85Å; R181-E213 WeakPolarHBondContact CG-OE1 3.37Å; R181-E213 VanDerWaalsContact CG-OE2 3.29Å; R181-E213 WeakPolarHBondContact CG-OE2 3.47Å; I209-E213 HydrophobicContact CG2-CG 4.11Å; I209-E213 VanDerWaalsContact O-CG 3.31Å; I209-E213 WeakPolarHBondContact O-CG 3.4Å; I209-E213 PolarHBondContact O-N 2.66Å; F210-E213 PolarHBondContact O-N 3.04Å
214	V	91.6	Very high	91.8	Very high	38 Å²	38	67.4 Å²	67.4	23%	0.23	34%	0.343	C	S	.	.	H	α-helix	trans	-94.1	-43.6	-173.6	-179.7	0	0	0	0	111.6	V188 F210 P232	V188-V214 HydrophobicContact CG2-CB 4.21Å; V188-V214 HydrophobicContact CG2-CG1 3.64Å; V188-V214 HydrophobicContact CG2-CG2 3.45Å; V188-V214 VanDerWaalsContact CG2-CG2 3.45Å; F210-V214 HydrophobicContact CD1-CB 4.39Å; F210-V214 HydrophobicContact CD1-CG2 4.34Å; F210-V214 HydrophobicContact CD2-CG2 3.77Å; F210-V214 HydrophobicContact CE1-CB 4.1Å; F210-V214 HydrophobicContact CE1-CG1 4.18Å; F210-V214 HydrophobicContact CE1-CG2 4.16Å; F210-V214 HydrophobicContact CE2-CB 4.42Å; F210-V214 HydrophobicContact CE2-CG2 3.61Å; F210-V214 HydrophobicContact CG-CG2 4.15Å; F210-V214 HydrophobicContact CZ-CB 4.1Å; F210-V214 HydrophobicContact CZ-CG1 4.01Å; F210-V214 HydrophobicContact CZ-CG2 3.79Å; F210-V214 VanDerWaalsContact O-CB 3.25Å; F210-V214 WeakPolarHBondContact O-CB 3.31Å; F210-V214 WeakPolarHBondContact O-CG2 3.47Å; F210-V214 PolarHBondContact O-N 3.25Å; V214-P232 HydrophobicContact CG1-CG 3.62Å
215	F	92.3	Very high	92.1	Very high	44 Å²	44	64.5 Å²	64.5	19%	0.193	33%	0.333	C	S	.	.	S	Bend	trans	-95.9	-9.3	-179.2	-51.3	-48.8	0	0	0	112.9	Y207 F210 S211 V217 H229 K230 P232	Y207-F215 HydrophobicContact CE2-CE2 4.48Å; F210-F215 HydrophobicContact CD1-CE2 4.11Å; F210-F215 HydrophobicContact CD1-CZ 4.46Å; F210-F215 AromaticContact CE1-CE2 3.88Å; F210-F215 HydrophobicContact CE1-CE2 3.88Å; F210-F215 AromaticContact CE1-CZ 3.78Å; F210-F215 HydrophobicContact CE1-CZ 3.78Å; S211-F215 CarbonylContact O-C 3.38Å; S211-F215 WeakPolarHBondContact O-CA 3.43Å; S211-F215 VanDerWaalsContact O-CB 3.3Å; S211-F215 WeakPolarHBondContact O-CB 3.07Å; S211-F215 PolarHBondContact O-N 3.32Å; F215-V217 HydrophobicContact CB-CB 4.31Å; F215-V217 HydrophobicContact CB-CG2 4.09Å; F215-V217 PolarHBondContact O-N 2.86Å; F215-H229 HydrophobicContact CD1-CB 4.41Å; F215-H229 HydrophobicContact CD2-CB 3.95Å; F215-H229 HydrophobicContact CE1-CB 4.07Å; F215-H229 HydrophobicContact CE2-CB 3.61Å; F215-H229 HydrophobicContact CG-CB 4.36Å; F215-H229 HydrophobicContact CZ-CB 3.67Å; F215-K230 WeakPolarHBondContact CE1-O 3.29Å; F215-K230 WeakPolarHBondContact CZ-O 3.3Å; F215-P232 HydrophobicContact CD1-CG 4.46Å; F215-P232 HydrophobicContact CE1-CG 4.05Å
216	G	92.1	Very high	92.5	Very high	66 Å²	66	66.5 Å²	66.5	68%	0.68	34%	0.339	S	S	*	.			trans	68.2	11.1	-171.6	0	0	0	0	0	113.2	S211 K212	S211-G216 PolarHBondContact O-N 3.48Å; K212-G216 WeakPolarHBondContact O-CA 3.22Å; K212-G216 PolarHBondContact O-N 3.09Å
217	V	91.1	Very high	92.8	Very high	56 Å²	56	67.4 Å²	67.4	34%	0.339	34%	0.344	S	S	.	.			trans	-106.2	117	-173	179.2	0	0	0	0	110.2	S211 K212 F215 V219	S211-V217 CarbonylContact C-O 3.56Å; S211-V217 VanDerWaalsContact C-O 3.29Å; S211-V217 PolarHBondContact O-N 3.01Å; S211-V217 VanDerWaalsContact O-N 3.16Å; S211-V217 PolarHBondContact OG-O 3.42Å; S211-V217 VanDerWaalsContact OG-O 3.09Å; K212-V217 WeakPolarHBondContact CA-O 3.42Å; K212-V217 PolarHBondContact N-O 3.27Å; F215-V217 HydrophobicContact CB-CB 4.31Å; F215-V217 HydrophobicContact CB-CG2 4.09Å; F215-V217 PolarHBondContact O-N 2.86Å; V217-V219 HydrophobicContact CG1-CG2 4.39Å; V217-V219 PolarHBondContact O-N 3.48Å
218	K	90.3	Very high	92.8	Very high	173 Å²	173	72.8 Å²	72.8	75%	0.752	38%	0.379	S	S	*	.			trans	-83.6	102.2	166.8	-172.6	-179.7	-179.8	-178.1	0	109.3	K220	K218-K220 PolarHBondContact O-N 3.43Å
219	V	86.2	Confident	93	Very high	42 Å²	42	72 Å²	72	26%	0.255	38%	0.375	S	S	.	.			trans	-70.6	119.3	178.9	-161.9	0	0	0	0	109.5	S211 V217 L222	S211-V219 VanDerWaalsContact OG-CG2 3.29Å; S211-V219 WeakPolarHBondContact OG-CG2 3.49Å; V217-V219 HydrophobicContact CG1-CG2 4.39Å; V217-V219 PolarHBondContact O-N 3.48Å; V219-L222 HydrophobicContact CB-CB 4.07Å; V219-L222 HydrophobicContact CG1-CB 3.64Å; V219-L222 HydrophobicContact CG1-CD1 4.07Å; V219-L222 HydrophobicContact CG1-CG 4.45Å
220	K	82.8	Confident	93.3	Very high	193 Å²	193	74.3 Å²	74.3	84%	0.839	38%	0.383	S	S	*	.	S	Bend	trans	-81.3	-47.5	-179.1	-68.7	-176.9	-179.7	178.3	0	112.2	K218	K218-K220 PolarHBondContact O-N 3.43Å
221	N	89.3	Confident	93.5	Very high	145 Å²	145	74.3 Å²	74.3	78%	0.775	38%	0.383	S	S	*	.	S	Bend	trans	-118.2	70.1	179.5	-65.4	-13.2	0	0	0	108.6	E223	N221-E223 PolarHBondContact O-N 3.46Å
222	L	93.3	Very high	93.7	Very high	8 Å²	8	76.2 Å²	76.2	4%	0.042	40%	0.396	C	S	.	.	P	Polyproline II helix	trans	-68.3	124.2	179.1	173.1	63.7	0	0	0	109.8	K204 Y207 E208 V219	K204-L222 HydrophobicContact CD-CD2 4.23Å; K204-L222 HydrophobicContact CD-CG 4.46Å; K204-L222 VanDerWaalsContact CE-CB 3.45Å; K204-L222 WeakPolarHBondContact CE-O 3.41Å; K204-L222 HydrophobicContact CG-CD2 3.39Å; K204-L222 HydrophobicContact CG-CG 4.05Å; K204-L222 PolarHBondContact NZ-O 2.98Å; Y207-L222 HydrophobicContact CD1-CD1 3.49Å; Y207-L222 VanDerWaalsContact CD1-CD1 3.49Å; Y207-L222 HydrophobicContact CD1-CD2 3.69Å; Y207-L222 HydrophobicContact CD1-CG 4.25Å; Y207-L222 HydrophobicContact CE1-CD1 3.55Å; E208-L222 HydrophobicContact CG-CD2 3.39Å; V219-L222 HydrophobicContact CB-CB 4.07Å; V219-L222 HydrophobicContact CG1-CB 3.64Å; V219-L222 HydrophobicContact CG1-CD1 4.07Å; V219-L222 HydrophobicContact CG1-CG 4.45Å
223	E	96.1	Very high	93.9	Very high	151 Å²	151	77.7 Å²	77.7	71%	0.706	41%	0.41	S	S	*	.	P	Polyproline II helix	trans	-98.4	156.7	173.6	-63.3	-173.9	167.2	0	0	110.6	N221 Q227	N221-E223 PolarHBondContact O-N 3.46Å; E223-Q227 PolarHBondContact O-NE2 3.47Å
224	F	97.9	Very high	94.4	Very high	57 Å²	57	74.8 Å²	74.8	25%	0.25	40%	0.397	C	S	.	.	S	Bend	trans	-76.1	165.7	170	-66.9	-67.3	0	0	0	110.6	K204 V240 M241 P242 F251 Y260	K204-F224 HydrophobicContact CB-CE1 3.97Å; K204-F224 HydrophobicContact CB-CZ 4.35Å; K204-F224 HydrophobicContact CD-CE1 4.49Å; K204-F224 HydrophobicContact CD-CZ 4.33Å; K204-F224 HydrophobicContact CG-CE1 4.48Å; F224-V240 HydrophobicContact CD1-CG1 4.02Å; F224-V240 HydrophobicContact CE1-CG1 4.45Å; F224-M241 VanDerWaalsContact CE1-C 3.49Å; F224-P242 HydrophobicContact CE1-CB 4.11Å; F224-P242 VanDerWaalsContact CE1-N 3.3Å; F224-P242 HydrophobicContact CZ-CB 4.08Å; F224-F251 HydrophobicContact CD2-CZ 4.4Å; F224-F251 AromaticContact CE2-CE2 3.63Å; F224-F251 HydrophobicContact CE2-CE2 3.63Å; F224-F251 AromaticContact CE2-CZ 3.77Å; F224-F251 HydrophobicContact CE2-CZ 3.77Å; F224-F251 AromaticContact CZ-CE2 3.84Å; F224-F251 HydrophobicContact CZ-CE2 3.84Å; F224-F251 HydrophobicContact CZ-CZ 4.4Å; F224-Y260 HydrophobicContact CB-CD1 3.75Å; F224-Y260 HydrophobicContact CB-CE1 3.22Å; F224-Y260 HydrophobicContact CD2-CE1 4.05Å; F224-Y260 AromaticContact CD2-CZ 3.72Å; F224-Y260 WeakPolarHBondContact CD2-OH 3.4Å; F224-Y260 HydrophobicContact CG-CD1 4.44Å; F224-Y260 AromaticContact CG-CE1 3.81Å; F224-Y260 HydrophobicContact CG-CE1 3.81Å; F224-Y260 AromaticContact CG-CZ 3.91Å
225	G	98.3	Very high	94.7	Very high	10 Å²	10	79.6 Å²	79.6	10%	0.103	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	93.1	-157.2	-179.6	0	0	0	0	0	113.2	Q227 Y239 V240	G225-Q227 PolarHBondContact O-NE2 3.26Å; G225-Y239 VanDerWaalsContact C-CD2 3.41Å; G225-Y239 VanDerWaalsContact CA-CE2 3.46Å; G225-Y239 WeakPolarHBondContact O-CA 3.35Å; G225-V240 PolarHBondContact N-O 2.85Å; G225-V240 PolarHBondContact O-N 3.46Å
226	L	98.5	Very high	95	Very high	93 Å²	93	77.6 Å²	77.6	49%	0.487	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	134	-177.7	179.6	62.9	0	0	0	110.9	L237 Y239 L267	L226-L237 HydrophobicContact CD1-CB 3.97Å; L226-L237 HydrophobicContact CD1-CD1 4.02Å; L226-L237 HydrophobicContact CD1-CG 4.43Å; L226-Y239 HydrophobicContact CB-CD2 4.23Å; L226-Y239 VanDerWaalsContact N-CD2 3.34Å; L226-L267 HydrophobicContact CD1-CD2 3.97Å; L226-L267 HydrophobicContact CD2-CD1 4.48Å
227	Q	98.1	Very high	95.3	Very high	19 Å²	19	75.9 Å²	75.9	9%	0.089	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	152.8	-179.4	-55.3	-63.3	-56.3	0	0	110.8	Y207 E223 G225 H229 C238 V240	Y207-Q227 HydrophobicContact CE1-CB 4.44Å; Y207-Q227 HydrophobicContact CE1-CG 3.8Å; Y207-Q227 VanDerWaalsContact CE1-OE1 3.27Å; Y207-Q227 HydrophobicContact CE2-CB 4.47Å; Y207-Q227 HydrophobicContact CE2-CG 4.02Å; Y207-Q227 VanDerWaalsContact OH-CB 3.23Å; Y207-Q227 WeakPolarHBondContact OH-CB 3.39Å; Y207-Q227 WeakPolarHBondContact OH-CG 3.44Å; E223-Q227 PolarHBondContact O-NE2 3.47Å; G225-Q227 PolarHBondContact O-NE2 3.26Å; Q227-H229 PolarHBondContact O-N 3.16Å; Q227-C238 HydrophobicContact CB-CB 3.95Å; Q227-C238 WeakPolarHBondContact CB-O 3.36Å; Q227-C238 HydrophobicContact CG-CB 4.21Å; Q227-C238 PolarHBondContact N-O 3.39Å; Q227-V240 HydrophobicContact CG-CG2 3.6Å
228	P	96.2	Very high	95.7	Very high	115 Å²	115	73.2 Å²	73.2	75%	0.747	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.9	-4.5	-176.4	29.9	-35.5	0	0	0	114.2
229	H	96.4	Very high	96.1	Very high	66 Å²	66	65.3 Å²	65.3	31%	0.306	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	138.4	-178.4	-52.2	100.7	0	0	0	110.8	F215 Q227 C238	F215-H229 HydrophobicContact CD1-CB 4.41Å; F215-H229 HydrophobicContact CD2-CB 3.95Å; F215-H229 HydrophobicContact CE1-CB 4.07Å; F215-H229 HydrophobicContact CE2-CB 3.61Å; F215-H229 HydrophobicContact CG-CB 4.36Å; F215-H229 HydrophobicContact CZ-CB 3.67Å; Q227-H229 PolarHBondContact O-N 3.16Å; H229-C238 WeakPolarHBondContact O-CB 3.25Å
230	K	98.3	Very high	96.7	Very high	90 Å²	90	63.3 Å²	63.3	39%	0.391	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	159.9	168.4	-62.6	-176.3	-177.5	172.6	0	110	F215 E235 T236 L237	F215-K230 WeakPolarHBondContact CE1-O 3.29Å; F215-K230 WeakPolarHBondContact CZ-O 3.3Å; K230-E235 IonicContact NZ-OE1 2.59Å; K230-E235 IonicContact NZ-OE2 2.88Å; K230-E235 PolarHBondContact NZ-OE2 3.16Å; K230-T236 CarbonylContact C-O 3.59Å; K230-T236 VanDerWaalsContact CA-O 3.29Å; K230-T236 WeakPolarHBondContact CA-O 3.36Å; K230-T236 WeakPolarHBondContact CB-O 3.46Å; K230-L237 HydrophobicContact CD-CD2 4.3Å; K230-L237 HydrophobicContact CG-CD2 4.05Å
231	I	98.4	Very high	97.4	Very high	1 Å²	1	54.1 Å²	54.1	1%	0.005	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-61.7	134.2	170.9	-58.1	-65.4	0	0	0	108.5	L191 Q192 A199 F210 D233 T234 T236 C238	L191-I231 HydrophobicContact CB-CG1 4.39Å; L191-I231 HydrophobicContact CB-CG2 3.92Å; L191-I231 HydrophobicContact CD1-CD1 3.57Å; L191-I231 HydrophobicContact CD1-CG1 3.96Å; Q192-I231 HydrophobicContact CG-CG2 4.47Å; A199-I231 HydrophobicContact CB-CD1 4.34Å; A199-I231 HydrophobicContact CB-CG1 4.28Å; F210-I231 HydrophobicContact CE1-CD1 3.7Å; F210-I231 HydrophobicContact CE2-CD1 4.49Å; F210-I231 HydrophobicContact CZ-CD1 3.41Å; F210-I231 VanDerWaalsContact CZ-CD1 3.41Å; I231-D233 PolarHBondContact O-N 2.74Å; I231-T234 WeakPolarHBondContact CB-OG1 3.47Å; I231-T234 HydrophobicContact CG2-CG2 4.36Å; I231-T234 PolarHBondContact O-N 2.9Å; I231-T234 VanDerWaalsContact O-N 3.17Å; I231-T234 PolarHBondContact O-OG1 3.48Å; I231-T236 HydrophobicContact CB-CG2 4.41Å; I231-T236 HydrophobicContact CG1-CG2 3.68Å; I231-T236 PolarHBondContact N-O 3.05Å; I231-C238 VanDerWaalsContact CD1-SG 3.56Å
232	P	97.9	Very high	97.8	Very high	40 Å²	40	47.3 Å²	47.3	26%	0.26	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	138.6	-174.8	-25.6	35.7	0	0	0	112.4	Q192 V214 F215 T234	Q192-P232 WeakPolarHBondContact CG-O 3.48Å; Q192-P232 PolarHBondContact NE2-O 2.93Å; V214-P232 HydrophobicContact CG1-CG 3.62Å; F215-P232 HydrophobicContact CD1-CG 4.46Å; F215-P232 HydrophobicContact CE1-CG 4.05Å; P232-T234 PolarHBondContact O-N 3.14Å
233	D	97.9	Very high	98	Very high	149 Å²	149	48.3 Å²	48.3	80%	0.797	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.1	21	179.5	-44.5	-50	0	0	0	114.6	Q192 I231	Q192-D233 PolarHBondContact NE2-OD2 3Å; Q192-D233 VanDerWaalsContact NE2-OD2 3.13Å; I231-D233 PolarHBondContact O-N 2.74Å
234	T	98.6	Very high	98	Very high	14 Å²	14	41.2 Å²	41.2	9%	0.086	22%	0.219	C	C	.	.	S	Bend	trans	-141.8	167.6	177.9	75	0	0	0	0	112.2	Q192 Q195 I231 P232 T236	Q192-T234 HydrophobicContact CB-CG2 4.36Å; Q192-T234 HydrophobicContact CG-CG2 4Å; Q195-T234 HydrophobicContact CG-CG2 4.04Å; I231-T234 WeakPolarHBondContact CB-OG1 3.47Å; I231-T234 HydrophobicContact CG2-CG2 4.36Å; I231-T234 PolarHBondContact O-N 2.9Å; I231-T234 VanDerWaalsContact O-N 3.17Å; I231-T234 PolarHBondContact O-OG1 3.48Å; P232-T234 PolarHBondContact O-N 3.14Å; T234-T236 VanDerWaalsContact C-N 3.32Å; T234-T236 WeakPolarHBondContact OG1-CB 3.4Å; T234-T236 PolarHBondContact OG1-N 3.24Å; T234-T236 VanDerWaalsContact OG1-N 3.16Å
235	E	98.6	Very high	97.8	Very high	140 Å²	140	39.3 Å²	39.3	65%	0.654	21%	0.212	S	C	*	.			trans	-89.3	3.9	169.4	-68.4	-60.5	119.8	0	0	113.5	K230 L237	K230-E235 IonicContact NZ-OE1 2.59Å; K230-E235 IonicContact NZ-OE2 2.88Å; K230-E235 PolarHBondContact NZ-OE2 3.16Å; E235-L237 PolarHBondContact O-N 3.12Å
236	T	98.9	Very high	97.6	Very high	2 Å²	2	41 Å²	41	1%	0.012	23%	0.225	C	C	.	.	P	Polyproline II helix	trans	-65.7	118.1	-177.4	-61.5	0	0	0	0	111	P196 A199 K230 I231 T234	P196-T236 HydrophobicContact CG-CG2 3.93Å; P196-T236 VanDerWaalsContact O-CB 3.26Å; P196-T236 WeakPolarHBondContact O-CB 3.45Å; P196-T236 VanDerWaalsContact O-CG2 3.22Å; P196-T236 WeakPolarHBondContact O-CG2 3.44Å; P196-T236 PolarHBondContact O-OG1 2.95Å; A199-T236 HydrophobicContact CB-CG2 3.67Å; K230-T236 CarbonylContact C-O 3.59Å; K230-T236 VanDerWaalsContact CA-O 3.29Å; K230-T236 WeakPolarHBondContact CA-O 3.36Å; K230-T236 WeakPolarHBondContact CB-O 3.46Å; I231-T236 HydrophobicContact CB-CG2 4.41Å; I231-T236 HydrophobicContact CG1-CG2 3.68Å; I231-T236 PolarHBondContact N-O 3.05Å; T234-T236 VanDerWaalsContact C-N 3.32Å; T234-T236 WeakPolarHBondContact OG1-CB 3.4Å; T234-T236 PolarHBondContact OG1-N 3.24Å; T234-T236 VanDerWaalsContact OG1-N 3.16Å
237	L	98.9	Very high	97.2	Very high	29 Å²	29	44.8 Å²	44.8	15%	0.152	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	149	175.9	-57.1	-177.4	0	0	0	111.2	R197 A199 L226 K230 E235 L267 L271	R197-L237 PolarHBondContact O-N 3.37Å; A199-L237 PolarHBondContact N-O 3.34Å; L226-L237 HydrophobicContact CD1-CB 3.97Å; L226-L237 HydrophobicContact CD1-CD1 4.02Å; L226-L237 HydrophobicContact CD1-CG 4.43Å; K230-L237 HydrophobicContact CD-CD2 4.3Å; K230-L237 HydrophobicContact CG-CD2 4.05Å; E235-L237 PolarHBondContact O-N 3.12Å; L237-L267 HydrophobicContact CD1-CD1 4.19Å; L237-L267 HydrophobicContact CD1-CD2 4.21Å; L237-L267 HydrophobicContact CD1-CG 4.5Å; L237-L271 HydrophobicContact CD1-CD1 3.84Å; L237-L271 HydrophobicContact CD1-CD2 4.33Å
238	C	98.8	Very high	96.9	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	129.5	169.7	-66.3	0	0	0	0	110.7	F201 Y207 Q227 H229 I231	F201-C238 HydrophobicContact CE2-CB 4.11Å; Y207-C238 HydrophobicContact CE2-CB 3.84Å; Q227-C238 HydrophobicContact CB-CB 3.95Å; Q227-C238 WeakPolarHBondContact CB-O 3.36Å; Q227-C238 HydrophobicContact CG-CB 4.21Å; Q227-C238 PolarHBondContact N-O 3.39Å; H229-C238 WeakPolarHBondContact O-CB 3.25Å; I231-C238 VanDerWaalsContact CD1-SG 3.56Å
239	Y	98.9	Very high	96.7	Very high	8 Å²	8	42 Å²	42	3%	0.031	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	135.1	176.9	-171.6	-89.4	0	0	0	110.3	A199 V200 F201 G225 L226 M241 Y260 K263 L264 L267	A199-Y239 PolarHBondContact O-N 2.8Å; V200-Y239 CarbonylContact C-O 3.47Å; V200-Y239 WeakPolarHBondContact CA-O 3.32Å; V200-Y239 HydrophobicContact CG1-CD1 4.3Å; F201-Y239 PolarHBondContact N-O 2.96Å; G225-Y239 VanDerWaalsContact C-CD2 3.41Å; G225-Y239 VanDerWaalsContact CA-CE2 3.46Å; G225-Y239 WeakPolarHBondContact O-CA 3.35Å; L226-Y239 HydrophobicContact CB-CD2 4.23Å; L226-Y239 VanDerWaalsContact N-CD2 3.34Å; Y239-M241 HydrophobicContact CD1-CG 3.76Å; Y239-M241 HydrophobicContact CD1-SD 4.35Å; Y239-M241 HydrophobicContact CE1-CG 3.44Å; Y239-M241 VanDerWaalsContact CE1-CG 3.44Å; Y239-M241 HydrophobicContact CE1-SD 3.82Å; Y239-Y260 WeakPolarHBondContact CE1-O 3.37Å; Y239-Y260 PolarHBondContact OH-O 3.05Å; Y239-K263 WeakPolarHBondContact OH-CB 3.48Å; Y239-L264 HydrophobicContact CD1-CB 4.37Å; Y239-L264 HydrophobicContact CD1-CD1 4.02Å; Y239-L264 HydrophobicContact CE1-CB 3.82Å; Y239-L264 HydrophobicContact CE1-CD1 4.31Å; Y239-L264 HydrophobicContact CG-CD1 4.17Å; Y239-L264 PolarHBondContact OH-N 3.18Å; Y239-L267 HydrophobicContact CD2-CD2 3.93Å
240	V	98.7	Very high	96.6	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	132.7	-173.3	-174.3	0	0	0	0	110.7	F201 Y207 F224 G225 Q227	F201-V240 HydrophobicContact CB-CG2 4.37Å; Y207-V240 HydrophobicContact CD1-CG2 3.61Å; Y207-V240 HydrophobicContact CD2-CG2 3.76Å; Y207-V240 HydrophobicContact CE1-CG2 4.12Å; Y207-V240 HydrophobicContact CE2-CG2 4.27Å; Y207-V240 HydrophobicContact CG-CG2 3.39Å; F224-V240 HydrophobicContact CD1-CG1 4.02Å; F224-V240 HydrophobicContact CE1-CG1 4.45Å; G225-V240 PolarHBondContact N-O 2.85Å; G225-V240 PolarHBondContact O-N 3.46Å; Q227-V240 HydrophobicContact CG-CG2 3.6Å
241	M	98.4	Very high	96.5	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	158.8	175.8	-61	-161.7	-59.8	0	0	111.2	V200 F201 G203 F224 Y239 Y261 L264	V200-M241 HydrophobicContact CG1-CE 3.5Å; V200-M241 HydrophobicContact CG1-CG 4.3Å; V200-M241 HydrophobicContact CG1-SD 4.31Å; F201-M241 PolarHBondContact O-N 3.28Å; G203-M241 CarbonylContact C-O 3.55Å; G203-M241 VanDerWaalsContact CA-O 3.25Å; G203-M241 WeakPolarHBondContact CA-O 3.46Å; G203-M241 PolarHBondContact N-O 3.47Å; F224-M241 VanDerWaalsContact CE1-C 3.49Å; Y239-M241 HydrophobicContact CD1-CG 3.76Å; Y239-M241 HydrophobicContact CD1-SD 4.35Å; Y239-M241 HydrophobicContact CE1-CG 3.44Å; Y239-M241 VanDerWaalsContact CE1-CG 3.44Å; Y239-M241 HydrophobicContact CE1-SD 3.82Å; M241-Y261 HydrophobicContact CE-CD1 4.26Å; M241-Y261 HydrophobicContact CE-CD2 4.01Å; M241-Y261 HydrophobicContact CE-CE1 3.82Å; M241-Y261 HydrophobicContact CE-CE2 3.52Å; M241-Y261 HydrophobicContact CE-CG 4.34Å; M241-Y261 VanDerWaalsContact CE-CZ 3.41Å; M241-Y261 HydrophobicContact SD-CD2 3.69Å; M241-Y261 HydrophobicContact SD-CE2 3.76Å; M241-Y261 HydrophobicContact SD-CG 4.09Å; M241-L264 HydrophobicContact CE-CD2 4.31Å; M241-L264 HydrophobicContact SD-CD2 4.24Å
242	P	97.4	Very high	96.4	Very high	2 Å²	2	42.4 Å²	42.4	1%	0.013	23%	0.226	C	C	.	.			trans	-59.5	148.9	165.2	27.2	-35.4	0	0	0	110.1	N202 F224 S244 F251 K257 Y260	N202-P242 PolarHBondContact OD1-O 3.47Å; F224-P242 HydrophobicContact CE1-CB 4.11Å; F224-P242 VanDerWaalsContact CE1-N 3.3Å; F224-P242 HydrophobicContact CZ-CB 4.08Å; P242-S244 PolarHBondContact O-N 2.95Å; P242-F251 HydrophobicContact CB-CB 4.41Å; P242-F251 HydrophobicContact CB-CD2 3.42Å; P242-F251 VanDerWaalsContact CB-CD2 3.42Å; P242-F251 HydrophobicContact CB-CE2 3.75Å; P242-F251 HydrophobicContact CB-CG 3.93Å; P242-F251 HydrophobicContact CB-CZ 4.48Å; P242-F251 HydrophobicContact CG-CD2 4.15Å; P242-F251 HydrophobicContact CG-CE2 4.36Å; P242-F251 HydrophobicContact CG-CG 4.26Å; P242-K257 HydrophobicContact CB-CG 4.46Å; P242-K257 HydrophobicContact CG-CB 4.12Å; P242-K257 HydrophobicContact CG-CD 4.48Å; P242-K257 HydrophobicContact CG-CG 3.92Å; P242-Y260 HydrophobicContact CG-CD2 3.48Å; P242-Y260 VanDerWaalsContact CG-CD2 3.48Å; P242-Y260 HydrophobicContact CG-CE2 3.68Å; P242-Y260 HydrophobicContact CG-CG 4.36Å
243	S	96.6	Very high	96.3	Very high	29 Å²	29	43 Å²	43	20%	0.203	22%	0.223	C	C	.	.			trans	-60.6	132.8	-180	-177.9	0	0	0	0	110.5	N202 S245 K257	N202-S243 WeakPolarHBondContact OD1-CA 3.47Å; S243-S245 PolarHBondContact O-N 3.46Å; S243-S245 PolarHBondContact OG-N 3.45Å; S243-K257 WeakPolarHBondContact O-CE 3.33Å; S243-K257 PolarHBondContact O-NZ 3.13Å
244	S	97.1	Very high	96.2	Very high	1 Å²	1	36.2 Å²	36.2	1%	0.007	19%	0.188	C	C	.	.	S	Bend	trans	-68	-16	178.4	71.1	0	0	0	0	113.1	N129 H130 N202 P242 A246 K257	N129-S244 PolarHBondContact ND2-OG 3.21Å; N129-S244 VanDerWaalsContact OD1-CB 3.28Å; N129-S244 WeakPolarHBondContact OD1-CB 3.34Å; N129-S244 PolarHBondContact OD1-OG 3.17Å; H130-S244 WeakPolarHBondContact CB-O 3.4Å; H130-S244 PolarHBondContact N-O 3.21Å; N202-S244 PolarHBondContact ND2-OG 3.37Å; N202-S244 PolarHBondContact OD1-N 3.33Å; P242-S244 PolarHBondContact O-N 2.95Å; S244-A246 PolarHBondContact O-N 3.26Å; S244-K257 PolarHBondContact O-NZ 3.1Å
245	S	94.1	Very high	96.1	Very high	17 Å²	17	38.1 Å²	38.1	12%	0.119	20%	0.196	C	C	.	.	B	Isolated β-bridge	trans	-58	136.7	175.1	-176.3	0	0	0	0	111.7	S243 R247 C248 K257	S243-S245 PolarHBondContact O-N 3.46Å; S243-S245 PolarHBondContact OG-N 3.45Å; S245-R247 PolarHBondContact O-N 3.39Å; S245-R247 VanDerWaalsContact O-N 3.13Å; S245-R247 PolarHBondContact OG-N 2.72Å; S245-R247 PolarHBondContact OG-NE 2.84Å; S245-C248 WeakPolarHBondContact O-CB 3.28Å; S245-C248 PolarHBondContact O-N 2.89Å; S245-C248 VanDerWaalsContact O-N 3.1Å; S245-K257 PolarHBondContact O-NZ 3.23Å
246	A	92.8	Very high	96.1	Very high	45 Å²	45	31.5 Å²	31.5	37%	0.372	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-12.6	172.2	0	0	0	0	0	112.9	G128 S244 C248	G128-A246 WeakPolarHBondContact O-CB 3.22Å; G128-A246 PolarHBondContact O-N 3.25Å; S244-A246 PolarHBondContact O-N 3.26Å; A246-C248 PolarHBondContact O-N 3.31Å
247	R	90.8	Very high	96	Very high	174 Å²	174	31.4 Å²	31.4	66%	0.657	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-8.3	173	-62.9	-177.2	-66.2	-130.9	5.9	113.7	P170 S245 A249	P170-R247 PolarHBondContact O-NH1 2.98Å; P170-R247 PolarHBondContact O-NH2 2.96Å; S245-R247 PolarHBondContact O-N 3.39Å; S245-R247 VanDerWaalsContact O-N 3.13Å; S245-R247 PolarHBondContact OG-N 2.72Å; S245-R247 PolarHBondContact OG-NE 2.84Å; R247-A249 PolarHBondContact O-N 3.21Å
248	C	92.4	Very high	96	Very high	16 Å²	16	30.6 Å²	30.6	11%	0.108	16%	0.161	C	C	.	.			trans	-71.4	98.5	176.6	-175.8	0	0	0	0	110.1	S245 A246 Q250 F251	S245-C248 WeakPolarHBondContact O-CB 3.28Å; S245-C248 PolarHBondContact O-N 2.89Å; S245-C248 VanDerWaalsContact O-N 3.1Å; A246-C248 PolarHBondContact O-N 3.31Å; C248-Q250 VanDerWaalsContact C-N 3.26Å; C248-Q250 PolarHBondContact O-N 3.36Å; C248-F251 CarbonylContact O-C 3.32Å; C248-F251 PolarHBondContact O-N 3.25Å; C248-F251 VanDerWaalsContact O-O 3.13Å
249	A	91.8	Very high	96	Very high	58 Å²	58	31.9 Å²	31.9	48%	0.479	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-27.2	-175.8	0	0	0	0	0	113.6	R247 F251 L289 Q293	R247-A249 PolarHBondContact O-N 3.21Å; A249-F251 VanDerWaalsContact C-N 3.33Å; A249-L289 WeakPolarHBondContact O-CD1 3.23Å; A249-Q293 PolarHBondContact O-NE2 2.86Å
250	Q	94	Very high	96	Very high	126 Å²	126	33.5 Å²	33.5	59%	0.589	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-25.3	178.9	-62	85.6	-5.8	0	0	112.9	C248 F287	C248-Q250 VanDerWaalsContact C-N 3.26Å; C248-Q250 PolarHBondContact O-N 3.36Å; Q250-F287 WeakPolarHBondContact O-CZ 3.43Å
251	F	96.5	Very high	96	Very high	26 Å²	26	33.6 Å²	33.6	11%	0.114	17%	0.173	C	C	.	.	S	Bend	trans	-134.6	80.7	-179.3	-64.4	-85.5	0	0	0	108.4	F224 P242 C248 A249 R253 D256 K257 Y260 F287	F224-F251 HydrophobicContact CD2-CZ 4.4Å; F224-F251 AromaticContact CE2-CE2 3.63Å; F224-F251 HydrophobicContact CE2-CE2 3.63Å; F224-F251 AromaticContact CE2-CZ 3.77Å; F224-F251 HydrophobicContact CE2-CZ 3.77Å; F224-F251 AromaticContact CZ-CE2 3.84Å; F224-F251 HydrophobicContact CZ-CE2 3.84Å; F224-F251 HydrophobicContact CZ-CZ 4.4Å; P242-F251 HydrophobicContact CB-CB 4.41Å; P242-F251 HydrophobicContact CB-CD2 3.42Å; P242-F251 VanDerWaalsContact CB-CD2 3.42Å; P242-F251 HydrophobicContact CB-CE2 3.75Å; P242-F251 HydrophobicContact CB-CG 3.93Å; P242-F251 HydrophobicContact CB-CZ 4.48Å; P242-F251 HydrophobicContact CG-CD2 4.15Å; P242-F251 HydrophobicContact CG-CE2 4.36Å; P242-F251 HydrophobicContact CG-CG 4.26Å; C248-F251 CarbonylContact O-C 3.32Å; C248-F251 PolarHBondContact O-N 3.25Å; C248-F251 VanDerWaalsContact O-O 3.13Å; A249-F251 VanDerWaalsContact C-N 3.33Å; F251-R253 PolarHBondContact O-N 3.28Å; F251-D256 HydrophobicContact CB-CB 4.19Å; F251-D256 HydrophobicContact CD1-CB 4.06Å; F251-D256 WeakPolarHBondContact CD1-O 3.38Å; F251-K257 HydrophobicContact CB-CD 4.31Å; F251-K257 HydrophobicContact CB-CG 3.71Å; F251-K257 HydrophobicContact CG-CG 4.38Å; F251-K257 WeakPolarHBondContact O-CE 3.46Å; F251-K257 PolarHBondContact O-NZ 3.47Å; F251-Y260 AromaticContact CE1-CE2 3.93Å; F251-Y260 HydrophobicContact CE1-CE2 3.93Å; F251-Y260 HydrophobicContact CZ-CE2 4.12Å; F251-F287 AromaticContact CD1-CE1 3.91Å; F251-F287 HydrophobicContact CD1-CE1 3.91Å; F251-F287 AromaticContact CD1-CZ 3.88Å; F251-F287 HydrophobicContact CD1-CZ 3.88Å; F251-F287 AromaticContact CE1-CE1 3.98Å; F251-F287 HydrophobicContact CE1-CE1 3.98Å; F251-F287 HydrophobicContact CE1-CZ 4.25Å
252	P	94.9	Very high	96	Very high	14 Å²	14	34.8 Å²	34.8	9%	0.091	18%	0.179	C	C	.	.			trans	-72.6	-25.1	-164.1	27.8	-35.5	0	0	0	114	H130 D256 L289 A292 Q293 A296	H130-P252 PolarHBondContact CE1-O 2.86Å; P252-D256 WeakPolarHBondContact CD-OD2 3.49Å; P252-L289 HydrophobicContact CG-CD1 4.46Å; P252-A292 VanDerWaalsContact CG-C 3.5Å; P252-A292 HydrophobicContact CG-CB 3.45Å; P252-A292 VanDerWaalsContact CG-CB 3.45Å; P252-Q293 HydrophobicContact CB-CG 3.99Å; P252-Q293 HydrophobicContact CG-CG 4.07Å; P252-A296 HydrophobicContact CB-CB 4.05Å
253	R	96.3	Very high	96	Very high	52 Å²	52	37.3 Å²	37.3	20%	0.196	19%	0.19	C	C	.	.	S	Bend	trans	-116.2	164.1	-178.4	-49.8	166.6	-68.1	178.2	-3	111.6	H130 F251 Q255 D256 D295 A296	H130-R253 VanDerWaalsContact CE1-C 3.44Å; F251-R253 PolarHBondContact O-N 3.28Å; R253-Q255 VanDerWaalsContact C-N 3.28Å; R253-Q255 HydrophobicContact CB-CG 4.21Å; R253-Q255 VanDerWaalsContact NE-NE2 3.12Å; R253-Q255 PolarHBondContact O-N 3.27Å; R253-D256 WeakPolarHBondContact CA-OD2 3.36Å; R253-D256 WeakPolarHBondContact CB-OD2 3.46Å; R253-D256 WeakPolarHBondContact CG-OD2 3.36Å; R253-D256 IonicContact CZ-OD1 2.83Å; R253-D256 IonicContact CZ-OD2 3.67Å; R253-D256 PolarHBondContact N-OD2 3.37Å; R253-D256 IonicContact NE-OD1 3.8Å; R253-D256 IonicContact NE-OD2 3.51Å; R253-D256 PolarHBondContact NE-OD2 2.75Å; R253-D256 IonicContact NH2-OD1 3.72Å; R253-D256 PolarHBondContact NH2-OD1 2.86Å; R253-D256 IonicContact NH2-OD2 2.95Å; R253-D256 PolarHBondContact O-N 2.84Å; R253-D295 WeakPolarHBondContact CD-OD2 3.18Å; R253-D295 IonicContact CZ-OD2 3.9Å; R253-D295 IonicContact NE-OD2 2.89Å; R253-D295 IonicContact NH1-OD2 3.62Å; R253-D295 PolarHBondContact NH1-OD2 3.03Å; R253-A296 HydrophobicContact CG-CB 3.87Å
254	A	96.3	Very high	96.1	Very high	8 Å²	8	36 Å²	36	7%	0.066	18%	0.181	C	C	.	.	S	Bend	trans	-61.5	-39.5	174	0	0	0	0	0	111.8	H130 K133 C134 M137 D256 K257 V258	H130-A254 HydrophobicContact CB-CB 3.8Å; H130-A254 PolarHBondContact CE1-N 3.21Å; H130-A254 PolarHBondContact ND1-N 2.93Å; K133-A254 HydrophobicContact CB-CB 4.28Å; K133-A254 HydrophobicContact CD-CB 3.8Å; K133-A254 HydrophobicContact CG-CB 3.95Å; C134-A254 PolarHBondContact SG-O 2.78Å; M137-A254 HydrophobicContact SD-CB 4.47Å; A254-D256 PolarHBondContact O-N 3.12Å; A254-K257 PolarHBondContact O-N 3.41Å; A254-V258 PolarHBondContact O-N 3.26Å
255	Q	96.8	Very high	96.2	Very high	54 Å²	54	38.5 Å²	38.5	25%	0.252	19%	0.192	S	C	.	.	H	α-helix	trans	-67	-23.8	179.6	71.9	72.6	59.3	0	0	112.6	M137 R253 K257 V258 Y285	M137-Q255 HydrophobicContact CE-CB 3.86Å; R253-Q255 VanDerWaalsContact C-N 3.28Å; R253-Q255 HydrophobicContact CB-CG 4.21Å; R253-Q255 VanDerWaalsContact NE-NE2 3.12Å; R253-Q255 PolarHBondContact O-N 3.27Å; Q255-K257 PolarHBondContact O-N 3.47Å; Q255-V258 WeakPolarHBondContact O-CG1 3.48Å; Q255-Y285 PolarHBondContact NE2-OH 3.36Å; Q255-Y285 PolarHBondContact OE1-OH 2.98Å
256	D	97.4	Very high	96.3	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-73.4	-12.7	177.1	-55.8	-66.2	0	0	0	111	F251 P252 R253 A254 Y285 F287	F251-D256 HydrophobicContact CB-CB 4.19Å; F251-D256 HydrophobicContact CD1-CB 4.06Å; F251-D256 WeakPolarHBondContact CD1-O 3.38Å; P252-D256 WeakPolarHBondContact CD-OD2 3.49Å; R253-D256 WeakPolarHBondContact CA-OD2 3.36Å; R253-D256 WeakPolarHBondContact CB-OD2 3.46Å; R253-D256 WeakPolarHBondContact CG-OD2 3.36Å; R253-D256 IonicContact CZ-OD1 2.83Å; R253-D256 IonicContact CZ-OD2 3.67Å; R253-D256 PolarHBondContact N-OD2 3.37Å; R253-D256 IonicContact NE-OD1 3.8Å; R253-D256 IonicContact NE-OD2 3.51Å; R253-D256 PolarHBondContact NE-OD2 2.75Å; R253-D256 IonicContact NH2-OD1 3.72Å; R253-D256 PolarHBondContact NH2-OD1 2.86Å; R253-D256 IonicContact NH2-OD2 2.95Å; R253-D256 PolarHBondContact O-N 2.84Å; A254-D256 PolarHBondContact O-N 3.12Å; D256-Y285 HydrophobicContact CB-CE1 4.34Å; D256-Y285 PolarHBondContact OD1-OH 3.5Å; D256-F287 HydrophobicContact CB-CD1 4.44Å; D256-F287 HydrophobicContact CB-CE1 4.06Å; D256-F287 HydrophobicContact CB-CE2 4.32Å; D256-F287 HydrophobicContact CB-CZ 3.99Å; D256-F287 WeakPolarHBondContact OD1-CD2 2.88Å; D256-F287 VanDerWaalsContact OD1-CG 3.25Å; D256-F287 WeakPolarHBondContact OD1-CG 3.33Å
257	K	98.3	Very high	96.6	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-109.3	-18.9	-176.4	-56.6	178.2	-168.6	177.4	0	113	H130 P242 S243 S244 S245 F251 A254 Q255 H259 Y260	H130-K257 WeakPolarHBondContact ND1-CE 3.19Å; H130-K257 PolarHBondContact ND1-NZ 3.17Å; H130-K257 VanDerWaalsContact ND1-NZ 3.17Å; P242-K257 HydrophobicContact CB-CG 4.46Å; P242-K257 HydrophobicContact CG-CB 4.12Å; P242-K257 HydrophobicContact CG-CD 4.48Å; P242-K257 HydrophobicContact CG-CG 3.92Å; S243-K257 WeakPolarHBondContact O-CE 3.33Å; S243-K257 PolarHBondContact O-NZ 3.13Å; S244-K257 PolarHBondContact O-NZ 3.1Å; S245-K257 PolarHBondContact O-NZ 3.23Å; F251-K257 HydrophobicContact CB-CD 4.31Å; F251-K257 HydrophobicContact CB-CG 3.71Å; F251-K257 HydrophobicContact CG-CG 4.38Å; F251-K257 WeakPolarHBondContact O-CE 3.46Å; F251-K257 PolarHBondContact O-NZ 3.47Å; A254-K257 PolarHBondContact O-N 3.41Å; Q255-K257 PolarHBondContact O-N 3.47Å; K257-H259 PolarHBondContact O-N 3.2Å; K257-Y260 PolarHBondContact O-N 3.29Å; K257-Y260 VanDerWaalsContact O-N 3.14Å
258	V	98.3	Very high	96.9	Very high	13 Å²	13	31.4 Å²	31.4	8%	0.079	16%	0.157	C	C	.	.	H	α-helix	trans	-60.1	-33	-170.8	74.3	0	0	0	0	112.3	M137 A254 Q255 Y260 Y261 I262	M137-V258 HydrophobicContact CB-CG2 3.62Å; A254-V258 PolarHBondContact O-N 3.26Å; Q255-V258 WeakPolarHBondContact O-CG1 3.48Å; V258-Y260 PolarHBondContact O-N 3.06Å; V258-Y260 VanDerWaalsContact O-N 3.16Å; V258-Y261 WeakPolarHBondContact O-CA 3.39Å; V258-Y261 WeakPolarHBondContact O-CB 3.39Å; V258-Y261 PolarHBondContact O-N 3.42Å; V258-I262 HydrophobicContact CG1-CD1 4.35Å; V258-I262 HydrophobicContact CG2-CD1 4.14Å; V258-I262 HydrophobicContact CG2-CG1 4.32Å; V258-I262 PolarHBondContact O-N 3.21Å
259	H	98.4	Very high	97.2	Very high	27 Å²	27	31.2 Å²	31.2	13%	0.125	16%	0.155	C	C	.	.	H	α-helix	trans	-47.1	-46.3	175	-179.6	68.8	0	0	0	112.8	K257 Y261 I262 K263 E282 Y285	K257-H259 PolarHBondContact O-N 3.2Å; H259-Y261 VanDerWaalsContact C-N 3.32Å; H259-Y261 PolarHBondContact O-N 3.27Å; H259-I262 PolarHBondContact O-N 3.26Å; H259-K263 WeakPolarHBondContact O-CG 3.39Å; H259-K263 PolarHBondContact O-N 2.58Å; H259-E282 VanDerWaalsContact CA-OE1 3.3Å; H259-E282 WeakPolarHBondContact CA-OE1 3.28Å; H259-E282 VanDerWaalsContact CB-OE1 3.29Å; H259-E282 WeakPolarHBondContact CB-OE1 3.41Å; H259-E282 IonicContact CE1-OE1 3.44Å; H259-E282 IonicContact CG-OE1 3.8Å; H259-E282 IonicContact ND1-OE1 3.89Å; H259-E282 PolarHBondContact ND1-OE1 3.04Å; H259-Y285 HydrophobicContact CB-CG 4.39Å
260	Y	98.6	Very high	97.4	Very high	42 Å²	42	35.1 Å²	35.1	17%	0.165	16%	0.163	C	C	.	.	H	α-helix	trans	-71.7	-27.3	-178.1	-59	-73.5	0	0	0	113.2	F224 Y239 P242 F251 K257 V258 L264	F224-Y260 HydrophobicContact CB-CD1 3.75Å; F224-Y260 HydrophobicContact CB-CE1 3.22Å; F224-Y260 HydrophobicContact CD2-CE1 4.05Å; F224-Y260 AromaticContact CD2-CZ 3.72Å; F224-Y260 WeakPolarHBondContact CD2-OH 3.4Å; F224-Y260 HydrophobicContact CG-CD1 4.44Å; F224-Y260 AromaticContact CG-CE1 3.81Å; F224-Y260 HydrophobicContact CG-CE1 3.81Å; F224-Y260 AromaticContact CG-CZ 3.91Å; Y239-Y260 WeakPolarHBondContact CE1-O 3.37Å; Y239-Y260 PolarHBondContact OH-O 3.05Å; P242-Y260 HydrophobicContact CG-CD2 3.48Å; P242-Y260 VanDerWaalsContact CG-CD2 3.48Å; P242-Y260 HydrophobicContact CG-CE2 3.68Å; P242-Y260 HydrophobicContact CG-CG 4.36Å; F251-Y260 AromaticContact CE1-CE2 3.93Å; F251-Y260 HydrophobicContact CE1-CE2 3.93Å; F251-Y260 HydrophobicContact CZ-CE2 4.12Å; K257-Y260 PolarHBondContact O-N 3.29Å; K257-Y260 VanDerWaalsContact O-N 3.14Å; V258-Y260 PolarHBondContact O-N 3.06Å; V258-Y260 VanDerWaalsContact O-N 3.16Å; Y260-L264 VanDerWaalsContact O-CB 3.31Å; Y260-L264 WeakPolarHBondContact O-CB 3.25Å; Y260-L264 PolarHBondContact O-N 3.29Å
261	Y	98.8	Very high	97.6	Very high	1 Å²	1	32.2 Å²	32.2	0%	0.004	15%	0.151	C	C	.	.	H	α-helix	trans	-76.2	-37.3	173.6	-75.6	-109.3	0	0	0	110.9	F131 C134 S138 L140 M241 V258 H259 L264 K265	F131-Y261 HydrophobicContact CD2-CE1 4.11Å; F131-Y261 WeakPolarHBondContact CD2-OH 3.08Å; F131-Y261 HydrophobicContact CE2-CE1 4.12Å; C134-Y261 HydrophobicContact CB-CD1 4.04Å; C134-Y261 HydrophobicContact CB-CD2 3.73Å; C134-Y261 HydrophobicContact CB-CE1 4Å; C134-Y261 HydrophobicContact CB-CE2 3.7Å; C134-Y261 HydrophobicContact CB-CG 3.92Å; S138-Y261 VanDerWaalsContact CB-CB 3.46Å; S138-Y261 WeakPolarHBondContact OG-CB 3.39Å; L140-Y261 HydrophobicContact CD1-CD1 3.92Å; M241-Y261 HydrophobicContact CE-CD1 4.26Å; M241-Y261 HydrophobicContact CE-CD2 4.01Å; M241-Y261 HydrophobicContact CE-CE1 3.82Å; M241-Y261 HydrophobicContact CE-CE2 3.52Å; M241-Y261 HydrophobicContact CE-CG 4.34Å; M241-Y261 VanDerWaalsContact CE-CZ 3.41Å; M241-Y261 HydrophobicContact SD-CD2 3.69Å; M241-Y261 HydrophobicContact SD-CE2 3.76Å; M241-Y261 HydrophobicContact SD-CG 4.09Å; V258-Y261 WeakPolarHBondContact O-CA 3.39Å; V258-Y261 WeakPolarHBondContact O-CB 3.39Å; V258-Y261 PolarHBondContact O-N 3.42Å; H259-Y261 VanDerWaalsContact C-N 3.32Å; H259-Y261 PolarHBondContact O-N 3.27Å; Y261-L264 WeakPolarHBondContact O-CB 3.04Å; Y261-L264 PolarHBondContact O-N 3.32Å; Y261-K265 PolarHBondContact O-N 3.18Å
262	I	98.3	Very high	97.6	Very high	25 Å²	25	35.5 Å²	35.5	13%	0.128	17%	0.165	C	C	.	.	H	α-helix	trans	-61.4	-48.8	172.3	-66.6	166.8	0	0	0	109.3	V258 H259 L264 K265 D266 E282	V258-I262 HydrophobicContact CG1-CD1 4.35Å; V258-I262 HydrophobicContact CG2-CD1 4.14Å; V258-I262 HydrophobicContact CG2-CG1 4.32Å; V258-I262 PolarHBondContact O-N 3.21Å; H259-I262 PolarHBondContact O-N 3.26Å; I262-L264 VanDerWaalsContact C-N 3.27Å; I262-L264 PolarHBondContact O-N 3.49Å; I262-K265 WeakPolarHBondContact O-CB 3.19Å; I262-K265 PolarHBondContact O-N 3.31Å; I262-K265 VanDerWaalsContact O-N 3.13Å; I262-D266 VanDerWaalsContact O-CG 3.27Å; I262-D266 PolarHBondContact O-N 3.11Å; I262-E282 WeakPolarHBondContact CD1-OE2 3.36Å; I262-E282 HydrophobicContact CG2-CB 4.42Å
263	K	98.4	Very high	97.6	Very high	56 Å²	56	38 Å²	38	24%	0.243	19%	0.194	C	C	.	.	H	α-helix	trans	-65	-28.8	176.6	-68.4	-69.9	157.4	-141.7	0	113.7	Y239 H259 D266 L267 E282	Y239-K263 WeakPolarHBondContact OH-CB 3.48Å; H259-K263 WeakPolarHBondContact O-CG 3.39Å; H259-K263 PolarHBondContact O-N 2.58Å; K263-D266 IonicContact NZ-OD2 3.73Å; K263-D266 PolarHBondContact NZ-OD2 3.25Å; K263-D266 CarbonylContact O-C 3.53Å; K263-D266 WeakPolarHBondContact O-CB 3.16Å; K263-D266 PolarHBondContact O-N 2.93Å; K263-L267 PolarHBondContact O-N 2.79Å; K263-E282 WeakPolarHBondContact CE-O 3.5Å; K263-E282 PolarHBondContact NZ-O 2.84Å
264	L	98.7	Very high	97.4	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.005	20%	0.204	C	C	.	.	H	α-helix	trans	-69.1	-43.8	171.6	175.2	61.4	0	0	0	111.7	I106 L140 I198 V200 Y239 M241 Y260 Y261 I262 D266 L267 R268	I106-L264 HydrophobicContact CD1-CD1 4.11Å; I106-L264 HydrophobicContact CD1-CD2 4.05Å; I106-L264 HydrophobicContact CD1-CG 3.91Å; I106-L264 HydrophobicContact CG1-CD1 4.3Å; L140-L264 HydrophobicContact CD1-CD2 4.34Å; I198-L264 HydrophobicContact CD1-CD1 3.93Å; I198-L264 HydrophobicContact CG2-CD1 4.07Å; V200-L264 HydrophobicContact CG1-CD2 4.07Å; V200-L264 HydrophobicContact CG2-CD1 3.6Å; V200-L264 HydrophobicContact CG2-CD2 3.82Å; V200-L264 HydrophobicContact CG2-CG 4.37Å; Y239-L264 HydrophobicContact CD1-CB 4.37Å; Y239-L264 HydrophobicContact CD1-CD1 4.02Å; Y239-L264 HydrophobicContact CE1-CB 3.82Å; Y239-L264 HydrophobicContact CE1-CD1 4.31Å; Y239-L264 HydrophobicContact CG-CD1 4.17Å; Y239-L264 PolarHBondContact OH-N 3.18Å; M241-L264 HydrophobicContact CE-CD2 4.31Å; M241-L264 HydrophobicContact SD-CD2 4.24Å; Y260-L264 VanDerWaalsContact O-CB 3.31Å; Y260-L264 WeakPolarHBondContact O-CB 3.25Å; Y260-L264 PolarHBondContact O-N 3.29Å; Y261-L264 WeakPolarHBondContact O-CB 3.04Å; Y261-L264 PolarHBondContact O-N 3.32Å; I262-L264 VanDerWaalsContact C-N 3.27Å; I262-L264 PolarHBondContact O-N 3.49Å; L264-D266 PolarHBondContact O-N 2.87Å; L264-L267 PolarHBondContact O-N 3.19Å; L264-L267 VanDerWaalsContact O-N 3.15Å; L264-R268 WeakPolarHBondContact O-CB 3.24Å; L264-R268 PolarHBondContact O-N 3.38Å
265	K	98.2	Very high	96.8	Very high	54 Å²	54	48 Å²	48	24%	0.235	24%	0.243	C	C	.	.	H	α-helix	trans	-57.5	-43.3	170	-166.3	-176	75.9	-170.9	0	109.8	S138 G139 L140 Y261 I262 L267 R268 D269 R276	S138-K265 PolarHBondContact O-NZ 2.82Å; G139-K265 WeakPolarHBondContact O-CD 3.29Å; L140-K265 HydrophobicContact CD2-CB 3.76Å; L140-K265 HydrophobicContact CD2-CG 3.9Å; L140-K265 HydrophobicContact CG-CB 4Å; L140-K265 HydrophobicContact CG-CG 4.32Å; Y261-K265 PolarHBondContact O-N 3.18Å; I262-K265 WeakPolarHBondContact O-CB 3.19Å; I262-K265 PolarHBondContact O-N 3.31Å; I262-K265 VanDerWaalsContact O-N 3.13Å; K265-L267 VanDerWaalsContact C-N 3.25Å; K265-L267 PolarHBondContact O-N 3.23Å; K265-R268 PolarHBondContact O-N 2.95Å; K265-D269 PolarHBondContact O-N 3.35Å; K265-R276 PolarHBondContact O-NH2 2.87Å
266	D	97	Very high	96	Very high	36 Å²	36	49.6 Å²	49.6	19%	0.193	25%	0.247	C	C	.	.	H	α-helix	trans	-62	-31.3	177.3	-65.9	-15.4	0	0	0	112.8	I262 K263 L264 R276	I262-D266 VanDerWaalsContact O-CG 3.27Å; I262-D266 PolarHBondContact O-N 3.11Å; K263-D266 IonicContact NZ-OD2 3.73Å; K263-D266 PolarHBondContact NZ-OD2 3.25Å; K263-D266 CarbonylContact O-C 3.53Å; K263-D266 WeakPolarHBondContact O-CB 3.16Å; K263-D266 PolarHBondContact O-N 2.93Å; L264-D266 PolarHBondContact O-N 2.87Å; D266-R276 VanDerWaalsContact C-CZ 3.46Å; D266-R276 VanDerWaalsContact CA-NH1 3.32Å; D266-R276 PolarHBondContact O-NH1 3.38Å; D266-R276 PolarHBondContact O-NH2 2.95Å; D266-R276 IonicContact OD1-CZ 2.78Å; D266-R276 IonicContact OD1-NE 2.93Å
267	L	98.2	Very high	95	Very high	18 Å²	18	53.5 Å²	53.5	9%	0.094	27%	0.274	C	S	.	.	H	α-helix	trans	-77	-43.4	172.2	-178.9	58.4	0	0	0	111.1	I198 L226 L237 Y239 K263 L264 K265 Q270 L271	I198-L267 HydrophobicContact CD1-CB 4.29Å; I198-L267 HydrophobicContact CD1-CD2 3.88Å; I198-L267 HydrophobicContact CD1-CG 3.81Å; I198-L267 HydrophobicContact CG1-CD2 4.37Å; I198-L267 HydrophobicContact CG2-CD2 4.4Å; L226-L267 HydrophobicContact CD1-CD2 3.97Å; L226-L267 HydrophobicContact CD2-CD1 4.48Å; L237-L267 HydrophobicContact CD1-CD1 4.19Å; L237-L267 HydrophobicContact CD1-CD2 4.21Å; L237-L267 HydrophobicContact CD1-CG 4.5Å; Y239-L267 HydrophobicContact CD2-CD2 3.93Å; K263-L267 PolarHBondContact O-N 2.79Å; L264-L267 PolarHBondContact O-N 3.19Å; L264-L267 VanDerWaalsContact O-N 3.15Å; K265-L267 VanDerWaalsContact C-N 3.25Å; K265-L267 PolarHBondContact O-N 3.23Å; L267-Q270 PolarHBondContact O-N 3.12Å; L267-L271 HydrophobicContact CD1-CD1 4.39Å; L267-L271 HydrophobicContact CD1-CG 4.4Å; L267-L271 HydrophobicContact CG-CD1 4.28Å; L267-L271 WeakPolarHBondContact O-CG 3.49Å; L267-L271 PolarHBondContact O-N 3.5Å; L267-L271 VanDerWaalsContact O-N 3.12Å
268	R	98.4	Very high	94.1	Very high	33 Å²	33	58.2 Å²	58.2	13%	0.125	30%	0.303	C	S	.	.	H	α-helix	trans	-60.6	-52.6	-176.2	-166.9	-74.7	-57.1	-94.8	-3.1	111.9	D105 I106 I198 L264 K265 Q270 L271 K272	D105-R268 HydrophobicContact CB-CG 3.9Å; D105-R268 IonicContact OD2-NH1 3.51Å; I106-R268 HydrophobicContact CD1-CB 4.25Å; I106-R268 HydrophobicContact CD1-CG 3.98Å; I106-R268 HydrophobicContact CG1-CG 4.35Å; I198-R268 HydrophobicContact CD1-CB 4.27Å; L264-R268 WeakPolarHBondContact O-CB 3.24Å; L264-R268 PolarHBondContact O-N 3.38Å; K265-R268 PolarHBondContact O-N 2.95Å; R268-Q270 VanDerWaalsContact C-N 3.27Å; R268-Q270 PolarHBondContact O-N 3.34Å; R268-L271 PolarHBondContact O-N 3.31Å; R268-K272 PolarHBondContact O-N 3.46Å; R268-K272 VanDerWaalsContact O-N 3.16Å
269	D	97.2	Very high	93.5	Very high	12 Å²	12	64.2 Å²	64.2	6%	0.064	34%	0.335	C	S	.	.	H	α-helix	trans	-69.4	-28.4	-175.4	-23.3	-55.4	0	0	0	112	K265 K272 G273 I274 R276	K265-D269 PolarHBondContact O-N 3.35Å; D269-K272 CarbonylContact O-C 3.51Å; D269-K272 PolarHBondContact O-N 2.99Å; D269-G273 PolarHBondContact O-N 2.95Å; D269-I274 HydrophobicContact CB-CB 3.77Å; D269-I274 HydrophobicContact CB-CD1 4.13Å; D269-I274 HydrophobicContact CB-CG1 4.45Å; D269-I274 HydrophobicContact CB-CG2 4.15Å; D269-I274 PolarHBondContact O-N 3Å; D269-R276 VanDerWaalsContact CA-NH2 3.31Å; D269-R276 VanDerWaalsContact CG-NH2 3.29Å; D269-R276 IonicContact OD2-CZ 3.86Å; D269-R276 IonicContact OD2-NE 3.96Å; D269-R276 PolarHBondContact OD2-NE 3.36Å; D269-R276 IonicContact OD2-NH2 2.63Å; D269-R276 PolarHBondContact OD2-NH2 3.41Å
270	Q	96.6	Very high	92.8	Very high	139 Å²	139	69.3 Å²	69.3	65%	0.65	37%	0.367	S	S	*	.	H	α-helix	trans	-62.8	-45.8	172.1	179.6	-174.6	-26.1	0	0	110.8	L267 R268 K272 G273	L267-Q270 PolarHBondContact O-N 3.12Å; R268-Q270 VanDerWaalsContact C-N 3.27Å; R268-Q270 PolarHBondContact O-N 3.34Å; Q270-K272 PolarHBondContact O-N 2.82Å; Q270-G273 PolarHBondContact O-N 2.83Å
271	L	97.1	Very high	92.2	Very high	66 Å²	66	73 Å²	73	35%	0.346	39%	0.386	S	S	.	.	H	α-helix	trans	-66.8	-20.7	177.2	-65.7	175.5	0	0	0	113.3	R197 I198 L237 L267 R268	R197-L271 HydrophobicContact CB-CD1 4.26Å; I198-L271 HydrophobicContact CD1-CD1 3.98Å; I198-L271 HydrophobicContact CG1-CD1 3.84Å; L237-L271 HydrophobicContact CD1-CD1 3.84Å; L237-L271 HydrophobicContact CD1-CD2 4.33Å; L267-L271 HydrophobicContact CD1-CD1 4.39Å; L267-L271 HydrophobicContact CD1-CG 4.4Å; L267-L271 HydrophobicContact CG-CD1 4.28Å; L267-L271 WeakPolarHBondContact O-CG 3.49Å; L267-L271 PolarHBondContact O-N 3.5Å; L267-L271 VanDerWaalsContact O-N 3.12Å; R268-L271 PolarHBondContact O-N 3.31Å
272	K	96.6	Very high	91.7	Very high	95 Å²	95	76 Å²	76	41%	0.413	40%	0.4	S	S	.	.	H	α-helix	trans	-95.1	-5.3	176.2	-66.7	-176.9	78.7	162.6	0	113.6	D105 R268 D269 Q270 I274	D105-K272 IonicContact OD1-NZ 3.99Å; D105-K272 WeakPolarHBondContact OD2-CD 3.38Å; D105-K272 WeakPolarHBondContact OD2-CE 3.19Å; D105-K272 IonicContact OD2-NZ 2.71Å; D105-K272 PolarHBondContact OD2-NZ 3.49Å; R268-K272 PolarHBondContact O-N 3.46Å; R268-K272 VanDerWaalsContact O-N 3.16Å; D269-K272 CarbonylContact O-C 3.51Å; D269-K272 PolarHBondContact O-N 2.99Å; Q270-K272 PolarHBondContact O-N 2.82Å; K272-I274 HydrophobicContact CB-CD1 3.78Å; K272-I274 HydrophobicContact CB-CG1 3.85Å; K272-I274 HydrophobicContact CD-CD1 4Å; K272-I274 PolarHBondContact O-N 3.48Å
273	G	95	Very high	91.3	Very high	67 Å²	67	80.6 Å²	80.6	69%	0.691	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.4	26.8	-175.1	0	0	0	0	0	113.5	D269 Q270	D269-G273 PolarHBondContact O-N 2.95Å; Q270-G273 PolarHBondContact O-N 2.83Å
274	I	92.3	Very high	90.9	Very high	80 Å²	80	85 Å²	85	41%	0.41	45%	0.451	S	S	.	.			trans	-80.9	124.1	175.9	-63.1	166.3	0	0	0	107.5	D269 K272	D269-I274 HydrophobicContact CB-CB 3.77Å; D269-I274 HydrophobicContact CB-CD1 4.13Å; D269-I274 HydrophobicContact CB-CG1 4.45Å; D269-I274 HydrophobicContact CB-CG2 4.15Å; D269-I274 PolarHBondContact O-N 3Å; K272-I274 HydrophobicContact CB-CD1 3.78Å; K272-I274 HydrophobicContact CB-CG1 3.85Å; K272-I274 HydrophobicContact CD-CD1 4Å; K272-I274 PolarHBondContact O-N 3.48Å
275	E	85.2	Confident	90.7	Very high	190 Å²	190	88 Å²	88	89%	0.888	46%	0.463	S	S	*	.			trans	-64.7	137.5	175.8	-73.5	-170.7	162.2	0	0	111.4
276	R	78.2	Confident	90.5	Very high	86 Å²	86	90.7 Å²	90.7	33%	0.325	48%	0.483	S	S	.	.			trans	-105.8	140.8	175.8	-66.1	-165.1	179.2	113.3	20.9	110.6	K265 D266 D269 T278	K265-R276 PolarHBondContact O-NH2 2.87Å; D266-R276 VanDerWaalsContact C-CZ 3.46Å; D266-R276 VanDerWaalsContact CA-NH1 3.32Å; D266-R276 PolarHBondContact O-NH1 3.38Å; D266-R276 PolarHBondContact O-NH2 2.95Å; D266-R276 IonicContact OD1-CZ 2.78Å; D266-R276 IonicContact OD1-NE 2.93Å; D269-R276 VanDerWaalsContact CA-NH2 3.31Å; D269-R276 VanDerWaalsContact CG-NH2 3.29Å; D269-R276 IonicContact OD2-CZ 3.86Å; D269-R276 IonicContact OD2-NE 3.96Å; D269-R276 PolarHBondContact OD2-NE 3.36Å; D269-R276 IonicContact OD2-NH2 2.63Å; D269-R276 PolarHBondContact OD2-NH2 3.41Å; R276-T278 PolarHBondContact O-N 3.02Å
277	S	78.2	Confident	90.5	Very high	82 Å²	82	92 Å²	92	57%	0.573	49%	0.487	S	S	*	.			trans	-63	122.2	157.3	161.6	0	0	0	0	107.8	D279	S277-D279 VanDerWaalsContact C-N 3.27Å; S277-D279 WeakPolarHBondContact OG-CB 3.49Å; S277-D279 PolarHBondContact OG-N 3.44Å; S277-D279 PolarHBondContact OG-OD2 3.03Å
278	T	78.9	Confident	90.4	Very high	99 Å²	99	95.7 Å²	95.7	61%	0.607	51%	0.507	S	S	*	.			trans	-88.4	3.9	177.6	47.8	0	0	0	0	112.7	R276 V280 Q281	R276-T278 PolarHBondContact O-N 3.02Å; T278-V280 PolarHBondContact O-N 3.02Å; T278-Q281 PolarHBondContact O-NE2 3.06Å
279	D	84.4	Confident	90.3	Very high	139 Å²	139	97.8 Å²	97.8	74%	0.743	52%	0.52	S	S	*	.	S	Bend	trans	-65.8	-38.6	-169	-56.6	-34.3	0	0	0	112.4	S277	S277-D279 VanDerWaalsContact C-N 3.27Å; S277-D279 WeakPolarHBondContact OG-CB 3.49Å; S277-D279 PolarHBondContact OG-N 3.44Å; S277-D279 PolarHBondContact OG-OD2 3.03Å
280	V	84.8	Confident	90.2	Very high	134 Å²	134	104 Å²	104	81%	0.812	55%	0.549	S	S	*	.	S	Bend	trans	-135.1	119.4	176.5	-177.1	0	0	0	0	109.1	T278	T278-V280 PolarHBondContact O-N 3.02Å
281	Q	86.1	Confident	90.2	Very high	121 Å²	121	102.5 Å²	102.5	57%	0.565	55%	0.545	S	S	*	.			trans	-127.1	123.5	179.3	-66.7	178.6	47.7	0	0	110.3	T278 V283	T278-Q281 PolarHBondContact O-NE2 3.06Å; Q281-V283 PolarHBondContact O-N 3.26Å
282	E	88.5	Confident	90.1	Very high	62 Å²	62	99.4 Å²	99.4	29%	0.29	53%	0.529	S	S	.	.			trans	-74.1	110.1	171.3	-170.6	176.8	127.5	0	0	109.1	H259 I262 K263	H259-E282 VanDerWaalsContact CA-OE1 3.3Å; H259-E282 WeakPolarHBondContact CA-OE1 3.28Å; H259-E282 VanDerWaalsContact CB-OE1 3.29Å; H259-E282 WeakPolarHBondContact CB-OE1 3.41Å; H259-E282 IonicContact CE1-OE1 3.44Å; H259-E282 IonicContact CG-OE1 3.8Å; H259-E282 IonicContact ND1-OE1 3.89Å; H259-E282 PolarHBondContact ND1-OE1 3.04Å; I262-E282 WeakPolarHBondContact CD1-OE2 3.36Å; I262-E282 HydrophobicContact CG2-CB 4.42Å; K263-E282 WeakPolarHBondContact CE-O 3.5Å; K263-E282 PolarHBondContact NZ-O 2.84Å
283	V	88.4	Confident	89.9	Confident	122 Å²	122	98.1 Å²	98.1	74%	0.739	53%	0.525	S	S	*	.			trans	-91.9	-43.3	-177.6	-67.9	0	0	0	0	112.5	Q281	Q281-V283 PolarHBondContact O-N 3.26Å
284	Q	90.1	Very high	89.9	Confident	150 Å²	150	100.5 Å²	100.5	70%	0.701	52%	0.518	S	S	*	.			trans	-149.5	145.2	-175.3	-174	176.5	4.2	0	0	109.8	T286	Q284-T286 HydrophobicContact CG-CG2 4.26Å
285	Y	94.7	Very high	89.9	Confident	64 Å²	64	98.4 Å²	98.4	25%	0.251	51%	0.507	S	S	.	.			trans	-126.2	129.7	174.4	177.9	-93.2	0	0	0	110.1	Q255 D256 H259 F287	Q255-Y285 PolarHBondContact NE2-OH 3.36Å; Q255-Y285 PolarHBondContact OE1-OH 2.98Å; D256-Y285 HydrophobicContact CB-CE1 4.34Å; D256-Y285 PolarHBondContact OD1-OH 3.5Å; H259-Y285 HydrophobicContact CB-CG 4.39Å; Y285-F287 HydrophobicContact CD1-CD1 4.03Å; Y285-F287 HydrophobicContact CE1-CB 4.07Å; Y285-F287 AromaticContact CE1-CD1 3.33Å; Y285-F287 HydrophobicContact CE1-CD1 3.33Å; Y285-F287 HydrophobicContact CE1-CE1 4.03Å; Y285-F287 AromaticContact CE1-CG 3.99Å; Y285-F287 HydrophobicContact CE1-CG 3.99Å
286	T	94.7	Very high	90.1	Very high	109 Å²	109	90.5 Å²	90.5	67%	0.669	47%	0.474	S	S	*	.			trans	-136.5	146.2	178.1	57.1	0	0	0	0	110.1	Q284	Q284-T286 HydrophobicContact CG-CG2 4.26Å
287	F	96.1	Very high	90.7	Very high	63 Å²	63	92.2 Å²	92.2	28%	0.276	48%	0.484	S	S	.	.			trans	-151	158.1	-179.1	66	-78.3	0	0	0	111.4	Q250 F251 D256 Y285 L289 A292	Q250-F287 WeakPolarHBondContact O-CZ 3.43Å; F251-F287 AromaticContact CD1-CE1 3.91Å; F251-F287 HydrophobicContact CD1-CE1 3.91Å; F251-F287 AromaticContact CD1-CZ 3.88Å; F251-F287 HydrophobicContact CD1-CZ 3.88Å; F251-F287 AromaticContact CE1-CE1 3.98Å; F251-F287 HydrophobicContact CE1-CE1 3.98Å; F251-F287 HydrophobicContact CE1-CZ 4.25Å; D256-F287 HydrophobicContact CB-CD1 4.44Å; D256-F287 HydrophobicContact CB-CE1 4.06Å; D256-F287 HydrophobicContact CB-CE2 4.32Å; D256-F287 HydrophobicContact CB-CZ 3.99Å; D256-F287 WeakPolarHBondContact OD1-CD2 2.88Å; D256-F287 VanDerWaalsContact OD1-CG 3.25Å; D256-F287 WeakPolarHBondContact OD1-CG 3.33Å; Y285-F287 HydrophobicContact CD1-CD1 4.03Å; Y285-F287 HydrophobicContact CE1-CB 4.07Å; Y285-F287 AromaticContact CE1-CD1 3.33Å; Y285-F287 HydrophobicContact CE1-CD1 3.33Å; Y285-F287 HydrophobicContact CE1-CE1 4.03Å; Y285-F287 AromaticContact CE1-CG 3.99Å; Y285-F287 HydrophobicContact CE1-CG 3.99Å; F287-L289 HydrophobicContact CE2-CD1 3.95Å; F287-A292 HydrophobicContact CD2-CB 3.65Å; F287-A292 HydrophobicContact CE2-CB 4.02Å
288	D	96.9	Very high	91.2	Very high	97 Å²	97	94.6 Å²	94.6	52%	0.519	48%	0.481	S	S	.	.			trans	-81.7	122.8	169	-175.2	-69.3	0	0	0	110.1	Q290 L291 A292	D288-Q290 WeakPolarHBondContact OD1-CA 3.48Å; D288-Q290 WeakPolarHBondContact OD1-CB 3.37Å; D288-Q290 PolarHBondContact OD1-N 2.94Å; D288-L291 HydrophobicContact CB-CB 4.09Å; D288-L291 PolarHBondContact OD1-N 2.91Å; D288-A292 WeakPolarHBondContact O-CB 3.42Å; D288-A292 PolarHBondContact O-N 3.45Å
289	L	95.9	Very high	91.4	Very high	76 Å²	76	92.3 Å²	92.3	40%	0.398	47%	0.467	S	S	.	.	H	α-helix	trans	-66.7	-39.9	-175	-178	61	0	0	0	112.9	A249 P252 F287 A292 Q293	A249-L289 WeakPolarHBondContact O-CD1 3.23Å; P252-L289 HydrophobicContact CG-CD1 4.46Å; F287-L289 HydrophobicContact CE2-CD1 3.95Å; L289-A292 PolarHBondContact O-N 3.35Å; L289-Q293 HydrophobicContact CD1-CG 4.38Å; L289-Q293 WeakPolarHBondContact O-CB 3.3Å; L289-Q293 VanDerWaalsContact O-CG 3.24Å; L289-Q293 WeakPolarHBondContact O-CG 3.34Å; L289-Q293 PolarHBondContact O-N 2.65Å
290	Q	95.6	Very high	91.4	Very high	143 Å²	143	88.2 Å²	88.2	67%	0.668	45%	0.452	S	S	*	.	H	α-helix	trans	-68.4	-47.7	-177.2	-66.9	-176.9	-9.9	0	0	109.8	D288 A292 Q293 E294	D288-Q290 WeakPolarHBondContact OD1-CA 3.48Å; D288-Q290 WeakPolarHBondContact OD1-CB 3.37Å; D288-Q290 PolarHBondContact OD1-N 2.94Å; Q290-A292 VanDerWaalsContact C-N 3.29Å; Q290-A292 PolarHBondContact O-N 3.41Å; Q290-Q293 PolarHBondContact O-N 2.99Å; Q290-Q293 VanDerWaalsContact O-N 3.15Å; Q290-E294 WeakPolarHBondContact O-CG 3.14Å; Q290-E294 PolarHBondContact O-N 3.15Å
291	L	95.9	Very high	90.9	Very high	108 Å²	108	85.1 Å²	85.1	57%	0.565	43%	0.433	S	S	*	.	H	α-helix	trans	-62.4	-38.9	178.2	-169.8	63.9	0	0	0	111.6	D288 E294 D295	D288-L291 HydrophobicContact CB-CB 4.09Å; D288-L291 PolarHBondContact OD1-N 2.91Å; L291-E294 PolarHBondContact O-N 3.36Å; L291-D295 VanDerWaalsContact O-CB 3.32Å; L291-D295 WeakPolarHBondContact O-CB 3.35Å; L291-D295 PolarHBondContact O-N 3.28Å
292	A	95.2	Very high	90.3	Very high	1 Å²	1	86 Å²	86	1%	0.008	44%	0.435	C	S	.	.	H	α-helix	trans	-66.7	-36	176.9	0	0	0	0	0	112.7	P252 F287 D288 L289 Q290 A296	P252-A292 VanDerWaalsContact CG-C 3.5Å; P252-A292 HydrophobicContact CG-CB 3.45Å; P252-A292 VanDerWaalsContact CG-CB 3.45Å; F287-A292 HydrophobicContact CD2-CB 3.65Å; F287-A292 HydrophobicContact CE2-CB 4.02Å; D288-A292 WeakPolarHBondContact O-CB 3.42Å; D288-A292 PolarHBondContact O-N 3.45Å; L289-A292 PolarHBondContact O-N 3.35Å; Q290-A292 VanDerWaalsContact C-N 3.29Å; Q290-A292 PolarHBondContact O-N 3.41Å; A292-A296 WeakPolarHBondContact O-CB 3.32Å; A292-A296 PolarHBondContact O-N 3.19Å
293	Q	93.3	Very high	89.4	Confident	68 Å²	68	88 Å²	88	32%	0.318	45%	0.445	S	S	.	.	H	α-helix	trans	-68.1	-41.4	174.4	-74.6	174	-1.5	0	0	112.1	A249 P252 L289 Q290 A296 K297	A249-Q293 PolarHBondContact O-NE2 2.86Å; P252-Q293 HydrophobicContact CB-CG 3.99Å; P252-Q293 HydrophobicContact CG-CG 4.07Å; L289-Q293 HydrophobicContact CD1-CG 4.38Å; L289-Q293 WeakPolarHBondContact O-CB 3.3Å; L289-Q293 VanDerWaalsContact O-CG 3.24Å; L289-Q293 WeakPolarHBondContact O-CG 3.34Å; L289-Q293 PolarHBondContact O-N 2.65Å; Q290-Q293 PolarHBondContact O-N 2.99Å; Q290-Q293 VanDerWaalsContact O-N 3.15Å; Q293-A296 PolarHBondContact O-N 3.16Å; Q293-K297 WeakPolarHBondContact O-CG 3.33Å; Q293-K297 PolarHBondContact O-N 3.31Å
294	E	93.8	Very high	88.2	Confident	117 Å²	117	90.5 Å²	90.5	55%	0.547	45%	0.448	S	S	.	.	H	α-helix	trans	-64.3	-43.7	175.4	-70.6	-179.2	175.2	0	0	112.1	Q290 L291 A296 K297 R298	Q290-E294 WeakPolarHBondContact O-CG 3.14Å; Q290-E294 PolarHBondContact O-N 3.15Å; L291-E294 PolarHBondContact O-N 3.36Å; E294-A296 PolarHBondContact O-N 3.02Å; E294-K297 PolarHBondContact O-N 2.88Å; E294-R298 WeakPolarHBondContact O-CB 3.37Å; E294-R298 PolarHBondContact O-N 2.99Å
295	D	92.6	Very high	86.4	Confident	35 Å²	35	91.2 Å²	91.2	19%	0.187	45%	0.449	C	S	.	.	H	α-helix	trans	-63.2	-40.7	176.2	-177.5	48	0	0	0	112.1	R253 L291 R298 T299	R253-D295 WeakPolarHBondContact CD-OD2 3.18Å; R253-D295 IonicContact CZ-OD2 3.9Å; R253-D295 IonicContact NE-OD2 2.89Å; R253-D295 IonicContact NH1-OD2 3.62Å; R253-D295 PolarHBondContact NH1-OD2 3.03Å; L291-D295 VanDerWaalsContact O-CB 3.32Å; L291-D295 WeakPolarHBondContact O-CB 3.35Å; L291-D295 PolarHBondContact O-N 3.28Å; D295-R298 PolarHBondContact O-N 2.77Å; D295-R298 IonicContact OD1-CZ 3.53Å; D295-R298 IonicContact OD1-NE 3.72Å; D295-R298 IonicContact OD1-NH2 2.65Å; D295-R298 PolarHBondContact OD1-NH2 3.25Å; D295-T299 WeakPolarHBondContact O-CB 3.37Å; D295-T299 PolarHBondContact O-N 3.08Å; D295-T299 PolarHBondContact O-OG1 3.39Å
296	A	90.8	Very high	83.9	Confident	24 Å²	24	95.4 Å²	95.4	20%	0.198	47%	0.465	C	S	.	.	H	α-helix	trans	-60.7	-44.6	173.3	0	0	0	0	0	111.9	P252 R253 A292 Q293 E294 T299 A300	P252-A296 HydrophobicContact CB-CB 4.05Å; R253-A296 HydrophobicContact CG-CB 3.87Å; A292-A296 WeakPolarHBondContact O-CB 3.32Å; A292-A296 PolarHBondContact O-N 3.19Å; Q293-A296 PolarHBondContact O-N 3.16Å; E294-A296 PolarHBondContact O-N 3.02Å; A296-T299 PolarHBondContact O-N 2.88Å; A296-A300 WeakPolarHBondContact O-CB 3.4Å; A296-A300 PolarHBondContact O-N 3.5Å
297	K	89.8	Confident	81.4	Confident	123 Å²	123	94.8 Å²	94.8	54%	0.535	46%	0.458	S	S	.	.	H	α-helix	trans	-61.1	-46.2	175.9	-72.2	171.7	-175.4	175.4	0	111.5	Q293 E294 T299 A300 V301	Q293-K297 WeakPolarHBondContact O-CG 3.33Å; Q293-K297 PolarHBondContact O-N 3.31Å; E294-K297 PolarHBondContact O-N 2.88Å; K297-T299 VanDerWaalsContact C-N 3.32Å; K297-T299 PolarHBondContact O-N 3.37Å; K297-A300 PolarHBondContact O-N 3.38Å; K297-V301 VanDerWaalsContact O-CG2 3.31Å; K297-V301 WeakPolarHBondContact O-CG2 3.47Å; K297-V301 PolarHBondContact O-N 3.12Å
298	R	88.6	Confident	79.2	Confident	131 Å²	131	96 Å²	96	49%	0.494	47%	0.473	S	S	.	.	H	α-helix	trans	-61.3	-42	178.4	179.1	175.7	59.4	-137.7	1.5	111.7	E294 D295 K302	E294-R298 WeakPolarHBondContact O-CB 3.37Å; E294-R298 PolarHBondContact O-N 2.99Å; D295-R298 PolarHBondContact O-N 2.77Å; D295-R298 IonicContact OD1-CZ 3.53Å; D295-R298 IonicContact OD1-NE 3.72Å; D295-R298 IonicContact OD1-NH2 2.65Å; D295-R298 PolarHBondContact OD1-NH2 3.25Å; R298-K302 WeakPolarHBondContact O-CG 3.49Å; R298-K302 PolarHBondContact O-N 2.85Å; R298-K302 VanDerWaalsContact O-N 3.09Å
299	T	84.1	Confident	77	Confident	52 Å²	52	93 Å²	93	32%	0.319	46%	0.464	S	S	.	.	H	α-helix	trans	-68	-44	178.8	-54.5	0	0	0	0	111.1	D295 A296 K297 V301 K302 E303	D295-T299 WeakPolarHBondContact O-CB 3.37Å; D295-T299 PolarHBondContact O-N 3.08Å; D295-T299 PolarHBondContact O-OG1 3.39Å; A296-T299 PolarHBondContact O-N 2.88Å; K297-T299 VanDerWaalsContact C-N 3.32Å; K297-T299 PolarHBondContact O-N 3.37Å; T299-V301 VanDerWaalsContact C-N 3.33Å; T299-V301 PolarHBondContact O-N 3.09Å; T299-K302 PolarHBondContact O-N 3.44Å; T299-K302 VanDerWaalsContact O-N 3.12Å; T299-E303 HydrophobicContact CG2-CG 4.5Å; T299-E303 WeakPolarHBondContact O-CG 3.31Å; T299-E303 PolarHBondContact O-N 2.92Å
300	A	82.9	Confident	74.5	Confident	53 Å²	53	96.5 Å²	96.5	44%	0.438	47%	0.473	S	S	.	.	H	α-helix	trans	-59.7	-41.5	176	0	0	0	0	0	112.4	A296 K297 K302 E303 E304	A296-A300 WeakPolarHBondContact O-CB 3.4Å; A296-A300 PolarHBondContact O-N 3.5Å; K297-A300 PolarHBondContact O-N 3.38Å; A300-K302 VanDerWaalsContact C-N 3.35Å; A300-K302 PolarHBondContact O-N 2.9Å; A300-E303 PolarHBondContact O-N 3.36Å; A300-E304 WeakPolarHBondContact O-CB 3.49Å; A300-E304 PolarHBondContact O-N 2.84Å
301	V	75.9	Confident	72.3	Confident	68 Å²	68	95 Å²	95	41%	0.412	47%	0.466	S	S	.	.	H	α-helix	trans	-65.4	-37.8	175.4	171.6	0	0	0	0	111.7	K297 T299 K305	K297-V301 VanDerWaalsContact O-CG2 3.31Å; K297-V301 WeakPolarHBondContact O-CG2 3.47Å; K297-V301 PolarHBondContact O-N 3.12Å; T299-V301 VanDerWaalsContact C-N 3.33Å; T299-V301 PolarHBondContact O-N 3.09Å; V301-K305 HydrophobicContact CG1-CD 4.13Å; V301-K305 WeakPolarHBondContact O-CB 3.42Å; V301-K305 VanDerWaalsContact O-CG 3.25Å; V301-K305 WeakPolarHBondContact O-CG 3.25Å; V301-K305 PolarHBondContact O-N 2.95Å
302	K	73.1	Confident	70.3	Confident	140 Å²	140	94.3 Å²	94.3	61%	0.609	48%	0.475	S	S	*	.	H	α-helix	trans	-67.2	-41.8	175.6	-75.1	179.6	178	-172.8	0	111.8	R298 T299 A300 K305 Y306	R298-K302 WeakPolarHBondContact O-CG 3.49Å; R298-K302 PolarHBondContact O-N 2.85Å; R298-K302 VanDerWaalsContact O-N 3.09Å; T299-K302 PolarHBondContact O-N 3.44Å; T299-K302 VanDerWaalsContact O-N 3.12Å; A300-K302 VanDerWaalsContact C-N 3.35Å; A300-K302 PolarHBondContact O-N 2.9Å; K302-K305 PolarHBondContact O-N 2.89Å; K302-Y306 PolarHBondContact O-N 2.83Å; K302-Y306 VanDerWaalsContact O-N 3.08Å
303	E	68.8	Low	68	Low	105 Å²	105	97.6 Å²	97.6	49%	0.491	50%	0.502	S	S	.	.	H	α-helix	trans	-67.2	-38.5	176.9	-73.5	-179.6	177.4	0	0	112.1	T299 A300 K305 Y306	T299-E303 HydrophobicContact CG2-CG 4.5Å; T299-E303 WeakPolarHBondContact O-CG 3.31Å; T299-E303 PolarHBondContact O-N 2.92Å; A300-E303 PolarHBondContact O-N 3.36Å; E303-K305 VanDerWaalsContact C-N 3.35Å; E303-Y306 PolarHBondContact O-N 3.04Å
304	E	62.8	Low	65.7	Low	173 Å²	173	103 Å²	103	81%	0.808	52%	0.521	S	S	*	.	H	α-helix	trans	-68.7	-33.4	175.4	-172.4	177.6	-169.3	0	0	112.3	A300 Y306	A300-E304 WeakPolarHBondContact O-CB 3.49Å; A300-E304 PolarHBondContact O-N 2.84Å; E304-Y306 VanDerWaalsContact C-N 3.32Å
305	K	52.9	Low	63.3	Low	165 Å²	165	100 Å²	100	72%	0.717	52%	0.521	S	S	*	.	H	α-helix	trans	-77.1	-16	174.7	-75.3	179.5	179.8	-172.9	0	113.7	V301 K302 E303 D307	V301-K305 HydrophobicContact CG1-CD 4.13Å; V301-K305 WeakPolarHBondContact O-CB 3.42Å; V301-K305 VanDerWaalsContact O-CG 3.25Å; V301-K305 WeakPolarHBondContact O-CG 3.25Å; V301-K305 PolarHBondContact O-N 2.95Å; K302-K305 PolarHBondContact O-N 2.89Å; E303-K305 VanDerWaalsContact C-N 3.35Å; K305-D307 VanDerWaalsContact C-N 3.32Å; K305-D307 PolarHBondContact O-N 3.06Å
306	Y	43.3	Very low	61	Low	152 Å²	152	101.7 Å²	101.7	60%	0.596	55%	0.548	S	S	*	.			trans	-73.3	91.9	175.9	-176	-100.9	0	0	0	108.7	K302 E303 E304 P308 E311	K302-Y306 PolarHBondContact O-N 2.83Å; K302-Y306 VanDerWaalsContact O-N 3.08Å; E303-Y306 PolarHBondContact O-N 3.04Å; E304-Y306 VanDerWaalsContact C-N 3.32Å; Y306-P308 HydrophobicContact CE1-CG 4.31Å; Y306-P308 WeakPolarHBondContact O-CD 3.25Å; Y306-E311 HydrophobicContact CE2-CG 4.4Å
307	D	42.1	Very low	58.7	Low	96 Å²	96	104.8 Å²	104.8	51%	0.513	57%	0.573	S	S	.	*			trans	-86.6	114.3	168.9	-179.8	3.3	0	0	0	108.3	K305 G309 Y310	K305-D307 VanDerWaalsContact C-N 3.32Å; K305-D307 PolarHBondContact O-N 3.06Å; D307-G309 PolarHBondContact O-N 3.02Å; D307-G309 VanDerWaalsContact O-N 3.09Å; D307-G309 WeakPolarHBondContact OD1-CA 3.07Å; D307-G309 PolarHBondContact OD1-N 3.44Å; D307-Y310 VanDerWaalsContact O-CB 3.25Å; D307-Y310 WeakPolarHBondContact O-CB 3.36Å; D307-Y310 PolarHBondContact O-N 3.4Å
308	P	48	Very low	56.1	Low	90 Å²	90	105.1 Å²	105.1	58%	0.584	59%	0.59	S	S	*	*	H	α-helix	trans	-56.9	-23.7	173.4	-22.9	33.9	0	0	0	112.8	Y306 A312	Y306-P308 HydrophobicContact CE1-CG 4.31Å; Y306-P308 WeakPolarHBondContact O-CD 3.25Å; P308-A312 PolarHBondContact O-N 3.08Å
309	G	50.8	Low	53.5	Low	32 Å²	32	102.7 Å²	102.7	33%	0.33	61%	0.605	S	S	.	*	H	α-helix	trans	-71.9	-23.2	171.5	0	0	0	0	0	114.2	D307 A312 A313	D307-G309 PolarHBondContact O-N 3.02Å; D307-G309 VanDerWaalsContact O-N 3.09Å; D307-G309 WeakPolarHBondContact OD1-CA 3.07Å; D307-G309 PolarHBondContact OD1-N 3.44Å; G309-A312 PolarHBondContact O-N 2.8Å; G309-A313 WeakPolarHBondContact O-CB 3.4Å; G309-A313 PolarHBondContact O-N 2.83Å
310	Y	44.6	Very low	51	Low	151 Å²	151	109.3 Å²	109.3	59%	0.592	63%	0.633	S	S	*	*	H	α-helix	trans	-69.8	-43	177.3	176.4	-92.6	0	0	0	111.7	D307 A313 Y314	D307-Y310 VanDerWaalsContact O-CB 3.25Å; D307-Y310 WeakPolarHBondContact O-CB 3.36Å; D307-Y310 PolarHBondContact O-N 3.4Å; Y310-A313 PolarHBondContact O-N 3.46Å; Y310-Y314 HydrophobicContact CD2-CD2 4.28Å; Y310-Y314 HydrophobicContact CE2-CD2 4.45Å; Y310-Y314 WeakPolarHBondContact O-CB 3.13Å; Y310-Y314 PolarHBondContact O-N 2.78Å
311	E	49.7	Very low	48.9	Very low	112 Å²	112	114.3 Å²	114.3	52%	0.523	65%	0.652	S	S	.	*	H	α-helix	trans	-67.5	-37.9	171.5	-77.7	-77.5	156.3	0	0	111.4	Y306 A313 G315	Y306-E311 HydrophobicContact CE2-CG 4.4Å; E311-A313 VanDerWaalsContact C-N 3.33Å; E311-A313 PolarHBondContact O-N 3.09Å; E311-G315 WeakPolarHBondContact O-CA 3.4Å; E311-G315 PolarHBondContact O-N 2.82Å
312	A	53.4	Low	47.2	Very low	92 Å²	92	117 Å²	117	76%	0.76	67%	0.671	S	S	*	*	H	α-helix	trans	-70.2	-27.4	175.8	0	0	0	0	0	113.6	P308 G309	P308-A312 PolarHBondContact O-N 3.08Å; G309-A312 PolarHBondContact O-N 2.8Å
313	A	46.1	Very low	45.1	Very low	70 Å²	70	115.6 Å²	115.6	58%	0.579	68%	0.678	S	S	*	*	H	α-helix	trans	-94.9	-23.9	-179.1	0	0	0	0	0	114	G309 Y310 E311	G309-A313 WeakPolarHBondContact O-CB 3.4Å; G309-A313 PolarHBondContact O-N 2.83Å; Y310-A313 PolarHBondContact O-N 3.46Å; E311-A313 VanDerWaalsContact C-N 3.33Å; E311-A313 PolarHBondContact O-N 3.09Å
314	Y	45.4	Very low	43.3	Very low	182 Å²	182	118.4 Å²	118.4	71%	0.714	70%	0.696	S	S	*	*	H	α-helix	trans	-134.5	-7.5	-174.7	-70.8	-84.4	0	0	0	115.1	Y310 G316	Y310-Y314 HydrophobicContact CD2-CD2 4.28Å; Y310-Y314 HydrophobicContact CE2-CD2 4.45Å; Y310-Y314 WeakPolarHBondContact O-CB 3.13Å; Y310-Y314 PolarHBondContact O-N 2.78Å; Y314-G316 PolarHBondContact O-N 2.72Å
315	G	43.1	Very low	41.8	Very low	53 Å²	53	114 Å²	114	55%	0.546	70%	0.696	S	S	.	*			trans	-79.3	35.6	178.3	0	0	0	0	0	114.2	E311	E311-G315 WeakPolarHBondContact O-CA 3.4Å; E311-G315 PolarHBondContact O-N 2.82Å
316	G	44.6	Very low	41	Very low	72 Å²	72	115.2 Å²	115.2	74%	0.742	71%	0.705	S	S	*	*			trans	-126.3	56.4	-178	0	0	0	0	0	112.3	Y314	Y314-G316 PolarHBondContact O-N 2.72Å
317	A	43.7	Very low	41.3	Very low	89 Å²	89	113 Å²	113	74%	0.736	71%	0.709	S	S	*	*	S	Bend	trans	-159.7	127.8	160.9	0	0	0	0	0	111.1
318	C	34.8	Very low	40.7	Very low	130 Å²	130	115.1 Å²	115.1	88%	0.878	73%	0.729	S	S	*	*			trans	80.8	63.6	173.4	-57.4	0	0	0	0	117.2
319	G	33.3	Very low	39.9	Very low	80 Å²	80	114.2 Å²	114.2	83%	0.825	74%	0.736	S	S	*	*			trans	-88.1	101.7	141.9	0	0	0	0	0	109.2	N321	G319-N321 PolarHBondContact O-N 2.83Å
320	E	31.1	Very low	38.7	Very low	191 Å²	191	123 Å²	123	89%	0.893	77%	0.766	S	S	*	*			trans	-69.7	116.5	161.1	-81.9	-178.1	136	0	0	108.5
321	N	39.4	Very low	38.1	Very low	158 Å²	158	119.8 Å²	119.8	85%	0.845	77%	0.771	S	S	*	*			trans	-76.6	138.9	166.9	-111.6	12.2	0	0	0	109.5	G319	G319-N321 PolarHBondContact O-N 2.83Å
322	P	39.7	Very low	37.3	Very low	124 Å²	124	119.4 Å²	119.4	81%	0.805	78%	0.78	S	S	*	*			trans	-107.3	122.8	145.5	7.3	12.7	0	0	0	110.6
323	C	29.9	Very low	36.3	Very low	111 Å²	111	122.9 Å²	122.9	75%	0.75	79%	0.786	S	S	*	*			trans	-24.3	144.3	166.3	-54.3	0	0	0	0	118.8
324	N	31.3	Very low	35.5	Very low	164 Å²	164	122.6 Å²	122.6	88%	0.877	79%	0.79	S	S	*	*				179	110.4	114.1	-85.7	-23.2	0	0	0	108.2
325	G	31.3	Very low	34.8	Very low	79 Å²	79	122 Å²	122	81%	0.814	80%	0.799	S	S	*	*				96.1	127.6	92.4	0	0	0	0	0	108.3
326	E	35.2	Very low	34.1	Very low	192 Å²	192	125.4 Å²	125.4	90%	0.897	81%	0.809	S	S	*	*			cis	-164.6	176.5	21.3	-111.2	-164.5	118.3	0	0	108.3
327	P	49	Very low	33.5	Very low	105 Å²	105	125.8 Å²	125.8	68%	0.682	81%	0.805	S	S	*	*			trans	-104.5	159.9	-152.2	40.1	-34.6	0	0	0	114.9
328	C	30.7	Very low	32.8	Very low	140 Å²	140	128.5 Å²	128.5	95%	0.946	81%	0.807	S	S	*	*			trans	-146.4	132.4	155.2	-91.8	0	0	0	0	109.8
329	G	29.9	Very low	32.5	Very low	71 Å²	71	127.7 Å²	127.7	73%	0.732	80%	0.803	S	S	*	*			trans	-114.3	-166.1	-165.8	0	0	0	0	0	116.7
330	F	27.5	Very low	32.5	Very low	216 Å²	216	128.6 Å²	128.6	95%	0.947	80%	0.802	S	S	*	*			trans	68.6	139.9	177.1	-82.5	-88.6	0	0	0	115.8
331	A	31.3	Very low	32.5	Very low	84 Å²	84	128.5 Å²	128.5	69%	0.694	80%	0.802	S	S	*	*			cis	-158.4	156.5	6.1	0	0	0	0	0	111.6
332	S	32.3	Very low	32.2	Very low	104 Å²	104	129.5 Å²	129.5	73%	0.727	81%	0.806	S	S	*	*			trans	-0.5	135.7	153.5	-48.3	0	0	0	0	122.6
333	N	32.8	Very low	31.6	Very low	165 Å²	165	127.3 Å²	127.3	88%	0.882	81%	0.807	S	S	*	*				166.8	127.1	124.1	-82.8	-15.6	0	0	0	105.9
334	G	28.5	Very low	31.6	Very low	64 Å²	64	125.7 Å²	125.7	66%	0.66	81%	0.809	S	S	*	*			cis	121	136.4	37.9	0	0	0	0	0	106.8
335	L	31.5	Very low	31.6	Very low	171 Å²	171	127.5 Å²	127.5	90%	0.895	81%	0.812	S	S	*	*			trans	87.5	140.7	177.4	-58.2	155.2	0	0	0	116.8
336	T	29.2	Very low	31.5	Very low	123 Å²	123	129.3 Å²	129.3	76%	0.755	81%	0.812	S	S	*	*			cis	-173.7	151.3	-31.7	20.2	0	0	0	0	106.1
337	A	30.3	Very low	31.6	Very low	80 Å²	80	124.6 Å²	124.6	66%	0.661	81%	0.806	S	S	*	*			trans	84.4	112.3	144.3	0	0	0	0	0	121.7
338	N	29.5	Very low	31.1	Very low	147 Å²	147	125.6 Å²	125.6	79%	0.786	81%	0.812	S	S	*	*				95.4	105.8	125.6	-66.7	-10.9	0	0	0	121.4
339	S	30	Very low	31.1	Very low	112 Å²	112	124.3 Å²	124.3	78%	0.783	81%	0.805	S	S	*	*				61.7	112.1	119.8	-54	0	0	0	0	119.6
340	A	32.4	Very low	31.3	Very low	99 Å²	99	128.9 Å²	128.9	82%	0.818	81%	0.813	S	S	*	*				177.7	120.8	97	0	0	0	0	0	110
341	E	30.8	Very low	31.6	Very low	190 Å²	190	125 Å²	125	89%	0.888	81%	0.807	S	S	*	*			trans	-64.6	143.7	158.6	-65.6	-174.2	125.9	0	0	109.7
342	L	32.5	Very low	31.9	Very low	178 Å²	178	126.5 Å²	126.5	93%	0.932	81%	0.809	S	S	*	*			trans	-156	115.5	141.9	-99.4	170.8	0	0	0	108
343	G	28.3	Very low	32.4	Very low	79 Å²	79	129.8 Å²	129.8	81%	0.814	82%	0.819	S	S	*	*			trans	-76.7	169.5	175.1	0	0	0	0	0	113.3
344	G	29.2	Very low	32.4	Very low	77 Å²	77	124.3 Å²	124.3	79%	0.794	80%	0.801	S	S	*	*			trans	170	90.6	172	0	0	0	0	0	111.8
345	E	31.1	Very low	32.8	Very low	202 Å²	202	130 Å²	130	94%	0.944	81%	0.81	S	S	*	*			trans	-61.1	139.4	162.2	-77.3	170.8	90.4	0	0	111.2
346	S	30.6	Very low	32.8	Very low	117 Å²	117	133.5 Å²	133.5	82%	0.818	81%	0.811	S	S	*	*			trans	-160.3	123.6	141.6	60.2	0	0	0	0	110.8
347	A	36.1	Very low	33.2	Very low	93 Å²	93	135.8 Å²	135.8	77%	0.769	82%	0.816	S	S	*	*			trans	-72.2	178.6	178.5	0	0	0	0	0	112.7
348	P	38.8	Very low	33.5	Very low	125 Å²	125	136.3 Å²	136.3	81%	0.812	82%	0.82	S	S	*	*			trans	-86.8	154.4	-144.5	36	-37.6	0	0	0	114.5
349	S	29.9	Very low	33.7	Very low	113 Å²	113	138 Å²	138	79%	0.79	82%	0.823	S	S	*	*			trans	-111.1	112.4	169	-40.3	0	0	0	0	109.9
350	D	35.3	Very low	34.1	Very low	168 Å²	168	136.8 Å²	136.8	90%	0.898	82%	0.815	S	S	*	*			trans	-57.5	132	164.1	-80.3	-49.5	0	0	0	111.3
351	V	34.2	Very low	34.4	Very low	135 Å²	135	141.4 Å²	141.4	82%	0.818	82%	0.817	S	S	*	*			trans	-140.5	138.6	161.9	-178.7	0	0	0	0	109
352	P	37.3	Very low	35	Very low	115 Å²	115	135.4 Å²	135.4	75%	0.747	80%	0.8	S	S	*	*			trans	-96.9	162.7	-141.7	35.8	-33.5	0	0	0	115.3	G354	P352-G354 PolarHBondContact O-N 3.37Å
353	N	41.9	Very low	35.3	Very low	173 Å²	173	135.1 Å²	135.1	93%	0.925	79%	0.794	S	S	*	*			trans	-44.7	110.6	172.7	-147.9	8.4	0	0	0	112.5
354	G	33.7	Very low	35.7	Very low	49 Å²	49	139.5 Å²	139.5	51%	0.505	79%	0.793	S	S	.	*			trans	-113	105.6	175.8	0	0	0	0	0	110.3	P352 W356	P352-G354 PolarHBondContact O-N 3.37Å; G354-W356 PolarHBondContact O-N 3.04Å; G354-W356 VanDerWaalsContact O-N 3.09Å
355	Q	36.8	Very low	36.3	Very low	183 Å²	183	142.2 Å²	142.2	86%	0.855	79%	0.788	S	S	*	*			trans	-63	96.4	-178.1	-165.1	172.2	7.1	0	0	111.7	M357	Q355-M357 PolarHBondContact O-N 2.85Å
356	W	31.6	Very low	36.5	Very low	245 Å²	245	137 Å²	137	93%	0.928	77%	0.772	S	S	*	*			trans	-87.4	98.9	171	-70.5	91.8	0	0	0	110.3	G354 A358	G354-W356 PolarHBondContact O-N 3.04Å; G354-W356 VanDerWaalsContact O-N 3.09Å; W356-A358 VanDerWaalsContact C-N 3.34Å; W356-A358 PolarHBondContact O-N 3.41Å
357	M	36.1	Very low	36.8	Very low	171 Å²	171	136.9 Å²	136.9	84%	0.842	77%	0.771	S	S	*	*			trans	-69.2	90.7	162.8	-75.4	-88.9	-92.6	0	0	108.9	Q355 Q359	Q355-M357 PolarHBondContact O-N 2.85Å; M357-Q359 PolarHBondContact O-N 2.99Å
358	A	37.6	Very low	36.9	Very low	92 Å²	92	141.8 Å²	141.8	76%	0.76	78%	0.775	S	S	*	*			trans	-82	99.9	162.2	0	0	0	0	0	107.8	W356 S360	W356-A358 VanDerWaalsContact C-N 3.34Å; W356-A358 PolarHBondContact O-N 3.41Å; A358-S360 PolarHBondContact O-N 3.39Å
359	Q	32.9	Very low	36.7	Very low	182 Å²	182	143.4 Å²	143.4	85%	0.85	78%	0.777	S	S	*	*			trans	-56.5	111.6	164.3	-81	-178.6	-28.6	0	0	108.1	M357	M357-Q359 PolarHBondContact O-N 2.99Å
360	S	38.3	Very low	36.9	Very low	86 Å²	86	145.9 Å²	145.9	60%	0.601	78%	0.781	S	S	*	*			trans	-69.4	146.7	177.4	64.6	0	0	0	0	109.7	A358 A362	A358-S360 PolarHBondContact O-N 3.39Å; S360-A362 PolarHBondContact O-N 3.16Å
361	F	40	Very low	36.6	Very low	197 Å²	197	143.9 Å²	143.9	86%	0.864	78%	0.779	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.8	17.3	179	-164.4	-101	0	0	0	113.4
362	A	42.5	Very low	36.4	Very low	64 Å²	64	141 Å²	141	53%	0.529	78%	0.776	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86.2	-4.6	-174.6	0	0	0	0	0	114.7	S360	S360-A362 PolarHBondContact O-N 3.16Å
363	E	40	Very low	36.2	Very low	172 Å²	172	141.8 Å²	141.8	80%	0.804	78%	0.78	S	S	*	*	S	Bend	trans	-102.4	21.9	-173.5	-70.6	-164.9	149.8	0	0	115.9
364	Q	35.8	Very low	35.7	Very low	170 Å²	170	137.4 Å²	137.4	79%	0.794	78%	0.775	S	S	*	*			trans	-121.4	50.7	172.7	-68.6	-171.5	1.9	0	0	113.3
365	I	41.1	Very low	35.6	Very low	134 Å²	134	143.8 Å²	143.8	69%	0.687	79%	0.792	S	S	*	*			trans	-105.8	108.8	163.1	-54.2	178.1	0	0	0	107.2	S367	I365-S367 PolarHBondContact O-N 3.39Å
366	P	34.9	Very low	35.3	Very low	93 Å²	93	144.4 Å²	144.4	60%	0.604	80%	0.795	S	S	*	*			trans	-65.7	121.6	169.4	-14.1	27.7	0	0	0	109.4	F368	P366-F368 PolarHBondContact O-N 2.8Å
367	S	38.2	Very low	35.3	Very low	115 Å²	115	141.9 Å²	141.9	80%	0.804	79%	0.793	S	S	*	*			trans	-68.1	116.5	165.4	-56.1	0	0	0	0	108.8	I365 N369	I365-S367 PolarHBondContact O-N 3.39Å; S367-N369 PolarHBondContact O-N 3.09Å
368	F	37.9	Very low	35.1	Very low	195 Å²	195	138.5 Å²	138.5	86%	0.855	79%	0.793	S	S	*	*			trans	-84.4	107.1	169.2	-73.1	-79.5	0	0	0	108.9	P366	P366-F368 PolarHBondContact O-N 2.8Å
369	N	34.7	Very low	34.7	Very low	159 Å²	159	137.9 Å²	137.9	85%	0.85	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-70.4	137.1	162.7	-98	-5.5	0	0	0	109.6	S367 C371	S367-N369 PolarHBondContact O-N 3.09Å; N369-C371 PolarHBondContact O-N 2.94Å
370	N	33.4	Very low	34.7	Very low	166 Å²	166	134.9 Å²	134.9	89%	0.888	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-47.2	129.8	178.3	-118.3	-8.7	0	0	0	112.4
371	C	30.5	Very low	34.5	Very low	125 Å²	125	140.4 Å²	140.4	85%	0.845	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-76.4	126.7	164.9	-157.2	0	0	0	0	107.8	N369	N369-C371 PolarHBondContact O-N 2.94Å
372	G	30.1	Very low	34.3	Very low	74 Å²	74	136 Å²	136	76%	0.763	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-61.9	135.8	-168.5	0	0	0	0	0	114.7
373	T	32.9	Very low	33.7	Very low	133 Å²	133	136.6 Å²	136.6	82%	0.816	82%	0.823	S	S	*	*			trans	-94.3	111.4	155.3	42.7	0	0	0	0	107.6	E375	T373-E375 PolarHBondContact O-N 3.13Å
374	G	30	Very low	33.5	Very low	81 Å²	81	133.3 Å²	133.3	84%	0.835	82%	0.819	S	S	*	*			trans	-70.5	114	165.8	0	0	0	0	0	109
375	E	31.7	Very low	33.5	Very low	182 Å²	182	134.4 Å²	134.4	85%	0.85	82%	0.824	S	S	*	*			trans	-81.5	115.3	164.7	-72.9	-178.8	141.6	0	0	108.1	T373	T373-E375 PolarHBondContact O-N 3.13Å
376	Q	30.4	Very low	33.4	Very low	196 Å²	196	136.5 Å²	136.5	92%	0.916	86%	0.861	S	S	*	*			trans	-83	105.9	161.5	-85	178.6	-13.6	0	0	107.4	A378	Q376-A378 PolarHBondContact O-N 2.9Å
377	E	31.3	Very low	33.3	Very low	192 Å²	192	138.7 Å²	138.7	90%	0.897	87%	0.874	S	S	*	*			trans	-69.8	112.1	165.1	-75.8	-176	142.8	0	0	109.6
378	A	31.9	Very low	33	Very low	101 Å²	101	139.9 Å²	139.9	84%	0.835	88%	0.877	S	S	*	*			trans	-95.1	90.5	162.8	0	0	0	0	0	108.4	Q376 S380	Q376-A378 PolarHBondContact O-N 2.9Å; A378-S380 PolarHBondContact O-N 3.25Å
379	G	30.9	Very low	32.8	Very low	79 Å²	79	136.8 Å²	136.8	81%	0.814	88%	0.878	S	S	*	*			trans	-79.1	105.6	171.4	0	0	0	0	0	111.1	H381	G379-H381 PolarHBondContact O-N 3.21Å
380	S	33.1	Very low	32.7	Very low	119 Å²	119	135.5 Å²	135.5	83%	0.832	88%	0.88	S	S	*	*			trans	-78.6	106	167.8	57	0	0	0	0	110.1	A378	A378-S380 PolarHBondContact O-N 3.25Å
381	H	33.9	Very low	32.6	Very low	201 Å²	201	133.6 Å²	133.6	93%	0.931	88%	0.88	S	S	*	*			trans	-88.7	115	164.9	-102.6	-36.9	0	0	0	109.9	G379	G379-H381 PolarHBondContact O-N 3.21Å
382	A	34.7	Very low	32.8	Very low	104 Å²	104	134.2 Å²	134.2	86%	0.86	88%	0.882	S	S	*	*			trans	-135.4	118	160.8	0	0	0	0	0	107.8
383	G	30.3	Very low	33	Very low	78 Å²	78	138.5 Å²	138.5	80%	0.804	89%	0.89	S	S	*	*			trans	172.8	85.3	-177	0	0	0	0	0	112.1
384	S	36.3	Very low	33	Very low	103 Å²	103	138.9 Å²	138.9	72%	0.72	90%	0.896	S	S	*	*			trans	-28.3	141.2	170	53.4	0	0	0	0	118.3
385	H	35.2	Very low	33.2	Very low	193 Å²	193	143.8 Å²	143.8	89%	0.894	90%	0.901	S	S	*	*				-166.3	139.7	127.5	-102	-67.5	0	0	0	111.6
386	A	38.6	Very low	33.3	Very low	177 Å²	177	140.3 Å²	140.3	100%	1.463	91%	0.906	S	S	*	*			trans	84.5	0	175	0	0	0	0	0	117.2

Retrieved 386 of 386 residues in 797.1 ms (Link to these results)

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