A0A087Y195_POEFO Loading...

Tribbles pseudokinase 1

AlphaFold DB , UniProt , Accession A0A087Y195, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 361 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	34	Very low	28.3	Very low	245 Å²	245	176.8 Å²	176.8	100%	1.207	85%	0.852	S	S	*	*				0	138.6	0	-65	172.4	-179.7	0	0	107.2
2	V	35.5	Very low	27.9	Very low	139 Å²	139	172.4 Å²	172.4	84%	0.842	85%	0.851	S	S	*	*			cis	-122.6	140.9	-3.1	175	0	0	0	0	109.1
3	N	24	Very low	27.7	Very low	140 Å²	140	168.3 Å²	168.3	75%	0.749	85%	0.849	S	S	*	*			trans	-106.4	133	171.9	172.9	9.7	0	0	0	108.2
4	R	32.9	Very low	27.8	Very low	235 Å²	235	164 Å²	164	89%	0.887	84%	0.843	S	S	*	*			trans	-163.9	156.4	150.7	-109	162.3	-167.4	-135.5	-0.3	111.9
5	P	32.2	Very low	28.1	Very low	99 Å²	99	160.9 Å²	160.9	64%	0.643	84%	0.838	S	S	*	*			trans	-110.9	177.2	-154.9	42.3	-36.8	0	0	0	114.2
6	F	24.3	Very low	28.1	Very low	218 Å²	218	159.6 Å²	159.6	96%	0.956	84%	0.838	S	S	*	*			trans	-116.6	137	146.9	-111	-98.5	0	0	0	110.4
7	R	25.6	Very low	28.2	Very low	218 Å²	218	158.2 Å²	158.2	82%	0.823	84%	0.837	S	S	*	*			trans	-150.6	124.8	-178.5	-163.9	-164.8	-161.5	-162.1	7.2	107.6
8	M	26.5	Very low	28.3	Very low	147 Å²	147	156.2 Å²	156.2	72%	0.724	84%	0.835	S	S	*	*				157.9	156.6	123.8	-85.5	-175.2	78.1	0	0	114.1
9	N	26	Very low	28.2	Very low	135 Å²	135	154.3 Å²	154.3	72%	0.722	83%	0.833	S	S	*	*			trans	71.2	106.8	156.7	-62	-7.9	0	0	0	119.6
10	L	25.5	Very low	28.3	Very low	171 Å²	171	154.1 Å²	154.1	90%	0.895	83%	0.83	S	S	*	*			trans	-65.9	144.5	143.6	-58.3	86.2	0	0	0	109.3
11	Q	24.3	Very low	28.2	Very low	198 Å²	198	158 Å²	158	93%	0.925	83%	0.833	S	S	*	*			trans	-135.8	151.7	142.5	-103.8	179.8	-12.6	0	0	108
12	C	24.4	Very low	28.1	Very low	124 Å²	124	157.8 Å²	157.8	84%	0.838	82%	0.819	S	S	*	*			trans	-101.4	125.7	-163.3	-171.6	0	0	0	0	112.4
13	S	24.7	Very low	28.1	Very low	119 Å²	119	155.3 Å²	155.3	83%	0.832	80%	0.804	S	S	*	*			trans	-153.9	137.8	158.9	49.1	0	0	0	0	110.7
14	S	29.4	Very low	28.6	Very low	108 Å²	108	152.2 Å²	152.2	76%	0.755	80%	0.798	S	S	*	*			trans	-94.5	174.3	-173.8	-49.1	0	0	0	0	111.8
15	P	32.6	Very low	29.1	Very low	118 Å²	118	146.1 Å²	146.1	77%	0.766	78%	0.779	S	S	*	*				-126.2	144.5	-59.1	35	-22.1	0	0	0	111.3
16	V	27	Very low	29.9	Very low	140 Å²	140	146.9 Å²	146.9	85%	0.848	77%	0.772	S	S	*	*			trans	-116	124.7	172.6	-178.9	0	0	0	0	109.9	P18	V16-P18 VanDerWaalsContact O-CD 3.32Å; V16-P18 WeakPolarHBondContact O-CD 3.22Å
17	V	30.9	Very low	30.8	Very low	136 Å²	136	146 Å²	146	82%	0.824	76%	0.763	S	S	*	*			trans	-73.1	120.5	-173.4	179.5	0	0	0	0	111.6	C19	V17-C19 PolarHBondContact O-N 2.99Å
18	P	29.6	Very low	31.8	Very low	122 Å²	122	141.2 Å²	141.2	79%	0.792	75%	0.753	S	S	*	*			trans	-82.3	102.3	176	-10.7	29.1	0	0	0	112.4	V16	V16-P18 VanDerWaalsContact O-CD 3.32Å; V16-P18 WeakPolarHBondContact O-CD 3.22Å
19	C	26.2	Very low	32.1	Very low	119 Å²	119	141.3 Å²	141.3	80%	0.804	76%	0.756	S	S	*	*			trans	28.3	104.2	147.9	-155.3	0	0	0	0	119	V17 R21	V17-C19 PolarHBondContact O-N 2.99Å; C19-R21 PolarHBondContact O-N 3.05Å
20	I	30.8	Very low	32.6	Very low	151 Å²	151	140.6 Å²	140.6	77%	0.774	76%	0.762	S	S	*	*			trans	-61.4	129.1	162.7	-64	168.4	0	0	0	109.6	R22	I20-R22 PolarHBondContact O-N 3.27Å; I20-R22 VanDerWaalsContact O-N 3.16Å
21	R	26.7	Very low	32.9	Very low	237 Å²	237	140.4 Å²	140.4	89%	0.894	76%	0.761	S	S	*	*			trans	-63	115	166.2	-83.2	-174	170.6	-171.7	-2.4	109	C19 V23	C19-R21 PolarHBondContact O-N 3.05Å; R21-V23 PolarHBondContact O-N 3.43Å; R21-V23 VanDerWaalsContact O-N 3.07Å
22	R	30.2	Very low	33.2	Very low	240 Å²	240	138.4 Å²	138.4	91%	0.906	76%	0.757	S	S	*	*			trans	-58.6	111	179	-70.3	179.3	175.9	169.7	-2.3	111	I20	I20-R22 PolarHBondContact O-N 3.27Å; I20-R22 VanDerWaalsContact O-N 3.16Å
23	V	35.5	Very low	33.4	Very low	87 Å²	87	139.9 Å²	139.9	53%	0.527	75%	0.752	S	S	.	*			trans	-68.9	129.6	155	178.6	0	0	0	0	107	R21 H25	R21-V23 PolarHBondContact O-N 3.43Å; R21-V23 VanDerWaalsContact O-N 3.07Å; V23-H25 PolarHBondContact O-N 3.49Å
24	A	34.5	Very low	34.1	Very low	74 Å²	74	139.7 Å²	139.7	61%	0.612	75%	0.748	S	S	*	*			trans	-81.7	87.6	-172.9	0	0	0	0	0	111.1	K26	A24-K26 PolarHBondContact O-N 2.81Å
25	H	43.3	Very low	34.8	Very low	108 Å²	108	140 Å²	140	50%	0.5	75%	0.747	S	S	.	*			trans	-61.6	108.2	174.4	-64.5	-69	0	0	0	111.3	V23	V23-H25 PolarHBondContact O-N 3.49Å
26	K	49.8	Very low	34.7	Very low	115 Å²	115	139.2 Å²	139.2	50%	0.5	75%	0.751	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-84.6	112.6	169.3	-61.1	164.6	-167.7	155.2	0	108.4	A24 D134	A24-K26 PolarHBondContact O-N 2.81Å; K26-D134 IonicContact NZ-OD2 2.65Å; K26-D134 PolarHBondContact NZ-OD2 3.28Å
27	R	42.8	Very low	34.8	Very low	200 Å²	200	142.6 Å²	142.6	76%	0.755	75%	0.754	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-83.7	149.8	157.3	-68.8	-176.2	179	180	-1.1	108.3
28	L	46.6	Very low	34.6	Very low	117 Å²	117	142.3 Å²	142.3	61%	0.613	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-96.1	124.2	154.9	-76.2	80	0	0	0	106.6	I136	L28-I136 HydrophobicContact CD1-CG2 4.34Å
29	D	33.2	Very low	34.6	Very low	149 Å²	149	141.6 Å²	141.6	80%	0.797	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-91.3	142.8	160.7	-68.8	-49.8	0	0	0	108.3
30	S	37.1	Very low	34.6	Very low	120 Å²	120	146.8 Å²	146.8	84%	0.839	76%	0.764	S	S	*	*			trans	-141.6	124.1	171.6	-71	0	0	0	0	107.2
31	D	31.6	Very low	34.4	Very low	166 Å²	166	146.3 Å²	146.3	89%	0.888	76%	0.762	S	S	*	*			trans	-104.6	164.9	-168.8	-131	-30.1	0	0	0	113.5
32	D	31.2	Very low	34.5	Very low	156 Å²	156	140.4 Å²	140.4	83%	0.834	76%	0.757	S	S	*	*			trans	82.8	157	163.9	-120.9	-40	0	0	0	122.2
33	Q	28.6	Very low	34.4	Very low	156 Å²	156	133 Å²	133	73%	0.729	75%	0.747	S	S	*	*			trans	-111.2	-171.6	-154.6	-141.7	48.4	124.1	0	0	109.5
34	P	39.6	Very low	34	Very low	115 Å²	115	135.8 Å²	135.8	75%	0.747	76%	0.759	S	S	*	*			cis	-137.6	178.3	5.8	41.6	-20.7	0	0	0	117.5
35	P	43.9	Very low	33.7	Very low	113 Å²	113	137.9 Å²	137.9	73%	0.734	77%	0.769	S	S	*	*			trans	-103.6	166.9	-167.3	39.4	-36.3	0	0	0	116.4
36	A	29.9	Very low	32.9	Very low	103 Å²	103	136.8 Å²	136.8	85%	0.851	79%	0.787	S	S	*	*			trans	-110	160.1	169.4	0	0	0	0	0	112.6
37	K	28.9	Very low	31.9	Very low	210 Å²	210	138.8 Å²	138.8	91%	0.913	80%	0.803	S	S	*	*			trans	-108.3	167.2	-165.8	-69.4	177.1	179.3	173.3	0	114.6
38	C	27.1	Very low	32.2	Very low	131 Å²	131	133.5 Å²	133.5	89%	0.885	80%	0.795	S	S	*	*			trans	-64.1	157.4	-179.3	-43.1	0	0	0	0	115.2
39	A	28.4	Very low	31.4	Very low	106 Å²	106	137.3 Å²	137.3	88%	0.876	81%	0.809	S	S	*	*			trans	-135.2	172	152.7	0	0	0	0	0	109.7
40	R	26.4	Very low	31.2	Very low	228 Å²	228	133.7 Å²	133.7	86%	0.86	81%	0.808	S	S	*	*			trans	-154.2	164	-161	-141.8	-173.4	-168.2	-177.7	4.4	112.3
41	L	27.5	Very low	30.8	Very low	142 Å²	142	135.7 Å²	135.7	74%	0.743	81%	0.808	S	S	*	*			trans	80	130.4	154.2	-66.4	162.4	0	0	0	121.2
42	S	27.8	Very low	30.6	Very low	112 Å²	112	135.8 Å²	135.8	78%	0.783	81%	0.808	S	S	*	*			trans	57	154.8	138.4	58.1	0	0	0	0	122
43	A	28.5	Very low	30.5	Very low	85 Å²	85	131.7 Å²	131.7	70%	0.702	80%	0.802	S	S	*	*			cis	-176.9	-165.5	-21.3	0	0	0	0	0	106.7
44	D	26.7	Very low	30.5	Very low	146 Å²	146	131 Å²	131	78%	0.781	81%	0.809	S	S	*	*			cis	-162.6	171.3	-1.3	-142.3	-45.5	0	0	0	110.9
45	S	28.3	Very low	30.1	Very low	118 Å²	118	131 Å²	131	83%	0.825	81%	0.811	S	S	*	*			trans	66.8	146.4	156.7	73.3	0	0	0	0	121.5
46	G	27.7	Very low	30.1	Very low	85 Å²	85	131.2 Å²	131.2	88%	0.876	81%	0.813	S	S	*	*			trans	149.6	64.5	166.7	0	0	0	0	0	118.2
47	D	27.9	Very low	29.9	Very low	157 Å²	157	131.5 Å²	131.5	84%	0.84	81%	0.809	S	S	*	*			trans	-121.7	170.3	176.2	-145.5	13.2	0	0	0	108.3
48	P	49	Very low	30.1	Very low	89 Å²	89	126.7 Å²	126.7	58%	0.578	80%	0.802	S	S	*	*			cis	-143.8	-166.9	-1.8	44.4	-24.6	0	0	0	117
49	Q	30.2	Very low	30.5	Very low	196 Å²	196	126.7 Å²	126.7	92%	0.916	80%	0.8	S	S	*	*			trans	78.1	140.1	156.1	-67.8	172.5	20.9	0	0	120.9
50	G	27.9	Very low	30.8	Very low	74 Å²	74	128.2 Å²	128.2	76%	0.763	80%	0.798	S	S	*	*			trans	-179.1	-4.9	178.3	0	0	0	0	0	124.3
51	L	29.2	Very low	31.4	Very low	161 Å²	161	122.5 Å²	122.5	84%	0.843	79%	0.793	S	S	*	*			trans	60.6	128.7	167.9	-68.5	167.6	0	0	0	122.3
52	L	27.5	Very low	31.8	Very low	169 Å²	169	121.5 Å²	121.5	89%	0.885	80%	0.795	S	S	*	*			trans	61.4	134.8	141.4	-60.8	170.2	0	0	0	122.7
53	G	28.5	Very low	32.2	Very low	69 Å²	69	120.6 Å²	120.6	71%	0.711	79%	0.794	S	S	*	*			trans	142.7	88.5	146.1	0	0	0	0	0	119.2
54	T	29	Very low	32.4	Very low	143 Å²	143	121.3 Å²	121.3	88%	0.877	80%	0.8	S	S	*	*			trans	25.2	121.6	148.3	53.8	0	0	0	0	122
55	S	31.9	Very low	32.7	Very low	114 Å²	114	121.3 Å²	121.3	80%	0.797	80%	0.8	S	S	*	*			trans	-59.3	162.8	156.6	-17.7	0	0	0	0	112.3
56	P	42.8	Very low	33.1	Very low	117 Å²	117	121.4 Å²	121.4	76%	0.76	80%	0.798	S	S	*	*				-151.4	-178.1	56.7	42.6	-22.5	0	0	0	118.9
57	S	27	Very low	33.6	Very low	110 Å²	110	123.6 Å²	123.6	77%	0.769	79%	0.794	S	S	*	*			trans	100	128	151.8	76.9	0	0	0	0	120.8
58	S	32.4	Very low	33.8	Very low	109 Å²	109	121.1 Å²	121.1	76%	0.762	79%	0.786	S	S	*	*			trans	51.4	108	151.7	-57.2	0	0	0	0	121.1
59	P	35	Very low	33.3	Very low	130 Å²	130	120.6 Å²	120.6	84%	0.844	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-76.3	135.4	166.4	32.5	-32.9	0	0	0	111.9
60	V	36.2	Very low	33.7	Very low	138 Å²	138	116.7 Å²	116.7	84%	0.836	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-82.3	127.2	162.6	171.9	0	0	0	0	108.4	P62	V60-P62 WeakPolarHBondContact O-CD 3.42Å
61	S	39.2	Very low	34.3	Very low	109 Å²	109	121.6 Å²	121.6	76%	0.762	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-65	121.9	175.1	-56.5	0	0	0	0	110.9
62	P	35.8	Very low	35.5	Very low	121 Å²	121	121.1 Å²	121.1	79%	0.786	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-67.1	147.5	167.5	29.7	-33.6	0	0	0	109.8	V60	V60-P62 WeakPolarHBondContact O-CD 3.42Å
63	A	35.9	Very low	36.9	Very low	93 Å²	93	115.4 Å²	115.4	77%	0.769	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-61.9	142.1	179.6	0	0	0	0	0	111.5	N65	A63-N65 PolarHBondContact O-N 3.46Å; A63-N65 VanDerWaalsContact O-N 3.13Å
64	A	32.4	Very low	38.6	Very low	99 Å²	99	115.8 Å²	115.8	82%	0.818	75%	0.747	S	S	*	*			trans	-68	110.9	174.1	0	0	0	0	0	109.8
65	N	33.1	Very low	41.2	Very low	147 Å²	147	111.7 Å²	111.7	79%	0.786	72%	0.724	S	S	*	*			trans	-58.7	128.1	166.6	-76.6	-32.9	0	0	0	108.7	A63 V67	A63-N65 PolarHBondContact O-N 3.46Å; A63-N65 VanDerWaalsContact O-N 3.13Å; N65-V67 PolarHBondContact O-N 3.15Å; N65-V67 VanDerWaalsContact O-N 3.1Å
66	P	37.4	Very low	43.9	Very low	119 Å²	119	114 Å²	114	77%	0.773	72%	0.715	S	S	*	*			trans	-65	115.8	173.4	26.7	-32.4	0	0	0	108.6
67	V	36.3	Very low	46.2	Very low	132 Å²	132	110 Å²	110	80%	0.8	69%	0.687	S	S	*	*			trans	-58.5	125.1	170.2	179.6	0	0	0	0	107.2	N65 A69	N65-V67 PolarHBondContact O-N 3.15Å; N65-V67 VanDerWaalsContact O-N 3.1Å; V67-A69 PolarHBondContact O-N 3.4Å
68	P	33.9	Very low	49.1	Very low	104 Å²	104	106.5 Å²	106.5	68%	0.675	67%	0.669	S	S	*	*			trans	-64	115.9	-179.6	25.5	-33.1	0	0	0	108.7	T70	P68-T70 PolarHBondContact O-N 3.36Å
69	A	36.8	Very low	51.9	Low	78 Å²	78	102.5 Å²	102.5	65%	0.645	64%	0.642	S	S	*	*			trans	-62.7	100	172.6	0	0	0	0	0	108.3	V67 H71	V67-A69 PolarHBondContact O-N 3.4Å; A69-H71 PolarHBondContact O-N 3Å
70	T	39.3	Very low	54.7	Low	115 Å²	115	96.9 Å²	96.9	71%	0.706	61%	0.605	S	S	*	*			trans	-71.5	83	174.9	38.5	0	0	0	0	108.6	P68 Q72	P68-T70 PolarHBondContact O-N 3.36Å; T70-Q72 PolarHBondContact O-N 3.1Å
71	H	41.1	Very low	57.4	Low	176 Å²	176	92.4 Å²	92.4	82%	0.815	58%	0.576	S	S	*	*			trans	-61.9	82.9	163.5	-74.9	-79.8	0	0	0	108.5	A69 G73	A69-H71 PolarHBondContact O-N 3Å; H71-G73 PolarHBondContact O-N 3.38Å
72	Q	53.5	Low	60	Low	152 Å²	152	87.6 Å²	87.6	71%	0.71	54%	0.542	S	S	*	.	P	Polyproline II helix	trans	-60.3	119.9	174.1	-66.1	-175.6	5.2	0	0	107.6	T70	T70-Q72 PolarHBondContact O-N 3.1Å
73	G	56.3	Low	62.6	Low	48 Å²	48	85.4 Å²	85.4	50%	0.495	52%	0.523	S	S	.	.	P	Polyproline II helix	trans	-60.4	162.4	176.7	0	0	0	0	0	111.7	H71 S75	H71-G73 PolarHBondContact O-N 3.38Å; G73-S75 PolarHBondContact O-N 3.2Å; G73-S75 VanDerWaalsContact O-N 3.11Å; G73-S75 PolarHBondContact O-OG 3.02Å
74	P	65.4	Low	64.9	Low	78 Å²	78	85.6 Å²	85.6	51%	0.506	52%	0.516	S	S	.	.	P	Polyproline II helix	trans	-59.8	120.6	-176.6	28.7	-37	0	0	0	110	L81 L82 L83	P74-L81 HydrophobicContact CB-CD1 3.86Å; P74-L81 HydrophobicContact CB-CD2 4.24Å; P74-L81 HydrophobicContact CB-CG 3.97Å; P74-L81 HydrophobicContact CG-CD1 4.35Å; P74-L82 CarbonylContact C-O 3.58Å; P74-L82 VanDerWaalsContact CA-O 3.25Å; P74-L82 WeakPolarHBondContact CA-O 3.38Å; P74-L83 HydrophobicContact CB-CD2 3.78Å
75	S	83.6	Confident	67.3	Low	57 Å²	57	83.9 Å²	83.9	40%	0.399	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	120.4	-166.4	-70.3	0	0	0	0	110.5	G73 L82	G73-S75 PolarHBondContact O-N 3.2Å; G73-S75 VanDerWaalsContact O-N 3.11Å; G73-S75 PolarHBondContact O-OG 3.02Å; S75-L82 PolarHBondContact N-O 2.86Å; S75-L82 VanDerWaalsContact N-O 3.13Å; S75-L82 VanDerWaalsContact O-CB 3.3Å; S75-L82 WeakPolarHBondContact O-CB 3.27Å; S75-L82 WeakPolarHBondContact O-CG 3.1Å; S75-L82 PolarHBondContact O-N 3.07Å
76	R	88.9	Confident	69	Low	161 Å²	161	82 Å²	82	61%	0.608	50%	0.497	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.7	125	-178.7	-169.7	179.7	-174.2	167	11.1	111.5	G78 F80 L81 T97	R76-G78 WeakPolarHBondContact CG-O 3.37Å; R76-G78 PolarHBondContact NE-O 3.32Å; R76-F80 CarbonylContact C-O 3.57Å; R76-F80 WeakPolarHBondContact CA-O 3.32Å; R76-L81 HydrophobicContact CB-CD1 4.44Å; R76-T97 PolarHBondContact NH2-OG1 3.07Å; R76-T97 VanDerWaalsContact NH2-OG1 3.1Å
77	I	89.7	Confident	70.4	Confident	33 Å²	33	83.9 Å²	83.9	17%	0.169	50%	0.501	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	96.5	175.2	-57.9	-63.8	0	0	0	108	A79 F80 L82 I136 Y143	I77-A79 PolarHBondContact O-N 2.97Å; I77-F80 PolarHBondContact N-O 3.3Å; I77-F80 PolarHBondContact O-N 2.6Å; I77-L82 HydrophobicContact CG1-CD1 3.73Å; I77-L82 HydrophobicContact CG1-CG 4.22Å; I77-I136 HydrophobicContact CG2-CB 4.2Å; I77-I136 HydrophobicContact CG2-CD1 4.05Å; I77-I136 HydrophobicContact CG2-CG2 3.79Å; I77-Y143 HydrophobicContact CD1-CE1 3.9Å; I77-Y143 HydrophobicContact CD1-CE2 4.18Å; I77-Y143 HydrophobicContact CG1-CD1 4.07Å; I77-Y143 HydrophobicContact CG1-CE1 3.79Å; I77-Y143 HydrophobicContact CG2-CD1 4.33Å; I77-Y143 HydrophobicContact CG2-CD2 3.99Å; I77-Y143 HydrophobicContact CG2-CE2 4.3Å; I77-Y143 HydrophobicContact CG2-CG 4.02Å
78	G	88.4	Confident	72.1	Confident	37 Å²	37	80.9 Å²	80.9	38%	0.381	48%	0.476	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.5	-122.9	-172.9	0	0	0	0	0	112.1	R76 F80	R76-G78 WeakPolarHBondContact CG-O 3.37Å; R76-G78 PolarHBondContact NE-O 3.32Å; G78-F80 VanDerWaalsContact C-N 3.27Å; G78-F80 PolarHBondContact O-N 2.76Å
79	A	90.7	Very high	73.4	Confident	25 Å²	25	85.6 Å²	85.6	21%	0.207	49%	0.489	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-2.3	175.9	0	0	0	0	0	114.1	I77 N96 T97 D98	I77-A79 PolarHBondContact O-N 2.97Å; A79-N96 CarbonylContact O-C 3.58Å; A79-N96 PolarHBondContact O-OD1 3.44Å; A79-T97 PolarHBondContact O-N 2.77Å; A79-T97 PolarHBondContact O-OG1 2.85Å; A79-D98 WeakPolarHBondContact CB-OD2 3.18Å
80	F	94.3	Very high	75.2	Confident	13 Å²	13	86.2 Å²	86.2	6%	0.057	49%	0.488	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	134.8	-175.8	-58.1	-78.4	0	0	0	112.4	R76 I77 G78 M95 N96 L103 I136 F145	R76-F80 CarbonylContact C-O 3.57Å; R76-F80 WeakPolarHBondContact CA-O 3.32Å; I77-F80 PolarHBondContact N-O 3.3Å; I77-F80 PolarHBondContact O-N 2.6Å; G78-F80 VanDerWaalsContact C-N 3.27Å; G78-F80 PolarHBondContact O-N 2.76Å; F80-M95 WeakPolarHBondContact CA-O 3.33Å; F80-N96 HydrophobicContact CD1-CB 3.98Å; F80-N96 HydrophobicContact CE1-CB 3.78Å; F80-L103 HydrophobicContact CD1-CD1 4.37Å; F80-L103 HydrophobicContact CE1-CD1 3.68Å; F80-L103 HydrophobicContact CZ-CD1 4.41Å; F80-I136 HydrophobicContact CD2-CD1 3.68Å; F80-I136 HydrophobicContact CE2-CD1 3.9Å; F80-F145 HydrophobicContact CB-CE1 3.65Å; F80-F145 HydrophobicContact CB-CZ 3.86Å; F80-F145 HydrophobicContact CD1-CD1 4.16Å; F80-F145 AromaticContact CD1-CE1 3.93Å; F80-F145 HydrophobicContact CD1-CE1 3.93Å; F80-F145 HydrophobicContact CD2-CD1 4.31Å; F80-F145 HydrophobicContact CD2-CD2 4.46Å; F80-F145 AromaticContact CD2-CE1 3.7Å; F80-F145 HydrophobicContact CD2-CE1 3.7Å; F80-F145 AromaticContact CD2-CE2 3.88Å; F80-F145 HydrophobicContact CD2-CE2 3.88Å; F80-F145 AromaticContact CD2-CZ 3.46Å; F80-F145 HydrophobicContact CD2-CZ 3.46Å; F80-F145 VanDerWaalsContact CD2-CZ 3.46Å; F80-F145 HydrophobicContact CE1-CD1 4.4Å; F80-F145 HydrophobicContact CE2-CD2 4.33Å; F80-F145 HydrophobicContact CE2-CE1 4.33Å; F80-F145 HydrophobicContact CE2-CE2 4.13Å; F80-F145 HydrophobicContact CE2-CZ 4.13Å; F80-F145 HydrophobicContact CG-CD1 4.11Å; F80-F145 AromaticContact CG-CE1 3.46Å; F80-F145 HydrophobicContact CG-CE1 3.46Å; F80-F145 VanDerWaalsContact CG-CE1 3.46Å; F80-F145 HydrophobicContact CG-CE2 4.49Å; F80-F145 AromaticContact CG-CZ 3.69Å; F80-F145 HydrophobicContact CG-CZ 3.69Å
81	L	94.1	Very high	77.5	Confident	43 Å²	43	81 Å²	81	23%	0.225	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	116	168	-170.3	70.6	0	0	0	109.1	P74 R76 L83 A94 M95 T97	P74-L81 HydrophobicContact CB-CD1 3.86Å; P74-L81 HydrophobicContact CB-CD2 4.24Å; P74-L81 HydrophobicContact CB-CG 3.97Å; P74-L81 HydrophobicContact CG-CD1 4.35Å; R76-L81 HydrophobicContact CB-CD1 4.44Å; L81-L83 HydrophobicContact CD2-CD2 4.24Å; L81-L83 HydrophobicContact CG-CD2 4.36Å; L81-A94 WeakPolarHBondContact O-CA 3.19Å; L81-M95 HydrophobicContact CD2-CE 4.24Å; L81-M95 PolarHBondContact N-O 2.85Å; L81-M95 PolarHBondContact O-N 2.95Å; L81-T97 HydrophobicContact CB-CG2 4.45Å
82	L	92.8	Very high	79.9	Confident	9 Å²	9	75.5 Å²	75.5	5%	0.047	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	132.8	178.2	-57.5	-175.3	0	0	0	111.4	P74 S75 I77 H92 G93 A94 C105 Y143 F145	P74-L82 CarbonylContact C-O 3.58Å; P74-L82 VanDerWaalsContact CA-O 3.25Å; P74-L82 WeakPolarHBondContact CA-O 3.38Å; S75-L82 PolarHBondContact N-O 2.86Å; S75-L82 VanDerWaalsContact N-O 3.13Å; S75-L82 VanDerWaalsContact O-CB 3.3Å; S75-L82 WeakPolarHBondContact O-CB 3.27Å; S75-L82 WeakPolarHBondContact O-CG 3.1Å; S75-L82 PolarHBondContact O-N 3.07Å; I77-L82 HydrophobicContact CG1-CD1 3.73Å; I77-L82 HydrophobicContact CG1-CG 4.22Å; L82-H92 HydrophobicContact CB-CB 4.48Å; L82-G93 CarbonylContact C-O 3.58Å; L82-G93 WeakPolarHBondContact CA-O 3.24Å; L82-A94 HydrophobicContact CD2-CB 3.82Å; L82-C105 HydrophobicContact CD2-CB 3.65Å; L82-Y143 HydrophobicContact CD1-CD1 3.92Å; L82-Y143 HydrophobicContact CD1-CE1 3.96Å; L82-F145 HydrophobicContact CD2-CE1 4.05Å; L82-F145 HydrophobicContact CD2-CZ 4.46Å
83	L	89.9	Confident	81.8	Confident	75 Å²	75	68.7 Å²	68.7	39%	0.393	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	129.5	-179.1	-55	178.5	0	0	0	109.2	P74 L81 H92 G93	P74-L83 HydrophobicContact CB-CD2 3.78Å; L81-L83 HydrophobicContact CD2-CD2 4.24Å; L81-L83 HydrophobicContact CG-CD2 4.36Å; L83-H92 CarbonylContact O-C 3.56Å; L83-H92 WeakPolarHBondContact O-CA 3.42Å; L83-G93 PolarHBondContact N-O 3.12Å; L83-G93 PolarHBondContact O-N 3.21Å
84	P	85	Confident	83.6	Confident	97 Å²	97	66.6 Å²	66.6	63%	0.63	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.2	137.2	177.8	28	-33.8	0	0	0	111.3
85	L	81.7	Confident	85	Confident	63 Å²	63	66.5 Å²	66.5	33%	0.33	37%	0.373	S	S	.	.			trans	-103.2	118.4	173.3	-59.6	178.3	0	0	0	109.7	D87 R88 L91 L104	L85-D87 PolarHBondContact O-N 3.04Å; L85-D87 VanDerWaalsContact O-N 3.17Å; L85-R88 PolarHBondContact O-N 3.23Å; L85-L91 HydrophobicContact CD1-CB 4.45Å; L85-L91 HydrophobicContact CD1-CD2 4.19Å; L85-L91 HydrophobicContact CD1-CG 4.17Å; L85-L104 HydrophobicContact CD1-CD2 4Å
86	A	69.1	Low	85.5	Confident	106 Å²	106	64.9 Å²	64.9	88%	0.876	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-30.7	-175.5	0	0	0	0	0	114
87	D	68.2	Low	85.7	Confident	159 Å²	159	60 Å²	60	85%	0.85	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.4	-3.5	-172.2	-60	-42.6	0	0	0	114.8	L85	L85-D87 PolarHBondContact O-N 3.04Å; L85-D87 VanDerWaalsContact O-N 3.17Å
88	R	70.3	Confident	85.8	Confident	70 Å²	70	64.2 Å²	64.2	26%	0.264	37%	0.371	S	S	.	.			trans	-144.3	83.1	-169.2	-63.1	176.6	86.1	172.2	3.2	112.2	L85 S90 L91 D149 E210	L85-R88 PolarHBondContact O-N 3.23Å; R88-S90 PolarHBondContact O-N 2.79Å; R88-L91 HydrophobicContact CB-CB 3.93Å; R88-L91 PolarHBondContact O-N 2.83Å; R88-L91 VanDerWaalsContact O-O 3.1Å; R88-D149 IonicContact CZ-OD2 2.78Å; R88-D149 IonicContact NH1-OD1 2.72Å; R88-D149 IonicContact NH1-OD2 2.69Å; R88-D149 PolarHBondContact NH1-OD2 3.05Å; R88-D149 IonicContact NH2-OD2 3.39Å; R88-E210 IonicContact NH2-OE1 2.66Å; R88-E210 IonicContact NH2-OE2 2.71Å; R88-E210 PolarHBondContact NH2-OE2 2.63Å
89	E	63	Low	86.1	Confident	203 Å²	203	66.6 Å²	66.6	95%	0.949	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.5	-31.2	-172.8	-60.3	179.3	148	0	0	116.4
90	S	73.5	Confident	86.1	Confident	90 Å²	90	67.8 Å²	67.8	63%	0.629	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.9	3	-179.4	59.1	0	0	0	0	114.9	R88	R88-S90 PolarHBondContact O-N 2.79Å
91	L	87.8	Confident	86.1	Confident	6 Å²	6	70.9 Å²	70.9	3%	0.031	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	131.1	-172.4	-166	71.8	0	0	0	112.1	L85 R88 L104 K106	L85-L91 HydrophobicContact CD1-CB 4.45Å; L85-L91 HydrophobicContact CD1-CD2 4.19Å; L85-L91 HydrophobicContact CD1-CG 4.17Å; R88-L91 HydrophobicContact CB-CB 3.93Å; R88-L91 PolarHBondContact O-N 2.83Å; R88-L91 VanDerWaalsContact O-O 3.1Å; L91-L104 HydrophobicContact CD1-CB 4.11Å; L91-L104 HydrophobicContact CD2-CB 4.37Å; L91-L104 HydrophobicContact CD2-CD1 4.2Å; L91-L104 HydrophobicContact CD2-CD2 3.98Å; L91-L104 HydrophobicContact CD2-CG 4.41Å; L91-L104 HydrophobicContact CG-CB 4.39Å; L91-L104 HydrophobicContact CG-CD2 4.38Å; L91-K106 HydrophobicContact CD1-CB 4.48Å; L91-K106 HydrophobicContact CD1-CD 4.2Å; L91-K106 HydrophobicContact CD1-CG 3.31Å
92	H	91.9	Very high	86.1	Confident	60 Å²	60	74.4 Å²	74.4	28%	0.278	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	147.6	176.4	-59.6	69.1	0	0	0	109.4	L82 L83 L104 C105	L82-H92 HydrophobicContact CB-CB 4.48Å; L83-H92 CarbonylContact O-C 3.56Å; L83-H92 WeakPolarHBondContact O-CA 3.42Å; H92-L104 CarbonylContact O-C 3.31Å; H92-L104 WeakPolarHBondContact O-CA 3.38Å; H92-C105 HydrophobicContact CB-CB 4.36Å; H92-C105 PolarHBondContact N-O 2.77Å; H92-C105 PolarHBondContact O-N 2.73Å
93	G	93.3	Very high	86.3	Confident	10 Å²	10	74.8 Å²	74.8	10%	0.103	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	146.7	157.2	0	0	0	0	0	108.5	L82 L83	L82-G93 CarbonylContact C-O 3.58Å; L82-G93 WeakPolarHBondContact CA-O 3.24Å; L83-G93 PolarHBondContact N-O 3.12Å; L83-G93 PolarHBondContact O-N 3.21Å
94	A	94.8	Very high	86.5	Confident	4 Å²	4	72.1 Å²	72.1	3%	0.033	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	131.3	175.2	0	0	0	0	0	109.3	L81 L82 L103 C105 F145	L81-A94 WeakPolarHBondContact O-CA 3.19Å; L82-A94 HydrophobicContact CD2-CB 3.82Å; A94-L103 HydrophobicContact CB-CB 4.19Å; A94-L103 PolarHBondContact N-O 2.9Å; A94-L103 PolarHBondContact O-N 3.09Å; A94-C105 HydrophobicContact CB-CB 3.99Å; A94-F145 HydrophobicContact CB-CD1 3.91Å; A94-F145 HydrophobicContact CB-CE1 3.77Å
95	M	94.8	Very high	87	Confident	76 Å²	76	67.5 Å²	67.5	37%	0.374	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	125.9	172.3	-175.1	179.1	68.8	0	0	109.1	F80 L81 T97 D101	F80-M95 WeakPolarHBondContact CA-O 3.33Å; L81-M95 HydrophobicContact CD2-CE 4.24Å; L81-M95 PolarHBondContact N-O 2.85Å; L81-M95 PolarHBondContact O-N 2.95Å; M95-T97 PolarHBondContact O-N 3.29Å; M95-D101 WeakPolarHBondContact CA-O 3.35Å
96	N	93.9	Very high	87.5	Confident	23 Å²	23	64.9 Å²	64.9	12%	0.123	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	119.4	171.6	-172.8	-13.2	0	0	0	109.4	A79 F80 D98 T99 G100 D101	A79-N96 CarbonylContact O-C 3.58Å; A79-N96 PolarHBondContact O-OD1 3.44Å; F80-N96 HydrophobicContact CD1-CB 3.98Å; F80-N96 HydrophobicContact CE1-CB 3.78Å; N96-D98 PolarHBondContact O-N 3.26Å; N96-D98 PolarHBondContact OD1-N 2.89Å; N96-T99 WeakPolarHBondContact CB-OG1 3.26Å; N96-T99 VanDerWaalsContact CG-OG1 3.25Å; N96-T99 PolarHBondContact ND2-OG1 2.71Å; N96-G100 VanDerWaalsContact O-CA 3.28Å; N96-G100 WeakPolarHBondContact O-CA 3.31Å; N96-G100 PolarHBondContact O-N 3.12Å; N96-D101 HydrophobicContact CB-CB 4.17Å; N96-D101 PolarHBondContact N-O 2.86Å
97	T	92.6	Very high	88.7	Confident	59 Å²	59	61.9 Å²	61.9	36%	0.362	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-19.2	-179.7	58.4	0	0	0	0	113.3	R76 A79 L81 M95	R76-T97 PolarHBondContact NH2-OG1 3.07Å; R76-T97 VanDerWaalsContact NH2-OG1 3.1Å; A79-T97 PolarHBondContact O-N 2.77Å; A79-T97 PolarHBondContact O-OG1 2.85Å; L81-T97 HydrophobicContact CB-CG2 4.45Å; M95-T97 PolarHBondContact O-N 3.29Å
98	D	92.1	Very high	89.9	Confident	120 Å²	120	55.6 Å²	55.6	64%	0.642	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.8	-27	-170.2	-52.3	-8.2	0	0	0	111.7	A79 N96	A79-D98 WeakPolarHBondContact CB-OD2 3.18Å; N96-D98 PolarHBondContact O-N 3.26Å; N96-D98 PolarHBondContact OD1-N 2.89Å
99	T	93.6	Very high	91.1	Very high	87 Å²	87	56.2 Å²	56.2	53%	0.534	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.5	-18.6	179.1	63.5	0	0	0	0	114.4	N96 D101	N96-T99 WeakPolarHBondContact CB-OG1 3.26Å; N96-T99 VanDerWaalsContact CG-OG1 3.25Å; N96-T99 PolarHBondContact ND2-OG1 2.71Å; T99-D101 VanDerWaalsContact C-N 3.26Å; T99-D101 WeakPolarHBondContact CB-OD2 3.09Å; T99-D101 WeakPolarHBondContact OG1-CB 3.34Å; T99-D101 PolarHBondContact OG1-N 3.5Å; T99-D101 PolarHBondContact OG1-OD2 3.36Å
100	G	92.6	Very high	92.5	Very high	50 Å²	50	49.4 Å²	49.4	52%	0.515	28%	0.282	S	S	.	.			trans	78.1	2.6	-169.7	0	0	0	0	0	114.8	N96 E102	N96-G100 VanDerWaalsContact O-CA 3.28Å; N96-G100 WeakPolarHBondContact O-CA 3.31Å; N96-G100 PolarHBondContact O-N 3.12Å; G100-E102 PolarHBondContact O-N 3.33Å
101	D	93.3	Very high	93.5	Very high	79 Å²	79	49 Å²	49	42%	0.422	29%	0.292	S	S	.	.			trans	-61.6	126.5	-179.5	-69.5	-51.2	0	0	0	111.7	M95 N96 T99	M95-D101 WeakPolarHBondContact CA-O 3.35Å; N96-D101 HydrophobicContact CB-CB 4.17Å; N96-D101 PolarHBondContact N-O 2.86Å; T99-D101 VanDerWaalsContact C-N 3.26Å; T99-D101 WeakPolarHBondContact CB-OD2 3.09Å; T99-D101 WeakPolarHBondContact OG1-CB 3.34Å; T99-D101 PolarHBondContact OG1-N 3.5Å; T99-D101 PolarHBondContact OG1-OD2 3.36Å
102	E	95	Very high	93.8	Very high	117 Å²	117	51.8 Å²	51.8	55%	0.547	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	127.9	167.8	-69.9	-174	-132.9	0	0	111.4	G100 K148	G100-E102 PolarHBondContact O-N 3.33Å; E102-K148 HydrophobicContact CB-CD 3.84Å; E102-K148 WeakPolarHBondContact O-CB 3.45Å; E102-K148 IonicContact OE1-NZ 2.77Å; E102-K148 WeakPolarHBondContact OE2-CD 3.43Å; E102-K148 WeakPolarHBondContact OE2-CE 3.4Å; E102-K148 IonicContact OE2-NZ 3.64Å; E102-K148 PolarHBondContact OE2-NZ 3.14Å
103	L	95.2	Very high	93.9	Very high	16 Å²	16	49.6 Å²	49.6	8%	0.084	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	176.4	-176.7	-62.8	178.5	0	0	0	110.3	F80 A94 R133 F145 L146	F80-L103 HydrophobicContact CD1-CD1 4.37Å; F80-L103 HydrophobicContact CE1-CD1 3.68Å; F80-L103 HydrophobicContact CZ-CD1 4.41Å; A94-L103 HydrophobicContact CB-CB 4.19Å; A94-L103 PolarHBondContact N-O 2.9Å; A94-L103 PolarHBondContact O-N 3.09Å; L103-R133 HydrophobicContact CD1-CG 4.35Å; L103-R133 HydrophobicContact CD2-CG 4.33Å; L103-F145 HydrophobicContact CD1-CB 4.42Å; L103-L146 WeakPolarHBondContact CB-O 3.12Å
104	L	95.1	Very high	94	Very high	19 Å²	19	55.3 Å²	55.3	10%	0.099	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	144	169.8	-62.8	166.3	0	0	0	109.1	L85 L91 H92 F145 L146 D149	L85-L104 HydrophobicContact CD1-CD2 4Å; L91-L104 HydrophobicContact CD1-CB 4.11Å; L91-L104 HydrophobicContact CD2-CB 4.37Å; L91-L104 HydrophobicContact CD2-CD1 4.2Å; L91-L104 HydrophobicContact CD2-CD2 3.98Å; L91-L104 HydrophobicContact CD2-CG 4.41Å; L91-L104 HydrophobicContact CG-CB 4.39Å; L91-L104 HydrophobicContact CG-CD2 4.38Å; H92-L104 CarbonylContact O-C 3.31Å; H92-L104 WeakPolarHBondContact O-CA 3.38Å; L104-F145 CarbonylContact O-C 3.55Å; L104-F145 WeakPolarHBondContact O-CA 3.33Å; L104-L146 HydrophobicContact CB-CB 4.41Å; L104-L146 PolarHBondContact N-O 3.48Å; L104-L146 PolarHBondContact O-N 3.22Å; L104-D149 HydrophobicContact CD1-CB 4.2Å; L104-D149 WeakPolarHBondContact CD1-OD2 3.42Å
105	C	95	Very high	93.9	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	120.8	-179.5	175.6	0	0	0	0	111.1	L82 H92 A94 V144 F145	L82-C105 HydrophobicContact CD2-CB 3.65Å; H92-C105 HydrophobicContact CB-CB 4.36Å; H92-C105 PolarHBondContact N-O 2.77Å; H92-C105 PolarHBondContact O-N 2.73Å; A94-C105 HydrophobicContact CB-CB 3.99Å; C105-V144 WeakPolarHBondContact CA-O 3.3Å; C105-F145 HydrophobicContact CB-CD1 3.91Å; C105-F145 HydrophobicContact CB-CE1 3.8Å
106	K	93.4	Very high	93.8	Very high	8 Å²	8	61.1 Å²	61.1	4%	0.035	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	138.5	168	-69	-173	177.8	-177.2	0	109.9	L91 F108 V144 L146 E210 E213	L91-K106 HydrophobicContact CD1-CB 4.48Å; L91-K106 HydrophobicContact CD1-CD 4.2Å; L91-K106 HydrophobicContact CD1-CG 3.31Å; K106-F108 HydrophobicContact CB-CD2 4.36Å; K106-F108 HydrophobicContact CB-CE2 3.55Å; K106-F108 HydrophobicContact CB-CZ 3.73Å; K106-F108 HydrophobicContact CD-CE2 4.49Å; K106-F108 HydrophobicContact CD-CZ 3.97Å; K106-F108 HydrophobicContact CG-CZ 4.46Å; K106-V144 PolarHBondContact N-O 3.01Å; K106-V144 PolarHBondContact O-N 3.02Å; K106-L146 HydrophobicContact CD-CD1 4.14Å; K106-L146 HydrophobicContact CG-CD1 4.34Å; K106-E210 WeakPolarHBondContact CE-OE1 3.32Å; K106-E210 IonicContact NZ-OE1 3.7Å; K106-E210 PolarHBondContact NZ-OE1 2.85Å; K106-E213 VanDerWaalsContact CD-OE1 3.25Å; K106-E213 WeakPolarHBondContact CD-OE1 3.42Å; K106-E213 WeakPolarHBondContact CD-OE2 3.49Å; K106-E213 IonicContact NZ-OE1 3.83Å; K106-E213 PolarHBondContact NZ-OE1 3.2Å; K106-E213 IonicContact NZ-OE2 3.44Å; K106-E213 PolarHBondContact NZ-OE2 3.4Å
107	V	93	Very high	93.8	Very high	44 Å²	44	61.2 Å²	61.2	27%	0.267	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	116.2	-177.1	-172	0	0	0	0	109.1	K141 A142 Y143	V107-K141 HydrophobicContact CG1-CB 3.92Å; V107-K141 HydrophobicContact CG1-CD 4.13Å; V107-K141 HydrophobicContact CG1-CG 4.05Å; V107-A142 WeakPolarHBondContact CA-O 3.41Å; V107-Y143 HydrophobicContact CG1-CD1 4.2Å; V107-Y143 HydrophobicContact CG1-CE1 3.93Å; V107-Y143 HydrophobicContact CG2-CD1 3.8Å; V107-Y143 HydrophobicContact CG2-CE1 4Å
108	F	93.6	Very high	94	Very high	27 Å²	27	66.4 Å²	66.4	12%	0.118	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	153.5	-178.1	-58.8	-77.9	0	0	0	110.9	K106 K116 K141 A142 V144 E213	K106-F108 HydrophobicContact CB-CD2 4.36Å; K106-F108 HydrophobicContact CB-CE2 3.55Å; K106-F108 HydrophobicContact CB-CZ 3.73Å; K106-F108 HydrophobicContact CD-CE2 4.49Å; K106-F108 HydrophobicContact CD-CZ 3.97Å; K106-F108 HydrophobicContact CG-CZ 4.46Å; F108-K116 HydrophobicContact CD1-CB 4.19Å; F108-K116 HydrophobicContact CD1-CG 4.12Å; F108-K116 HydrophobicContact CE1-CB 4.02Å; F108-K116 HydrophobicContact CE1-CG 4.11Å; F108-K116 HydrophobicContact CZ-CB 4.36Å; F108-K141 CarbonylContact O-C 3.52Å; F108-K141 VanDerWaalsContact O-CA 3.22Å; F108-K141 WeakPolarHBondContact O-CA 3.38Å; F108-A142 PolarHBondContact N-O 2.99Å; F108-A142 PolarHBondContact O-N 3.44Å; F108-V144 HydrophobicContact CD2-CB 4.38Å; F108-V144 HydrophobicContact CD2-CG2 3.8Å; F108-V144 HydrophobicContact CE2-CB 4.03Å; F108-V144 HydrophobicContact CE2-CG2 3.83Å; F108-E213 HydrophobicContact CE1-CG 4.2Å; F108-E213 HydrophobicContact CZ-CG 3.85Å
109	D	94.9	Very high	94.1	Very high	82 Å²	82	60.9 Å²	60.9	44%	0.439	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	144.1	168.6	-74.7	-81.9	0	0	0	111.8	G111 V112 Y113 K141	D109-G111 PolarHBondContact O-N 2.82Å; D109-G111 VanDerWaalsContact O-N 3.08Å; D109-V112 HydrophobicContact CB-CG2 4.17Å; D109-V112 WeakPolarHBondContact O-CG2 3.49Å; D109-V112 PolarHBondContact O-N 3.34Å; D109-Y113 PolarHBondContact O-N 3.48Å; D109-K141 IonicContact OD1-NZ 3.31Å; D109-K141 PolarHBondContact OD1-NZ 3.49Å; D109-K141 IonicContact OD2-NZ 3.72Å; D109-K141 PolarHBondContact OD2-NZ 2.96Å
110	M	93.8	Very high	94.2	Very high	60 Å²	60	58.6 Å²	58.6	30%	0.296	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-26.4	-175.2	-166.2	60.4	59.3	0	0	113.2	Y113 L137 G138 R140 K141 A142	M110-Y113 HydrophobicContact CG-CE1 4.41Å; M110-Y113 VanDerWaalsContact O-CD1 3.31Å; M110-Y113 WeakPolarHBondContact O-CD1 3.44Å; M110-Y113 HydrophobicContact SD-CD1 3.81Å; M110-Y113 HydrophobicContact SD-CE1 3.33Å; M110-Y113 WeakPolarHBondContact SD-CE1 3.26Å; M110-L137 HydrophobicContact CE-CB 4.31Å; M110-L137 HydrophobicContact CE-CD2 4.31Å; M110-L137 HydrophobicContact SD-CD2 4.4Å; M110-G138 WeakPolarHBondContact CE-O 3.38Å; M110-R140 WeakPolarHBondContact CB-O 3.36Å; M110-R140 PolarHBondContact N-O 3.44Å; M110-K141 WeakPolarHBondContact CE-O 3.36Å; M110-A142 HydrophobicContact CE-CB 4.46Å
111	G	94.1	Very high	94.2	Very high	81 Å²	81	59.3 Å²	59.3	84%	0.835	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-17.1	176.6	0	0	0	0	0	115.4	D109	D109-G111 PolarHBondContact O-N 2.82Å; D109-G111 VanDerWaalsContact O-N 3.08Å
112	V	94	Very high	94.3	Very high	65 Å²	65	59.2 Å²	59.2	39%	0.394	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125	-16.6	-173.5	-60	0	0	0	0	114.6	D109 Q114 E115 K116	D109-V112 HydrophobicContact CB-CG2 4.17Å; D109-V112 WeakPolarHBondContact O-CG2 3.49Å; D109-V112 PolarHBondContact O-N 3.34Å; V112-Q114 VanDerWaalsContact C-N 3.26Å; V112-Q114 PolarHBondContact O-N 2.91Å; V112-E115 PolarHBondContact O-N 2.78Å; V112-K116 PolarHBondContact O-N 2.99Å; V112-K116 VanDerWaalsContact O-N 3.16Å
113	Y	94.3	Very high	94.3	Very high	15 Å²	15	54.5 Å²	54.5	6%	0.059	30%	0.302	C	S	.	.	H	α-helix	trans	-58.8	-36.2	-174.1	87.8	-81.9	0	0	0	113.2	D109 M110 E115 K116 I117 L137 A142	D109-Y113 PolarHBondContact O-N 3.48Å; M110-Y113 HydrophobicContact CG-CE1 4.41Å; M110-Y113 VanDerWaalsContact O-CD1 3.31Å; M110-Y113 WeakPolarHBondContact O-CD1 3.44Å; M110-Y113 HydrophobicContact SD-CD1 3.81Å; M110-Y113 HydrophobicContact SD-CE1 3.33Å; M110-Y113 WeakPolarHBondContact SD-CE1 3.26Å; Y113-E115 VanDerWaalsContact C-N 3.34Å; Y113-E115 PolarHBondContact O-N 2.71Å; Y113-K116 PolarHBondContact O-N 3.2Å; Y113-I117 HydrophobicContact CD2-CD1 3.92Å; Y113-I117 HydrophobicContact CD2-CG1 4.49Å; Y113-I117 HydrophobicContact CE2-CD1 4Å; Y113-I117 WeakPolarHBondContact O-CG1 3.49Å; Y113-I117 PolarHBondContact O-N 2.87Å; Y113-L137 HydrophobicContact CD2-CD2 4.4Å; Y113-L137 HydrophobicContact CE1-CD2 4.35Å; Y113-L137 HydrophobicContact CE2-CD2 3.81Å; Y113-A142 HydrophobicContact CD1-CB 3.9Å; Y113-A142 HydrophobicContact CD2-CB 3.7Å; Y113-A142 HydrophobicContact CE2-CB 4.36Å; Y113-A142 HydrophobicContact CG-CB 3.44Å; Y113-A142 VanDerWaalsContact CG-CB 3.44Å
114	Q	94.4	Very high	94.4	Very high	130 Å²	130	57.2 Å²	57.2	61%	0.607	32%	0.321	S	S	*	.	H	α-helix	trans	-63.4	-39.4	-178.6	-65.9	-165.2	-24.3	0	0	112.4	V112 R118	V112-Q114 VanDerWaalsContact C-N 3.26Å; V112-Q114 PolarHBondContact O-N 2.91Å; Q114-R118 WeakPolarHBondContact O-CB 3.2Å; Q114-R118 PolarHBondContact O-N 3.02Å
115	E	92.8	Very high	94.4	Very high	146 Å²	146	62.9 Å²	62.9	68%	0.682	36%	0.358	S	S	*	.	H	α-helix	trans	-65.5	-49.6	173.4	-176.5	176.1	-151.9	0	0	110.2	V112 Y113 I117 R118	V112-E115 PolarHBondContact O-N 2.78Å; Y113-E115 VanDerWaalsContact C-N 3.34Å; Y113-E115 PolarHBondContact O-N 2.71Å; E115-I117 PolarHBondContact O-N 3.31Å; E115-R118 VanDerWaalsContact O-CB 3.3Å; E115-R118 WeakPolarHBondContact O-CB 3.48Å; E115-R118 PolarHBondContact O-N 3.42Å
116	K	93.1	Very high	94.5	Very high	55 Å²	55	64.9 Å²	64.9	24%	0.239	37%	0.368	C	S	.	.	H	α-helix	trans	-61.3	-23.3	179.2	-67.7	-57.8	-175.1	-175.6	0	114.7	F108 V112 Y113 E213 D214	F108-K116 HydrophobicContact CD1-CB 4.19Å; F108-K116 HydrophobicContact CD1-CG 4.12Å; F108-K116 HydrophobicContact CE1-CB 4.02Å; F108-K116 HydrophobicContact CE1-CG 4.11Å; F108-K116 HydrophobicContact CZ-CB 4.36Å; V112-K116 PolarHBondContact O-N 2.99Å; V112-K116 VanDerWaalsContact O-N 3.16Å; Y113-K116 PolarHBondContact O-N 3.2Å; K116-E213 HydrophobicContact CB-CG 4.29Å; K116-E213 HydrophobicContact CD-CB 4.07Å; K116-E213 HydrophobicContact CD-CG 4.47Å; K116-E213 WeakPolarHBondContact CD-O 3.45Å; K116-E213 PolarHBondContact NZ-O 3.42Å; K116-D214 IonicContact NZ-OD1 2.68Å; K116-D214 PolarHBondContact NZ-OD1 2.97Å
117	I	95.1	Very high	94.7	Very high	26 Å²	26	71 Å²	71	13%	0.133	39%	0.391	C	S	.	.	H	α-helix	trans	-103.7	-3.6	173.5	73.7	176.1	0	0	0	114.9	Y113 E115 A119 Y120 I132 I135 V144	Y113-I117 HydrophobicContact CD2-CD1 3.92Å; Y113-I117 HydrophobicContact CD2-CG1 4.49Å; Y113-I117 HydrophobicContact CE2-CD1 4Å; Y113-I117 WeakPolarHBondContact O-CG1 3.49Å; Y113-I117 PolarHBondContact O-N 2.87Å; E115-I117 PolarHBondContact O-N 3.31Å; I117-A119 PolarHBondContact O-N 3.04Å; I117-A119 VanDerWaalsContact O-N 3.11Å; I117-Y120 HydrophobicContact CB-CD2 4.17Å; I117-Y120 WeakPolarHBondContact O-CD2 3.44Å; I117-Y120 PolarHBondContact O-N 3.17Å; I117-Y120 VanDerWaalsContact O-N 3.11Å; I117-I132 HydrophobicContact CB-CD1 3.84Å; I117-I132 HydrophobicContact CG2-CD1 3.77Å; I117-I135 HydrophobicContact CD1-CD1 3.62Å; I117-V144 HydrophobicContact CG2-CG1 4.4Å; I117-V144 HydrophobicContact CG2-CG2 3.98Å
118	R	95.4	Very high	94.9	Very high	168 Å²	168	69 Å²	69	63%	0.634	38%	0.378	S	S	*	.	H	α-helix	trans	-55.1	-37.5	-172.4	-169.7	179.1	173.6	-167.7	-2.8	112.8	Q114 E115 Y120 G121 I217	Q114-R118 WeakPolarHBondContact O-CB 3.2Å; Q114-R118 PolarHBondContact O-N 3.02Å; E115-R118 VanDerWaalsContact O-CB 3.3Å; E115-R118 WeakPolarHBondContact O-CB 3.48Å; E115-R118 PolarHBondContact O-N 3.42Å; R118-Y120 PolarHBondContact O-N 3.09Å; R118-G121 PolarHBondContact O-N 3.03Å; R118-G121 VanDerWaalsContact O-N 3.14Å; R118-I217 HydrophobicContact CB-CD1 4.07Å; R118-I217 HydrophobicContact CG-CD1 3.68Å
119	A	95.5	Very high	95.1	Very high	4 Å²	4	68.4 Å²	68.4	3%	0.033	38%	0.377	C	S	.	.	H	α-helix	trans	-63	-39.1	-179.1	0	0	0	0	0	113.8	I117 G121 V122 L123 I187 L212 C215 I217	I117-A119 PolarHBondContact O-N 3.04Å; I117-A119 VanDerWaalsContact O-N 3.11Å; A119-G121 PolarHBondContact O-N 3.48Å; A119-V122 WeakPolarHBondContact O-CG2 3.39Å; A119-V122 PolarHBondContact O-N 3.36Å; A119-L123 WeakPolarHBondContact O-CB 3.38Å; A119-L123 PolarHBondContact O-N 3Å; A119-I187 HydrophobicContact CB-CD1 4.22Å; A119-L212 HydrophobicContact CB-CB 3.58Å; A119-L212 HydrophobicContact CB-CD1 3.91Å; A119-L212 HydrophobicContact CB-CG 4.35Å; A119-C215 WeakPolarHBondContact CB-SG 3.26Å; A119-I217 HydrophobicContact CB-CD1 4.37Å; A119-I217 HydrophobicContact CB-CG1 4.48Å
120	Y	95.3	Very high	95.1	Very high	38 Å²	38	64.7 Å²	64.7	15%	0.149	36%	0.357	C	S	.	.	H	α-helix	trans	-69.6	-16.8	176.9	-50.2	-92.4	0	0	0	112.5	I117 R118 A130 I132 S211 L212 E213	I117-Y120 HydrophobicContact CB-CD2 4.17Å; I117-Y120 WeakPolarHBondContact O-CD2 3.44Å; I117-Y120 PolarHBondContact O-N 3.17Å; I117-Y120 VanDerWaalsContact O-N 3.11Å; R118-Y120 PolarHBondContact O-N 3.09Å; Y120-A130 WeakPolarHBondContact CE1-O 3.39Å; Y120-I132 HydrophobicContact CD1-CD1 4.44Å; Y120-I132 HydrophobicContact CD1-CG1 4.16Å; Y120-I132 HydrophobicContact CD2-CD1 3.59Å; Y120-I132 HydrophobicContact CD2-CG1 4.14Å; Y120-I132 HydrophobicContact CE1-CG1 4.43Å; Y120-I132 HydrophobicContact CE2-CD1 4.07Å; Y120-I132 HydrophobicContact CE2-CG1 4.4Å; Y120-I132 HydrophobicContact CG-CD1 3.79Å; Y120-I132 HydrophobicContact CG-CG1 4Å; Y120-S211 VanDerWaalsContact OH-CA 3.31Å; Y120-S211 WeakPolarHBondContact OH-CA 3.19Å; Y120-L212 HydrophobicContact CD1-CD1 3.73Å; Y120-L212 HydrophobicContact CD1-CG 4.31Å; Y120-L212 HydrophobicContact CE1-CB 4.18Å; Y120-L212 HydrophobicContact CE1-CD1 3.92Å; Y120-L212 HydrophobicContact CE1-CG 3.97Å; Y120-L212 HydrophobicContact CE2-CB 4.09Å; Y120-L212 HydrophobicContact CG-CD1 4.12Å; Y120-L212 PolarHBondContact OH-N 3.37Å; Y120-L212 VanDerWaalsContact OH-N 3.08Å; Y120-E213 PolarHBondContact OH-OE1 2.8Å
121	G	93.1	Very high	95.2	Very high	65 Å²	65	63.6 Å²	63.6	67%	0.67	36%	0.362	S	S	*	.	H	α-helix	trans	-82.2	-18.9	174.6	0	0	0	0	0	114.6	R118 A119	R118-G121 PolarHBondContact O-N 3.03Å; R118-G121 VanDerWaalsContact O-N 3.14Å; A119-G121 PolarHBondContact O-N 3.48Å
122	V	93.5	Very high	95.2	Very high	77 Å²	77	62 Å²	62	47%	0.467	33%	0.334	S	S	.	.	H	α-helix	trans	-108.2	-26.2	178.4	-59.5	0	0	0	0	113.2	A119 P124 I187 I217	A119-V122 WeakPolarHBondContact O-CG2 3.39Å; A119-V122 PolarHBondContact O-N 3.36Å; V122-P124 WeakPolarHBondContact O-CD 3.28Å; V122-I187 HydrophobicContact CG2-CD1 4.11Å; V122-I217 HydrophobicContact CG2-CD1 4.04Å; V122-I217 HydrophobicContact CG2-CG1 4.36Å; V122-I217 HydrophobicContact CG2-CG2 4.4Å
123	L	96	Very high	95.3	Very high	18 Å²	18	66.7 Å²	66.7	9%	0.094	34%	0.344	C	S	.	.	S	Bend	trans	-80	123	178.9	-169.3	65.5	0	0	0	111.2	A119 V129 H181 A185 I187 L212	A119-L123 WeakPolarHBondContact O-CB 3.38Å; A119-L123 PolarHBondContact O-N 3Å; L123-V129 HydrophobicContact CD2-CG1 3.99Å; L123-V129 HydrophobicContact CD2-CG2 4.38Å; L123-H181 VanDerWaalsContact CD1-CD2 3.44Å; L123-H181 WeakPolarHBondContact CD1-CD2 3.32Å; L123-A185 HydrophobicContact CD1-CB 3.39Å; L123-I187 HydrophobicContact CB-CD1 3.98Å; L123-I187 HydrophobicContact CD1-CD1 4.1Å; L123-I187 HydrophobicContact CG-CD1 4.43Å; L123-L212 HydrophobicContact CB-CD1 4.49Å; L123-L212 HydrophobicContact CD2-CD1 3.63Å
124	P	96.2	Very high	95.3	Very high	74 Å²	74	67.4 Å²	67.4	48%	0.481	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-61.8	147.1	172.1	-22.4	34.2	0	0	0	111.4	V122 H126 H181	V122-P124 WeakPolarHBondContact O-CD 3.28Å; P124-H126 PolarHBondContact O-N 3.05Å; P124-H181 PolarHBondContact O-NE2 2.87Å
125	P	95.8	Very high	95.3	Very high	138 Å²	138	61.6 Å²	61.6	90%	0.896	32%	0.322	S	S	*	.	P	Polyproline II helix	trans	-57.8	129.1	179.6	-26.2	35	0	0	0	112.8
126	H	97.1	Very high	95.5	Very high	42 Å²	42	55.2 Å²	55.2	19%	0.194	29%	0.293	C	S	.	.			trans	-138.8	133.9	178.3	176.8	-112.5	0	0	0	111.3	P124 N128 V129 H181	P124-H126 PolarHBondContact O-N 3.05Å; H126-N128 PolarHBondContact CE1-OD1 2.82Å; H126-N128 PolarHBondContact ND1-N 3.25Å; H126-N128 PolarHBondContact O-N 2.95Å; H126-V129 PolarHBondContact O-N 3.47Å; H126-V129 VanDerWaalsContact O-O 3.08Å; H126-H181 VanDerWaalsContact CB-CD2 3.42Å; H126-H181 WeakPolarHBondContact CB-CD2 2.92Å; H126-H181 WeakPolarHBondContact CB-NE2 3.41Å; H126-H181 AromaticContact CG-CD2 3.97Å; H126-H181 AromaticContact CG-CG 3.9Å
127	R	97	Very high	95.6	Very high	137 Å²	137	53.9 Å²	53.9	52%	0.517	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-24.1	-171.5	71.4	-178.6	-156.6	-57.2	-11	115.4	H206	R127-H206 PolarHBondContact O-CE1 2.91Å; R127-H206 PolarHBondContact O-NE2 2.6Å
128	N	98.2	Very high	95.5	Very high	1 Å²	1	54.3 Å²	54.3	1%	0.005	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	18	178.5	-55.1	115.8	0	0	0	113.2	H126 Q174 A178 H206 V207 R208 L209	H126-N128 PolarHBondContact CE1-OD1 2.82Å; H126-N128 PolarHBondContact ND1-N 3.25Å; H126-N128 PolarHBondContact O-N 2.95Å; N128-Q174 PolarHBondContact ND2-OE1 3.25Å; N128-A178 HydrophobicContact CB-CB 4.04Å; N128-A178 WeakPolarHBondContact O-CB 3.13Å; N128-H206 PolarHBondContact ND2-CE1 2.73Å; N128-H206 VanDerWaalsContact ND2-CE1 3.28Å; N128-V207 WeakPolarHBondContact CA-O 3.23Å; N128-V207 WeakPolarHBondContact CB-O 3.44Å; N128-V207 PolarHBondContact ND2-O 2.92Å; N128-R208 CarbonylContact O-C 3.55Å; N128-R208 VanDerWaalsContact O-CA 3.3Å; N128-R208 WeakPolarHBondContact O-CA 3.2Å; N128-L209 PolarHBondContact O-N 2.95Å
129	V	97.6	Very high	95.2	Very high	15 Å²	15	54.7 Å²	54.7	9%	0.091	31%	0.308	C	S	.	.	B	Isolated β-bridge	trans	-129.7	137.6	169.9	-176.4	0	0	0	0	108.3	L123 H126 G131 A178 L209 L212	L123-V129 HydrophobicContact CD2-CG1 3.99Å; L123-V129 HydrophobicContact CD2-CG2 4.38Å; H126-V129 PolarHBondContact O-N 3.47Å; H126-V129 VanDerWaalsContact O-O 3.08Å; V129-G131 PolarHBondContact O-N 2.86Å; V129-A178 HydrophobicContact CG2-CB 4.01Å; V129-L209 HydrophobicContact CG1-CB 4.45Å; V129-L209 HydrophobicContact CG1-CD2 4.41Å; V129-L209 HydrophobicContact CG2-CB 4.39Å; V129-L212 HydrophobicContact CG1-CD1 4.23Å; V129-L212 HydrophobicContact CG1-CD2 4.35Å; V129-L212 HydrophobicContact CG1-CG 4.34Å
130	A	95.4	Very high	95.1	Very high	3 Å²	3	63.5 Å²	63.5	3%	0.025	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-63.6	132.7	175.1	0	0	0	0	0	111.1	Y120 L209 E210	Y120-A130 WeakPolarHBondContact CE1-O 3.39Å; A130-L209 WeakPolarHBondContact CB-O 3.28Å; A130-L209 PolarHBondContact N-O 2.85Å; A130-E210 WeakPolarHBondContact CB-O 3.44Å
131	G	94.5	Very high	95.1	Very high	38 Å²	38	65.1 Å²	65.1	39%	0.392	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-93.5	153.3	168.8	0	0	0	0	0	111.3	V129 L146	V129-G131 PolarHBondContact O-N 2.86Å; G131-L146 WeakPolarHBondContact O-CD2 3.28Å
132	I	95.9	Very high	95.2	Very high	47 Å²	47	62 Å²	62	24%	0.241	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	131.2	165.8	-63.7	175.2	0	0	0	108.8	I117 Y120 I135 V144 L146	I117-I132 HydrophobicContact CB-CD1 3.84Å; I117-I132 HydrophobicContact CG2-CD1 3.77Å; Y120-I132 HydrophobicContact CD1-CD1 4.44Å; Y120-I132 HydrophobicContact CD1-CG1 4.16Å; Y120-I132 HydrophobicContact CD2-CD1 3.59Å; Y120-I132 HydrophobicContact CD2-CG1 4.14Å; Y120-I132 HydrophobicContact CE1-CG1 4.43Å; Y120-I132 HydrophobicContact CE2-CD1 4.07Å; Y120-I132 HydrophobicContact CE2-CG1 4.4Å; Y120-I132 HydrophobicContact CG-CD1 3.79Å; Y120-I132 HydrophobicContact CG-CG1 4Å; I132-I135 HydrophobicContact CD1-CD1 4.42Å; I132-I135 HydrophobicContact CG2-CD1 4.02Å; I132-I135 HydrophobicContact CG2-CG1 3.58Å; I132-V144 HydrophobicContact CB-CG1 4.47Å; I132-V144 HydrophobicContact CD1-CG1 3.83Å; I132-V144 HydrophobicContact CG1-CG1 3.82Å; I132-V144 HydrophobicContact CG2-CG1 3.89Å; I132-L146 HydrophobicContact CG1-CD2 4.22Å
133	R	94.9	Very high	95.2	Very high	163 Å²	163	60.4 Å²	60.4	62%	0.615	30%	0.302	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.7	-46.7	-176.3	-172.5	66.4	-178.7	-173.9	0.1	112.9	L103 F145	L103-R133 HydrophobicContact CD1-CG 4.35Å; L103-R133 HydrophobicContact CD2-CG 4.33Å; R133-F145 HydrophobicContact CB-CB 4.47Å; R133-F145 PolarHBondContact N-O 2.83Å
134	D	94.4	Very high	95.2	Very high	30 Å²	30	59.7 Å²	59.7	16%	0.16	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	163.4	172	-155.6	-13	0	0	0	109.2	K26 F145	K26-D134 IonicContact NZ-OD2 2.65Å; K26-D134 PolarHBondContact NZ-OD2 3.28Å; D134-F145 HydrophobicContact CB-CB 4.5Å; D134-F145 HydrophobicContact CB-CD2 4.4Å; D134-F145 PolarHBondContact O-N 3.3Å
135	I	95.6	Very high	95.2	Very high	8 Å²	8	56.2 Å²	56.2	4%	0.041	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	116.6	174.6	-53.1	176.5	0	0	0	109.2	I117 I132 L137 Y143 V144	I117-I135 HydrophobicContact CD1-CD1 3.62Å; I132-I135 HydrophobicContact CD1-CD1 4.42Å; I132-I135 HydrophobicContact CG2-CD1 4.02Å; I132-I135 HydrophobicContact CG2-CG1 3.58Å; I135-L137 HydrophobicContact CG2-CD2 3.89Å; I135-L137 HydrophobicContact CG2-CG 4.47Å; I135-Y143 WeakPolarHBondContact CA-O 3.47Å; I135-V144 HydrophobicContact CG2-CG2 4.39Å
136	I	95.5	Very high	95.2	Very high	13 Å²	13	49.9 Å²	49.9	7%	0.067	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	133.5	170.7	-61.7	176.6	0	0	0	109.1	L28 I77 F80 Y143 F145	L28-I136 HydrophobicContact CD1-CG2 4.34Å; I77-I136 HydrophobicContact CG2-CB 4.2Å; I77-I136 HydrophobicContact CG2-CD1 4.05Å; I77-I136 HydrophobicContact CG2-CG2 3.79Å; F80-I136 HydrophobicContact CD2-CD1 3.68Å; F80-I136 HydrophobicContact CE2-CD1 3.9Å; I136-Y143 PolarHBondContact N-O 3.43Å; I136-Y143 PolarHBondContact O-N 3.48Å; I136-F145 HydrophobicContact CB-CE2 4.25Å; I136-F145 HydrophobicContact CD1-CE2 3.94Å; I136-F145 HydrophobicContact CD1-CZ 4.33Å; I136-F145 HydrophobicContact CG1-CE2 3.99Å
137	L	95.7	Very high	95	Very high	26 Å²	26	51 Å²	51	14%	0.136	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	116.5	177.1	-57.9	179.2	0	0	0	109.2	M110 Y113 I135 A142	M110-L137 HydrophobicContact CE-CB 4.31Å; M110-L137 HydrophobicContact CE-CD2 4.31Å; M110-L137 HydrophobicContact SD-CD2 4.4Å; Y113-L137 HydrophobicContact CD2-CD2 4.4Å; Y113-L137 HydrophobicContact CE1-CD2 4.35Å; Y113-L137 HydrophobicContact CE2-CD2 3.81Å; I135-L137 HydrophobicContact CG2-CD2 3.89Å; I135-L137 HydrophobicContact CG2-CG 4.47Å; L137-A142 HydrophobicContact CD2-CB 3.66Å
138	G	92.1	Very high	94.9	Very high	36 Å²	36	48 Å²	48	37%	0.371	23%	0.233	S	C	.	.			trans	-91.4	-168.1	165.1	0	0	0	0	0	111.2	M110 K141	M110-G138 WeakPolarHBondContact CE-O 3.38Å; G138-K141 PolarHBondContact N-O 2.72Å
139	E	90.8	Very high	94.8	Very high	176 Å²	176	49.1 Å²	49.1	82%	0.822	24%	0.238	S	C	*	.	S	Bend	trans	-63.7	-48.1	178.7	-63.8	176.8	-172.3	0	0	113.4
140	R	92.4	Very high	94.7	Very high	189 Å²	189	51.4 Å²	51.4	71%	0.713	25%	0.247	S	C	*	.	S	Bend	trans	-116.2	-19	-169.6	-56.2	-175	-169.6	-164	1.1	113.8	M110	M110-R140 WeakPolarHBondContact CB-O 3.36Å; M110-R140 PolarHBondContact N-O 3.44Å
141	K	94.5	Very high	94.7	Very high	71 Å²	71	52.3 Å²	52.3	31%	0.309	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	144.5	-175.5	-62	-60.6	-163.1	-173.2	0	111.3	V107 F108 D109 M110 G138 Y143	V107-K141 HydrophobicContact CG1-CB 3.92Å; V107-K141 HydrophobicContact CG1-CD 4.13Å; V107-K141 HydrophobicContact CG1-CG 4.05Å; F108-K141 CarbonylContact O-C 3.52Å; F108-K141 VanDerWaalsContact O-CA 3.22Å; F108-K141 WeakPolarHBondContact O-CA 3.38Å; D109-K141 IonicContact OD1-NZ 3.31Å; D109-K141 PolarHBondContact OD1-NZ 3.49Å; D109-K141 IonicContact OD2-NZ 3.72Å; D109-K141 PolarHBondContact OD2-NZ 2.96Å; M110-K141 WeakPolarHBondContact CE-O 3.36Å; G138-K141 PolarHBondContact N-O 2.72Å; K141-Y143 HydrophobicContact CB-CE2 3.92Å
142	A	95.3	Very high	94.7	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	134.5	167.7	0	0	0	0	0	109.5	V107 F108 M110 Y113 L137	V107-A142 WeakPolarHBondContact CA-O 3.41Å; F108-A142 PolarHBondContact N-O 2.99Å; F108-A142 PolarHBondContact O-N 3.44Å; M110-A142 HydrophobicContact CE-CB 4.46Å; Y113-A142 HydrophobicContact CD1-CB 3.9Å; Y113-A142 HydrophobicContact CD2-CB 3.7Å; Y113-A142 HydrophobicContact CE2-CB 4.36Å; Y113-A142 HydrophobicContact CG-CB 3.44Å; Y113-A142 VanDerWaalsContact CG-CB 3.44Å; L137-A142 HydrophobicContact CD2-CB 3.66Å
143	Y	95.3	Very high	94.8	Very high	44 Å²	44	49.5 Å²	49.5	17%	0.173	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	108.3	-177.5	-58.9	-95.4	0	0	0	108	I77 L82 V107 I135 I136 K141	I77-Y143 HydrophobicContact CD1-CE1 3.9Å; I77-Y143 HydrophobicContact CD1-CE2 4.18Å; I77-Y143 HydrophobicContact CG1-CD1 4.07Å; I77-Y143 HydrophobicContact CG1-CE1 3.79Å; I77-Y143 HydrophobicContact CG2-CD1 4.33Å; I77-Y143 HydrophobicContact CG2-CD2 3.99Å; I77-Y143 HydrophobicContact CG2-CE2 4.3Å; I77-Y143 HydrophobicContact CG2-CG 4.02Å; L82-Y143 HydrophobicContact CD1-CD1 3.92Å; L82-Y143 HydrophobicContact CD1-CE1 3.96Å; V107-Y143 HydrophobicContact CG1-CD1 4.2Å; V107-Y143 HydrophobicContact CG1-CE1 3.93Å; V107-Y143 HydrophobicContact CG2-CD1 3.8Å; V107-Y143 HydrophobicContact CG2-CE1 4Å; I135-Y143 WeakPolarHBondContact CA-O 3.47Å; I136-Y143 PolarHBondContact N-O 3.43Å; I136-Y143 PolarHBondContact O-N 3.48Å; K141-Y143 HydrophobicContact CB-CE2 3.92Å
144	V	95.4	Very high	94.9	Very high	3 Å²	3	44.5 Å²	44.5	2%	0.018	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	114.1	-175.1	179.3	0	0	0	0	108.6	C105 K106 F108 I117 I132 I135	C105-V144 WeakPolarHBondContact CA-O 3.3Å; K106-V144 PolarHBondContact N-O 3.01Å; K106-V144 PolarHBondContact O-N 3.02Å; F108-V144 HydrophobicContact CD2-CB 4.38Å; F108-V144 HydrophobicContact CD2-CG2 3.8Å; F108-V144 HydrophobicContact CE2-CB 4.03Å; F108-V144 HydrophobicContact CE2-CG2 3.83Å; I117-V144 HydrophobicContact CG2-CG1 4.4Å; I117-V144 HydrophobicContact CG2-CG2 3.98Å; I132-V144 HydrophobicContact CB-CG1 4.47Å; I132-V144 HydrophobicContact CD1-CG1 3.83Å; I132-V144 HydrophobicContact CG1-CG1 3.82Å; I132-V144 HydrophobicContact CG2-CG1 3.89Å; I135-V144 HydrophobicContact CG2-CG2 4.39Å
145	F	95.5	Very high	94.9	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	138.9	-176.9	-63.1	-90.4	0	0	0	110.9	F80 L82 A94 L103 L104 C105 R133 D134 I136	F80-F145 HydrophobicContact CB-CE1 3.65Å; F80-F145 HydrophobicContact CB-CZ 3.86Å; F80-F145 HydrophobicContact CD1-CD1 4.16Å; F80-F145 AromaticContact CD1-CE1 3.93Å; F80-F145 HydrophobicContact CD1-CE1 3.93Å; F80-F145 HydrophobicContact CD2-CD1 4.31Å; F80-F145 HydrophobicContact CD2-CD2 4.46Å; F80-F145 AromaticContact CD2-CE1 3.7Å; F80-F145 HydrophobicContact CD2-CE1 3.7Å; F80-F145 AromaticContact CD2-CE2 3.88Å; F80-F145 HydrophobicContact CD2-CE2 3.88Å; F80-F145 AromaticContact CD2-CZ 3.46Å; F80-F145 HydrophobicContact CD2-CZ 3.46Å; F80-F145 VanDerWaalsContact CD2-CZ 3.46Å; F80-F145 HydrophobicContact CE1-CD1 4.4Å; F80-F145 HydrophobicContact CE2-CD2 4.33Å; F80-F145 HydrophobicContact CE2-CE1 4.33Å; F80-F145 HydrophobicContact CE2-CE2 4.13Å; F80-F145 HydrophobicContact CE2-CZ 4.13Å; F80-F145 HydrophobicContact CG-CD1 4.11Å; F80-F145 AromaticContact CG-CE1 3.46Å; F80-F145 HydrophobicContact CG-CE1 3.46Å; F80-F145 VanDerWaalsContact CG-CE1 3.46Å; F80-F145 HydrophobicContact CG-CE2 4.49Å; F80-F145 AromaticContact CG-CZ 3.69Å; F80-F145 HydrophobicContact CG-CZ 3.69Å; L82-F145 HydrophobicContact CD2-CE1 4.05Å; L82-F145 HydrophobicContact CD2-CZ 4.46Å; A94-F145 HydrophobicContact CB-CD1 3.91Å; A94-F145 HydrophobicContact CB-CE1 3.77Å; L103-F145 HydrophobicContact CD1-CB 4.42Å; L104-F145 CarbonylContact O-C 3.55Å; L104-F145 WeakPolarHBondContact O-CA 3.33Å; C105-F145 HydrophobicContact CB-CD1 3.91Å; C105-F145 HydrophobicContact CB-CE1 3.8Å; R133-F145 HydrophobicContact CB-CB 4.47Å; R133-F145 PolarHBondContact N-O 2.83Å; D134-F145 HydrophobicContact CB-CB 4.5Å; D134-F145 HydrophobicContact CB-CD2 4.4Å; D134-F145 PolarHBondContact O-N 3.3Å; I136-F145 HydrophobicContact CB-CE2 4.25Å; I136-F145 HydrophobicContact CD1-CE2 3.94Å; I136-F145 HydrophobicContact CD1-CZ 4.33Å; I136-F145 HydrophobicContact CG1-CE2 3.99Å
146	L	95.1	Very high	95	Very high	5 Å²	5	46.7 Å²	46.7	3%	0.026	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	152.1	-177	-61.2	169.2	0	0	0	108.6	L103 L104 K106 G131 I132	L103-L146 WeakPolarHBondContact CB-O 3.12Å; L104-L146 HydrophobicContact CB-CB 4.41Å; L104-L146 PolarHBondContact N-O 3.48Å; L104-L146 PolarHBondContact O-N 3.22Å; K106-L146 HydrophobicContact CD-CD1 4.14Å; K106-L146 HydrophobicContact CG-CD1 4.34Å; G131-L146 WeakPolarHBondContact O-CD2 3.28Å; I132-L146 HydrophobicContact CG1-CD2 4.22Å
147	D	94.8	Very high	95.1	Very high	65 Å²	65	46.4 Å²	46.4	35%	0.348	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	149.2	173.7	-53.3	-44.9	0	0	0	111	R208	D147-R208 PolarHBondContact O-NH1 3.38Å; D147-R208 PolarHBondContact O-NH2 2.71Å
148	K	94.6	Very high	95.1	Very high	76 Å²	76	53 Å²	53	33%	0.33	26%	0.257	S	S	.	.			trans	-60.7	143.4	176.3	174	173.7	173.3	178.3	0	112.8	E102 R208	E102-K148 HydrophobicContact CB-CD 3.84Å; E102-K148 WeakPolarHBondContact O-CB 3.45Å; E102-K148 IonicContact OE1-NZ 2.77Å; E102-K148 WeakPolarHBondContact OE2-CD 3.43Å; E102-K148 WeakPolarHBondContact OE2-CE 3.4Å; E102-K148 IonicContact OE2-NZ 3.64Å; E102-K148 PolarHBondContact OE2-NZ 3.14Å; K148-R208 PolarHBondContact O-NH2 2.98Å
149	D	95.1	Very high	95.3	Very high	23 Å²	23	55.3 Å²	55.3	12%	0.123	27%	0.268	C	S	.	.			trans	-109.7	158.1	173.3	87.5	62.2	0	0	0	112.5	R88 L104 G151 V198 F199	R88-D149 IonicContact CZ-OD2 2.78Å; R88-D149 IonicContact NH1-OD1 2.72Å; R88-D149 IonicContact NH1-OD2 2.69Å; R88-D149 PolarHBondContact NH1-OD2 3.05Å; R88-D149 IonicContact NH2-OD2 3.39Å; L104-D149 HydrophobicContact CD1-CB 4.2Å; L104-D149 WeakPolarHBondContact CD1-OD2 3.42Å; D149-G151 WeakPolarHBondContact OD1-CA 3.23Å; D149-G151 PolarHBondContact OD1-N 3.33Å; D149-V198 HydrophobicContact CB-CB 3.83Å; D149-V198 HydrophobicContact CB-CG2 3.73Å; D149-F199 WeakPolarHBondContact CA-O 3.35Å
150	F	95.9	Very high	95.5	Very high	64 Å²	64	49.6 Å²	49.6	28%	0.281	25%	0.246	S	C	.	.			trans	-112.1	29.7	-177.1	-63.1	-93.6	0	0	0	112	F199 A200 E202 R204	F150-F199 HydrophobicContact CB-CB 4.15Å; F150-F199 PolarHBondContact N-O 2.76Å; F150-A200 WeakPolarHBondContact CE2-O 3.2Å; F150-E202 HydrophobicContact CD1-CB 3.79Å; F150-E202 HydrophobicContact CD1-CG 4.23Å; F150-E202 HydrophobicContact CE1-CB 3.79Å; F150-E202 HydrophobicContact CE1-CG 4.37Å; F150-E202 HydrophobicContact CG-CB 4.49Å; F150-E202 HydrophobicContact CZ-CB 4.49Å; F150-R204 VanDerWaalsContact O-CZ 3.27Å; F150-R204 PolarHBondContact O-NE 2.9Å; F150-R204 PolarHBondContact O-NH2 3.24Å
151	G	94.6	Very high	95.7	Very high	22 Å²	22	50.7 Å²	50.7	23%	0.227	25%	0.251	C	S	.	.			trans	96.8	172.5	-177.3	0	0	0	0	0	113.9	D149 V198 F199	D149-G151 WeakPolarHBondContact OD1-CA 3.23Å; D149-G151 PolarHBondContact OD1-N 3.33Å; G151-V198 WeakPolarHBondContact O-CA 3.48Å; G151-F199 VanDerWaalsContact O-CD2 3.23Å; G151-F199 WeakPolarHBondContact O-CD2 3.48Å; G151-F199 PolarHBondContact O-N 2.87Å
152	D	95.9	Very high	95.8	Very high	25 Å²	25	55.3 Å²	55.3	13%	0.134	27%	0.266	C	S	.	.	B	Isolated β-bridge	trans	-107.9	159.7	-171.9	75.1	94.4	0	0	0	114.7	H154 T155 L156 F197 V198	D152-H154 VanDerWaalsContact C-N 3.34Å; D152-H154 PolarHBondContact O-N 3.34Å; D152-H154 VanDerWaalsContact OD1-CA 3.3Å; D152-H154 WeakPolarHBondContact OD1-CA 3.43Å; D152-H154 WeakPolarHBondContact OD1-CB 3.31Å; D152-H154 PolarHBondContact OD1-N 3.46Å; D152-T155 PolarHBondContact O-N 3.2Å; D152-T155 PolarHBondContact OD1-N 2.76Å; D152-T155 PolarHBondContact OD1-OG1 3.28Å; D152-T155 WeakPolarHBondContact OD2-CB 3.44Å; D152-T155 PolarHBondContact OD2-OG1 3.41Å; D152-L156 PolarHBondContact O-N 3.21Å; D152-F197 CarbonylContact C-O 3.59Å; D152-F197 WeakPolarHBondContact CA-O 3.37Å; D152-V198 HydrophobicContact CB-CG1 4.07Å
153	M	97.7	Very high	95.9	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-67.7	-27.3	-179.4	-70.7	-174.8	66.4	0	0	113.9	L156 V157 L171 V175 L194 F197 F199 V207 M264	M153-L156 PolarHBondContact O-N 3.02Å; M153-V157 VanDerWaalsContact O-CG2 3.3Å; M153-V157 WeakPolarHBondContact O-CG2 3.3Å; M153-V157 PolarHBondContact O-N 3.01Å; M153-L171 HydrophobicContact CE-CB 3.81Å; M153-L171 HydrophobicContact CE-CD1 4.3Å; M153-V175 HydrophobicContact CE-CG2 4.17Å; M153-V175 HydrophobicContact SD-CG2 3.66Å; M153-L194 HydrophobicContact CB-CB 4.42Å; M153-L194 HydrophobicContact CB-CD2 4.03Å; M153-L194 HydrophobicContact CE-CD2 4.09Å; M153-F197 HydrophobicContact CB-CB 4.44Å; M153-F197 HydrophobicContact CG-CB 4Å; M153-F197 PolarHBondContact N-O 2.77Å; M153-F197 HydrophobicContact SD-CB 3.63Å; M153-F197 HydrophobicContact SD-CG 4.46Å; M153-F199 HydrophobicContact CG-CE1 4.46Å; M153-F199 HydrophobicContact CG-CE2 4.3Å; M153-F199 HydrophobicContact CG-CZ 3.84Å; M153-V207 HydrophobicContact CG-CG2 4.34Å; M153-V207 HydrophobicContact SD-CG1 3.74Å; M153-V207 HydrophobicContact SD-CG2 3.97Å; M153-M264 HydrophobicContact CE-CE 3.46Å; M153-M264 VanDerWaalsContact CE-CE 3.46Å; M153-M264 HydrophobicContact CE-CG 4.47Å; M153-M264 HydrophobicContact CE-SD 3.59Å; M153-M264 VanDerWaalsContact CE-SD 3.59Å
154	H	96.1	Very high	95.9	Very high	59 Å²	59	57.8 Å²	57.8	27%	0.273	28%	0.282	S	S	.	.	H	α-helix	trans	-69.7	-41.3	175.4	164.7	-78.8	0	0	0	110.2	D152 V157 K158 L194 R195	D152-H154 VanDerWaalsContact C-N 3.34Å; D152-H154 PolarHBondContact O-N 3.34Å; D152-H154 VanDerWaalsContact OD1-CA 3.3Å; D152-H154 WeakPolarHBondContact OD1-CA 3.43Å; D152-H154 WeakPolarHBondContact OD1-CB 3.31Å; D152-H154 PolarHBondContact OD1-N 3.46Å; H154-V157 PolarHBondContact O-N 3.07Å; H154-K158 VanDerWaalsContact O-CB 3.32Å; H154-K158 WeakPolarHBondContact O-CB 3.49Å; H154-K158 PolarHBondContact O-N 2.99Å; H154-L194 HydrophobicContact CB-CB 3.69Å; H154-R195 HydrophobicContact CB-CB 4.3Å
155	T	95.9	Very high	95.9	Very high	67 Å²	67	59.8 Å²	59.8	41%	0.411	29%	0.291	S	S	.	.	H	α-helix	trans	-63.5	-40	173.1	-62.2	0	0	0	0	111.9	D152 K158 S159	D152-T155 PolarHBondContact O-N 3.2Å; D152-T155 PolarHBondContact OD1-N 2.76Å; D152-T155 PolarHBondContact OD1-OG1 3.28Å; D152-T155 WeakPolarHBondContact OD2-CB 3.44Å; D152-T155 PolarHBondContact OD2-OG1 3.41Å; T155-K158 PolarHBondContact O-N 2.77Å; T155-S159 PolarHBondContact O-N 3.17Å; T155-S159 PolarHBondContact O-OG 2.91Å
156	L	97.1	Very high	95.9	Very high	17 Å²	17	63.2 Å²	63.2	9%	0.089	31%	0.312	C	S	.	.	H	α-helix	trans	-58.9	-55.6	171.9	-179.8	66.8	0	0	0	111.5	D152 M153 K158 S159 C160 L163 L171 F199	D152-L156 PolarHBondContact O-N 3.21Å; M153-L156 PolarHBondContact O-N 3.02Å; L156-K158 VanDerWaalsContact C-N 3.28Å; L156-K158 PolarHBondContact O-N 3.28Å; L156-S159 PolarHBondContact O-N 3.26Å; L156-S159 PolarHBondContact O-OG 3.39Å; L156-C160 PolarHBondContact O-N 3.24Å; L156-C160 PolarHBondContact O-SG 3.4Å; L156-L163 HydrophobicContact CD2-CD2 4.18Å; L156-L163 HydrophobicContact CG-CD2 4.08Å; L156-L171 HydrophobicContact CD2-CD1 3.78Å; L156-F199 HydrophobicContact CB-CE2 4.11Å; L156-F199 HydrophobicContact CB-CZ 4.32Å; L156-F199 HydrophobicContact CD2-CE2 4.16Å; L156-F199 HydrophobicContact CD2-CZ 3.58Å
157	V	97.4	Very high	96	Very high	7 Å²	7	66 Å²	66	4%	0.042	33%	0.325	C	S	.	.	H	α-helix	trans	-57.6	-41.8	-179.5	172.6	0	0	0	0	111.2	M153 H154 S159 C160 R161 L163 L194 T263 M264	M153-V157 VanDerWaalsContact O-CG2 3.3Å; M153-V157 WeakPolarHBondContact O-CG2 3.3Å; M153-V157 PolarHBondContact O-N 3.01Å; H154-V157 PolarHBondContact O-N 3.07Å; V157-S159 VanDerWaalsContact C-N 3.35Å; V157-S159 PolarHBondContact O-N 3.31Å; V157-C160 PolarHBondContact O-N 3.22Å; V157-R161 CarbonylContact O-C 3.26Å; V157-R161 VanDerWaalsContact O-C 3.26Å; V157-R161 VanDerWaalsContact O-CA 3.28Å; V157-R161 WeakPolarHBondContact O-CA 3.3Å; V157-R161 PolarHBondContact O-N 3.48Å; V157-L163 HydrophobicContact CG2-CD1 4.1Å; V157-L163 HydrophobicContact CG2-CD2 4.23Å; V157-L163 HydrophobicContact CG2-CG 4.03Å; V157-L194 HydrophobicContact CG2-CD1 4.27Å; V157-T263 WeakPolarHBondContact CG1-O 3.44Å; V157-M264 HydrophobicContact CG2-CB 4.42Å; V157-M264 HydrophobicContact CG2-CG 3.93Å
158	K	95.6	Very high	96.1	Very high	164 Å²	164	62.9 Å²	62.9	71%	0.713	31%	0.308	S	S	*	.	H	α-helix	trans	-59.4	-42.2	174.9	-175.6	-179.5	177.1	-174.6	0	112.2	H154 T155 L156 R161	H154-K158 VanDerWaalsContact O-CB 3.32Å; H154-K158 WeakPolarHBondContact O-CB 3.49Å; H154-K158 PolarHBondContact O-N 2.99Å; T155-K158 PolarHBondContact O-N 2.77Å; L156-K158 VanDerWaalsContact C-N 3.28Å; L156-K158 PolarHBondContact O-N 3.28Å; K158-R161 PolarHBondContact O-N 3.19Å
159	S	96	Very high	96.2	Very high	84 Å²	84	60.6 Å²	60.6	59%	0.587	30%	0.298	S	S	*	.	H	α-helix	trans	-69.7	-41	179.7	71.9	0	0	0	0	113.3	T155 L156 V157 R161	T155-S159 PolarHBondContact O-N 3.17Å; T155-S159 PolarHBondContact O-OG 2.91Å; L156-S159 PolarHBondContact O-N 3.26Å; L156-S159 PolarHBondContact O-OG 3.39Å; V157-S159 VanDerWaalsContact C-N 3.35Å; V157-S159 PolarHBondContact O-N 3.31Å; S159-R161 VanDerWaalsContact C-N 3.28Å; S159-R161 PolarHBondContact O-N 2.97Å
160	C	96	Very high	96.3	Very high	56 Å²	56	67.7 Å²	67.7	38%	0.378	32%	0.323	S	S	.	.	H	α-helix	trans	-80	-9	178.2	-58.6	0	0	0	0	113.2	L156 V157 R162 L163	L156-C160 PolarHBondContact O-N 3.24Å; L156-C160 PolarHBondContact O-SG 3.4Å; V157-C160 PolarHBondContact O-N 3.22Å; C160-R162 VanDerWaalsContact CB-O 3.26Å; C160-R162 WeakPolarHBondContact CB-O 3.36Å; C160-R162 PolarHBondContact O-N 3.34Å; C160-L163 HydrophobicContact CB-CD2 3.94Å
161	R	95.7	Very high	96.5	Very high	213 Å²	213	64.9 Å²	64.9	80%	0.804	31%	0.311	S	S	*	.	S	Bend	trans	62.6	-46.3	-161.1	-53	-175.9	179.9	-150.9	-0.1	113.8	V157 K158 S159 G267	V157-R161 CarbonylContact O-C 3.26Å; V157-R161 VanDerWaalsContact O-C 3.26Å; V157-R161 VanDerWaalsContact O-CA 3.28Å; V157-R161 WeakPolarHBondContact O-CA 3.3Å; V157-R161 PolarHBondContact O-N 3.48Å; K158-R161 PolarHBondContact O-N 3.19Å; S159-R161 VanDerWaalsContact C-N 3.28Å; S159-R161 PolarHBondContact O-N 2.97Å; R161-G267 WeakPolarHBondContact O-CA 3.32Å
162	R	96.1	Very high	96.7	Very high	168 Å²	168	63.8 Å²	63.8	63%	0.634	30%	0.3	S	S	*	.	S	Bend	trans	-149.6	162.4	168.4	63.7	173.9	-178	-107.1	-0.2	109.2	C160 L265	C160-R162 VanDerWaalsContact CB-O 3.26Å; C160-R162 WeakPolarHBondContact CB-O 3.36Å; C160-R162 PolarHBondContact O-N 3.34Å; R162-L265 WeakPolarHBondContact CD-O 3.46Å
163	L	97.5	Very high	96.8	Very high	6 Å²	6	68 Å²	68	3%	0.031	31%	0.314	C	S	.	.			trans	-95.2	154.6	173.4	-47.8	-176.1	0	0	0	110.3	L156 V157 C160 A168 L171 M264	L156-L163 HydrophobicContact CD2-CD2 4.18Å; L156-L163 HydrophobicContact CG-CD2 4.08Å; V157-L163 HydrophobicContact CG2-CD1 4.1Å; V157-L163 HydrophobicContact CG2-CD2 4.23Å; V157-L163 HydrophobicContact CG2-CG 4.03Å; C160-L163 HydrophobicContact CB-CD2 3.94Å; L163-A168 HydrophobicContact CB-CB 4.22Å; L163-L171 HydrophobicContact CD1-CD1 4.17Å; L163-M264 HydrophobicContact CD1-CB 4.26Å; L163-M264 HydrophobicContact CD1-CE 3.82Å; L163-M264 HydrophobicContact CD1-CG 4.28Å; L163-M264 PolarHBondContact N-O 2.63Å
164	D	95.7	Very high	96.8	Very high	90 Å²	90	69.2 Å²	69.2	48%	0.481	32%	0.319	S	S	.	.			trans	-71.4	160.8	165.6	76	77.8	0	0	0	111.1	V166 Q167 A168	D164-V166 VanDerWaalsContact C-N 3.27Å; D164-V166 PolarHBondContact O-N 3.49Å; D164-V166 VanDerWaalsContact OD1-CA 3.27Å; D164-V166 WeakPolarHBondContact OD1-CA 3.47Å; D164-V166 VanDerWaalsContact OD1-CB 3.24Å; D164-V166 WeakPolarHBondContact OD1-CB 3.41Å; D164-V166 PolarHBondContact OD1-N 2.98Å; D164-Q167 PolarHBondContact O-N 3.04Å; D164-Q167 PolarHBondContact OD1-N 3.34Å; D164-Q167 WeakPolarHBondContact OD2-CB 3.32Å; D164-A168 WeakPolarHBondContact O-CB 3.24Å; D164-A168 PolarHBondContact O-N 3Å
165	E	95.6	Very high	96.9	Very high	44 Å²	44	66.4 Å²	66.4	21%	0.206	31%	0.306	C	S	.	.	H	α-helix	trans	-68.6	-23.4	-174	-153	-176.4	114.3	0	0	113.4	R169 L265 S295 W324	E165-R169 WeakPolarHBondContact O-CB 3.4Å; E165-R169 PolarHBondContact O-N 3.34Å; E165-R169 PolarHBondContact O-NH1 2.96Å; E165-R169 IonicContact OE1-CZ 3.95Å; E165-R169 IonicContact OE1-NH2 2.79Å; E165-R169 PolarHBondContact OE1-NH2 2.84Å; E165-L265 HydrophobicContact CB-CD2 4.32Å; E165-L265 HydrophobicContact CG-CD2 3.98Å; E165-S295 VanDerWaalsContact CD-OG 3.24Å; E165-S295 PolarHBondContact OE1-OG 2.92Å; E165-S295 WeakPolarHBondContact OE2-CB 3.38Å; E165-S295 PolarHBondContact OE2-N 3.23Å; E165-S295 PolarHBondContact OE2-OG 2.96Å; E165-W324 VanDerWaalsContact CD-NE1 3.34Å; E165-W324 HydrophobicContact CG-CZ2 3.8Å; E165-W324 PolarHBondContact OE1-NE1 2.91Å
166	V	95.3	Very high	97.1	Very high	72 Å²	72	63.2 Å²	63.2	44%	0.436	29%	0.287	S	S	.	.	H	α-helix	trans	-77.8	-45.9	177.3	-174.4	0	0	0	0	110.7	D164 R170	D164-V166 VanDerWaalsContact C-N 3.27Å; D164-V166 PolarHBondContact O-N 3.49Å; D164-V166 VanDerWaalsContact OD1-CA 3.27Å; D164-V166 WeakPolarHBondContact OD1-CA 3.47Å; D164-V166 VanDerWaalsContact OD1-CB 3.24Å; D164-V166 WeakPolarHBondContact OD1-CB 3.41Å; D164-V166 PolarHBondContact OD1-N 2.98Å; V166-R170 WeakPolarHBondContact O-CG 3.42Å; V166-R170 PolarHBondContact O-N 3.45Å; V166-R170 VanDerWaalsContact O-N 3.12Å
167	Q	96.4	Very high	97.1	Very high	63 Å²	63	63.9 Å²	63.9	29%	0.294	29%	0.29	S	S	.	.	H	α-helix	trans	-63.7	-47.3	172.8	-169.9	-175.3	36.5	0	0	110.6	D164 R169 R170 L171	D164-Q167 PolarHBondContact O-N 3.04Å; D164-Q167 PolarHBondContact OD1-N 3.34Å; D164-Q167 WeakPolarHBondContact OD2-CB 3.32Å; Q167-R169 VanDerWaalsContact C-N 3.34Å; Q167-R169 PolarHBondContact O-N 2.95Å; Q167-R170 PolarHBondContact O-N 3.05Å; Q167-R170 VanDerWaalsContact O-N 3.17Å; Q167-L171 HydrophobicContact CG-CD1 4.22Å; Q167-L171 HydrophobicContact CG-CG 4.47Å; Q167-L171 WeakPolarHBondContact O-CG 3.33Å; Q167-L171 PolarHBondContact O-N 3.32Å
168	A	97.8	Very high	97.2	Very high	0 Å²	0	63.5 Å²	63.5	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-56.9	-45.4	177.5	0	0	0	0	0	111.9	L163 D164 R170 L171 F172 M264 L265 W324	L163-A168 HydrophobicContact CB-CB 4.22Å; D164-A168 WeakPolarHBondContact O-CB 3.24Å; D164-A168 PolarHBondContact O-N 3Å; A168-R170 PolarHBondContact O-N 3.47Å; A168-L171 PolarHBondContact O-N 3.41Å; A168-F172 WeakPolarHBondContact O-CB 3.45Å; A168-F172 PolarHBondContact O-N 3.45Å; A168-M264 HydrophobicContact CB-CE 4.12Å; A168-L265 HydrophobicContact CB-CD2 3.54Å; A168-L265 HydrophobicContact CB-CG 4.35Å; A168-W324 HydrophobicContact CB-CH2 4.46Å
169	R	97.6	Very high	97.3	Very high	29 Å²	29	55.7 Å²	55.7	11%	0.109	25%	0.254	C	S	.	.	H	α-helix	trans	-58.3	-45.8	175.3	178.8	-173.3	-67.1	104.5	10.2	112.7	E165 Q167 R173 W324 F325	E165-R169 WeakPolarHBondContact O-CB 3.4Å; E165-R169 PolarHBondContact O-N 3.34Å; E165-R169 PolarHBondContact O-NH1 2.96Å; E165-R169 IonicContact OE1-CZ 3.95Å; E165-R169 IonicContact OE1-NH2 2.79Å; E165-R169 PolarHBondContact OE1-NH2 2.84Å; Q167-R169 VanDerWaalsContact C-N 3.34Å; Q167-R169 PolarHBondContact O-N 2.95Å; R169-R173 WeakPolarHBondContact O-CB 3.22Å; R169-R173 PolarHBondContact O-N 2.64Å; R169-R173 VanDerWaalsContact O-N 3.09Å; R169-W324 HydrophobicContact CB-CH2 3.82Å; R169-W324 HydrophobicContact CB-CZ2 4.04Å; R169-W324 HydrophobicContact CB-CZ3 4.12Å; R169-W324 HydrophobicContact CG-CZ3 4.39Å; R169-W324 PolarHBondContact NE-O 2.65Å; R169-W324 PolarHBondContact NH2-O 3.04Å; R169-F325 HydrophobicContact CG-CD1 4.14Å
170	R	97.2	Very high	97.4	Very high	171 Å²	171	51.9 Å²	51.9	65%	0.645	23%	0.228	S	C	*	.	H	α-helix	trans	-65.3	-39.5	-179.8	-73.3	172.5	178.9	-173.7	1.1	112.9	V166 Q167 A168 Q174	V166-R170 WeakPolarHBondContact O-CG 3.42Å; V166-R170 PolarHBondContact O-N 3.45Å; V166-R170 VanDerWaalsContact O-N 3.12Å; Q167-R170 PolarHBondContact O-N 3.05Å; Q167-R170 VanDerWaalsContact O-N 3.17Å; A168-R170 PolarHBondContact O-N 3.47Å; R170-Q174 PolarHBondContact O-NE2 3Å
171	L	98.4	Very high	97.5	Very high	5 Å²	5	50.9 Å²	50.9	3%	0.026	22%	0.217	C	C	.	.	H	α-helix	trans	-80.3	-46.2	179.2	-58.7	-175	0	0	0	111.7	M153 L156 L163 Q167 A168 R173 Q174 V175 F199 V207 M264	M153-L171 HydrophobicContact CE-CB 3.81Å; M153-L171 HydrophobicContact CE-CD1 4.3Å; L156-L171 HydrophobicContact CD2-CD1 3.78Å; L163-L171 HydrophobicContact CD1-CD1 4.17Å; Q167-L171 HydrophobicContact CG-CD1 4.22Å; Q167-L171 HydrophobicContact CG-CG 4.47Å; Q167-L171 WeakPolarHBondContact O-CG 3.33Å; Q167-L171 PolarHBondContact O-N 3.32Å; A168-L171 PolarHBondContact O-N 3.41Å; L171-R173 VanDerWaalsContact C-N 3.29Å; L171-R173 PolarHBondContact O-N 2.98Å; L171-Q174 WeakPolarHBondContact O-CB 3.44Å; L171-Q174 PolarHBondContact O-N 3.43Å; L171-V175 PolarHBondContact O-N 3.32Å; L171-V175 VanDerWaalsContact O-N 3.17Å; L171-F199 HydrophobicContact CD1-CE1 4.18Å; L171-F199 HydrophobicContact CD1-CZ 4.24Å; L171-F199 HydrophobicContact CD2-CE1 4.09Å; L171-V207 HydrophobicContact CB-CG2 4.45Å; L171-V207 HydrophobicContact CD2-CG2 3.87Å; L171-M264 HydrophobicContact CB-CE 4.11Å
172	F	98.6	Very high	97.6	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-64.6	-31.4	-178.7	-168.5	-113.6	0	0	0	112.3	A168 Q174 V175 V176 L257 M260 L261 M264 L305 L319 W324 F325	A168-F172 WeakPolarHBondContact O-CB 3.45Å; A168-F172 PolarHBondContact O-N 3.45Å; F172-Q174 PolarHBondContact O-N 2.96Å; F172-V175 HydrophobicContact CD2-CB 4.31Å; F172-V175 HydrophobicContact CD2-CG1 4.32Å; F172-V175 HydrophobicContact CE2-CG1 4.38Å; F172-V175 WeakPolarHBondContact O-CB 3.27Å; F172-V175 PolarHBondContact O-N 2.65Å; F172-V176 HydrophobicContact CD1-CG2 3.97Å; F172-V176 HydrophobicContact CE1-CG2 3.65Å; F172-V176 HydrophobicContact CE2-CG2 4.36Å; F172-V176 HydrophobicContact CG-CG2 4.45Å; F172-V176 HydrophobicContact CZ-CG2 3.87Å; F172-V176 WeakPolarHBondContact O-CG2 3.23Å; F172-V176 PolarHBondContact O-N 3.43Å; F172-L257 HydrophobicContact CE2-CB 4.36Å; F172-L257 HydrophobicContact CE2-CD2 3.92Å; F172-L257 WeakPolarHBondContact CE2-O 3.44Å; F172-L257 HydrophobicContact CZ-CB 4.02Å; F172-L257 HydrophobicContact CZ-CD2 4.19Å; F172-L257 WeakPolarHBondContact CZ-O 3.3Å; F172-M260 HydrophobicContact CE2-CB 4.29Å; F172-L261 HydrophobicContact CB-CD1 4.42Å; F172-L261 HydrophobicContact CD1-CB 4.44Å; F172-L261 HydrophobicContact CD1-CD1 3.91Å; F172-L261 HydrophobicContact CD1-CD2 4.27Å; F172-L261 HydrophobicContact CD1-CG 4.43Å; F172-L261 HydrophobicContact CD2-CB 4.28Å; F172-L261 HydrophobicContact CD2-CD1 4.47Å; F172-L261 HydrophobicContact CE1-CB 4.05Å; F172-L261 HydrophobicContact CE1-CD1 4.27Å; F172-L261 HydrophobicContact CE1-CD2 3.9Å; F172-L261 HydrophobicContact CE1-CG 4.29Å; F172-L261 HydrophobicContact CE2-CB 3.87Å; F172-L261 HydrophobicContact CG-CD1 4.02Å; F172-L261 HydrophobicContact CZ-CB 3.75Å; F172-L261 HydrophobicContact CZ-CD2 4.37Å; F172-L261 HydrophobicContact CZ-CG 4.48Å; F172-M264 HydrophobicContact CB-CE 3.98Å; F172-M264 HydrophobicContact CB-SD 4.35Å; F172-M264 HydrophobicContact CD2-SD 4.06Å; F172-L305 HydrophobicContact CZ-CD1 4.37Å; F172-L319 HydrophobicContact CE1-CD2 4.37Å; F172-W324 HydrophobicContact CB-CZ3 4.39Å; F172-W324 AromaticContact CD1-CZ3 3.94Å; F172-W324 HydrophobicContact CD1-CZ3 3.94Å; F172-F325 HydrophobicContact CD1-CE1 4.07Å; F172-F325 AromaticContact CD1-CZ 3.62Å; F172-F325 HydrophobicContact CD1-CZ 3.62Å; F172-F325 HydrophobicContact CE1-CZ 4.11Å
173	R	98.4	Very high	97.7	Very high	114 Å²	114	33.3 Å²	33.3	43%	0.43	15%	0.152	S	C	.	.	H	α-helix	trans	-61.3	-32.8	173.1	-166.6	172.5	-178.4	-91	-3.1	112.4	R169 L171 L177 L320 F325	R169-R173 WeakPolarHBondContact O-CB 3.22Å; R169-R173 PolarHBondContact O-N 2.64Å; R169-R173 VanDerWaalsContact O-N 3.09Å; L171-R173 VanDerWaalsContact C-N 3.29Å; L171-R173 PolarHBondContact O-N 2.98Å; R173-L177 WeakPolarHBondContact O-CB 3.49Å; R173-L177 VanDerWaalsContact O-CG 3.23Å; R173-L177 WeakPolarHBondContact O-CG 3.36Å; R173-L177 PolarHBondContact O-N 2.88Å; R173-L320 HydrophobicContact CG-CD2 4.28Å; R173-F325 HydrophobicContact CB-CD1 3.7Å; R173-F325 HydrophobicContact CB-CE1 3.54Å; R173-F325 HydrophobicContact CB-CZ 4.43Å; R173-F325 HydrophobicContact CG-CD1 3.94Å; R173-F325 HydrophobicContact CG-CE1 4.06Å
174	Q	98.6	Very high	97.6	Very high	24 Å²	24	39.9 Å²	39.9	11%	0.112	18%	0.182	C	C	.	.	H	α-helix	trans	-76.1	-38.9	178	-64.3	178.9	68.7	0	0	111.9	N128 R170 L171 F172 L177 A178 T205 V207	N128-Q174 PolarHBondContact ND2-OE1 3.25Å; R170-Q174 PolarHBondContact O-NE2 3Å; L171-Q174 WeakPolarHBondContact O-CB 3.44Å; L171-Q174 PolarHBondContact O-N 3.43Å; F172-Q174 PolarHBondContact O-N 2.96Å; Q174-L177 PolarHBondContact O-N 2.91Å; Q174-A178 PolarHBondContact O-N 2.87Å; Q174-A178 VanDerWaalsContact O-N 3.08Å; Q174-T205 PolarHBondContact NE2-O 2.97Å; Q174-V207 HydrophobicContact CB-CB 4.16Å
175	V	98.8	Very high	97.6	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-54.7	-53.6	168.7	171.8	0	0	0	0	110.2	M153 L171 F172 L177 A178 V179 F197 V207 L257 M260	M153-V175 HydrophobicContact CE-CG2 4.17Å; M153-V175 HydrophobicContact SD-CG2 3.66Å; L171-V175 PolarHBondContact O-N 3.32Å; L171-V175 VanDerWaalsContact O-N 3.17Å; F172-V175 HydrophobicContact CD2-CB 4.31Å; F172-V175 HydrophobicContact CD2-CG1 4.32Å; F172-V175 HydrophobicContact CE2-CG1 4.38Å; F172-V175 WeakPolarHBondContact O-CB 3.27Å; F172-V175 PolarHBondContact O-N 2.65Å; V175-L177 PolarHBondContact O-N 2.97Å; V175-A178 WeakPolarHBondContact O-CB 3.26Å; V175-A178 PolarHBondContact O-N 3.32Å; V175-A178 VanDerWaalsContact O-N 3.12Å; V175-V179 PolarHBondContact O-N 3.27Å; V175-V179 VanDerWaalsContact O-N 3.11Å; V175-F197 HydrophobicContact CB-CD1 4.38Å; V175-F197 HydrophobicContact CB-CE1 4.22Å; V175-F197 HydrophobicContact CG1-CD1 4.37Å; V175-F197 HydrophobicContact CG1-CD2 4.46Å; V175-F197 HydrophobicContact CG1-CE1 3.94Å; V175-F197 HydrophobicContact CG1-CE2 4.04Å; V175-F197 HydrophobicContact CG1-CZ 3.76Å; V175-F197 HydrophobicContact CG2-CB 4.47Å; V175-F197 HydrophobicContact CG2-CD1 3.84Å; V175-F197 HydrophobicContact CG2-CE1 4.19Å; V175-F197 HydrophobicContact CG2-CG 4Å; V175-V207 HydrophobicContact CG2-CG1 4.21Å; V175-L257 HydrophobicContact CG1-CD2 3.47Å; V175-L257 VanDerWaalsContact CG1-CD2 3.47Å; V175-M260 HydrophobicContact CG1-CE 3.55Å; V175-M260 HydrophobicContact CG1-SD 4.28Å; V175-M260 HydrophobicContact CG2-CE 4.16Å
176	V	98.6	Very high	97.6	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-64.8	-38.7	-178.8	-179.5	0	0	0	0	112	F172 A178 V179 A180 L257 L319 L320 F325	F172-V176 HydrophobicContact CD1-CG2 3.97Å; F172-V176 HydrophobicContact CE1-CG2 3.65Å; F172-V176 HydrophobicContact CE2-CG2 4.36Å; F172-V176 HydrophobicContact CG-CG2 4.45Å; F172-V176 HydrophobicContact CZ-CG2 3.87Å; F172-V176 WeakPolarHBondContact O-CG2 3.23Å; F172-V176 PolarHBondContact O-N 3.43Å; V176-A178 VanDerWaalsContact C-N 3.26Å; V176-A178 PolarHBondContact O-N 3.33Å; V176-V179 PolarHBondContact O-N 3.44Å; V176-A180 WeakPolarHBondContact O-CB 3.45Å; V176-A180 PolarHBondContact O-N 3.46Å; V176-L257 HydrophobicContact CG2-CD1 4.41Å; V176-L257 HydrophobicContact CG2-CD2 4.49Å; V176-L319 HydrophobicContact CB-CD2 4.23Å; V176-L319 HydrophobicContact CG1-CB 4.19Å; V176-L319 HydrophobicContact CG1-CD2 3.65Å; V176-L319 HydrophobicContact CG1-CG 3.79Å; V176-L319 HydrophobicContact CG2-CD2 3.43Å; V176-L319 VanDerWaalsContact CG2-CD2 3.43Å; V176-L319 HydrophobicContact CG2-CG 3.98Å; V176-L320 HydrophobicContact CB-CD2 3.94Å; V176-L320 HydrophobicContact CG1-CD1 4.41Å; V176-L320 HydrophobicContact CG1-CD2 3.62Å; V176-L320 HydrophobicContact CG1-CG 3.64Å; V176-F325 HydrophobicContact CG2-CZ 4.2Å
177	L	98.5	Very high	97.7	Very high	31 Å²	31	31.8 Å²	31.8	16%	0.162	14%	0.143	C	C	.	.	H	α-helix	trans	-59.7	-35.5	173.9	-77.9	169.7	0	0	0	112.6	R173 Q174 V175 H181 L320	R173-L177 WeakPolarHBondContact O-CB 3.49Å; R173-L177 VanDerWaalsContact O-CG 3.23Å; R173-L177 WeakPolarHBondContact O-CG 3.36Å; R173-L177 PolarHBondContact O-N 2.88Å; Q174-L177 PolarHBondContact O-N 2.91Å; V175-L177 PolarHBondContact O-N 2.97Å; L177-H181 VanDerWaalsContact O-CB 3.32Å; L177-H181 WeakPolarHBondContact O-CB 3.37Å; L177-H181 PolarHBondContact O-N 2.61Å; L177-L320 HydrophobicContact CD2-CD1 3.8Å; L177-L320 HydrophobicContact CD2-CD2 3.92Å; L177-L320 HydrophobicContact CG-CD2 3.87Å
178	A	98.5	Very high	97.6	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-66.8	-46.9	173.9	0	0	0	0	0	111.8	N128 V129 Q174 V175 V176 H181 C182 F197 L209	N128-A178 HydrophobicContact CB-CB 4.04Å; N128-A178 WeakPolarHBondContact O-CB 3.13Å; V129-A178 HydrophobicContact CG2-CB 4.01Å; Q174-A178 PolarHBondContact O-N 2.87Å; Q174-A178 VanDerWaalsContact O-N 3.08Å; V175-A178 WeakPolarHBondContact O-CB 3.26Å; V175-A178 PolarHBondContact O-N 3.32Å; V175-A178 VanDerWaalsContact O-N 3.12Å; V176-A178 VanDerWaalsContact C-N 3.26Å; V176-A178 PolarHBondContact O-N 3.33Å; A178-H181 PolarHBondContact O-N 3.47Å; A178-C182 PolarHBondContact O-N 3.46Å; A178-C182 VanDerWaalsContact O-N 3.09Å; A178-C182 PolarHBondContact O-SG 3.08Å; A178-C182 VanDerWaalsContact O-SG 3.36Å; A178-F197 HydrophobicContact CB-CE1 4.19Å; A178-L209 HydrophobicContact CB-CB 4.39Å
179	V	98.5	Very high	97.5	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-65.3	-44.1	179.5	-177.7	0	0	0	0	111.7	V175 V176 H181 C182 H183 L189 L192 F197 L257 A316	V175-V179 PolarHBondContact O-N 3.27Å; V175-V179 VanDerWaalsContact O-N 3.11Å; V176-V179 PolarHBondContact O-N 3.44Å; V179-H181 VanDerWaalsContact C-N 3.33Å; V179-H181 PolarHBondContact O-N 2.93Å; V179-C182 PolarHBondContact O-N 3.11Å; V179-H183 WeakPolarHBondContact CG1-NE2 3.32Å; V179-H183 WeakPolarHBondContact O-CB 3.41Å; V179-H183 PolarHBondContact O-CD2 3.15Å; V179-H183 PolarHBondContact O-N 3.12Å; V179-L189 HydrophobicContact CB-CD1 4.37Å; V179-L189 HydrophobicContact CG1-CD1 4.36Å; V179-L189 HydrophobicContact CG2-CD1 3.93Å; V179-L192 HydrophobicContact CG1-CD1 4.16Å; V179-L192 HydrophobicContact CG2-CD1 3.76Å; V179-L192 HydrophobicContact CG2-CD2 3.96Å; V179-F197 HydrophobicContact CG2-CZ 4.45Å; V179-L257 HydrophobicContact CB-CD1 4.18Å; V179-L257 HydrophobicContact CG1-CD1 4.06Å; V179-L257 HydrophobicContact CG2-CD1 4.15Å; V179-L257 HydrophobicContact CG2-CD2 4.06Å; V179-L257 HydrophobicContact CG2-CG 4.43Å; V179-A316 HydrophobicContact CG1-CB 4.44Å
180	A	98.3	Very high	97.2	Very high	4 Å²	4	29 Å²	29	3%	0.033	14%	0.14	C	C	.	.	H	α-helix	trans	-59.4	-42.8	177.3	0	0	0	0	0	112.1	V176 H183 Q184 A316 L320	V176-A180 WeakPolarHBondContact O-CB 3.45Å; V176-A180 PolarHBondContact O-N 3.46Å; A180-H183 PolarHBondContact O-N 2.82Å; A180-Q184 WeakPolarHBondContact O-CB 3.5Å; A180-Q184 WeakPolarHBondContact O-CG 3.46Å; A180-Q184 PolarHBondContact O-N 3.43Å; A180-A316 HydrophobicContact CB-CB 3.8Å; A180-L320 HydrophobicContact CB-CD1 3.83Å
181	H	98.1	Very high	96.9	Very high	35 Å²	35	22.3 Å²	22.3	16%	0.162	12%	0.117	C	C	.	.	H	α-helix	trans	-63.4	-44.1	176.6	-175.4	74.3	0	0	0	112.1	L123 P124 H126 L177 A178 V179 A185	L123-H181 VanDerWaalsContact CD1-CD2 3.44Å; L123-H181 WeakPolarHBondContact CD1-CD2 3.32Å; P124-H181 PolarHBondContact O-NE2 2.87Å; H126-H181 VanDerWaalsContact CB-CD2 3.42Å; H126-H181 WeakPolarHBondContact CB-CD2 2.92Å; H126-H181 WeakPolarHBondContact CB-NE2 3.41Å; H126-H181 AromaticContact CG-CD2 3.97Å; H126-H181 AromaticContact CG-CG 3.9Å; L177-H181 VanDerWaalsContact O-CB 3.32Å; L177-H181 WeakPolarHBondContact O-CB 3.37Å; L177-H181 PolarHBondContact O-N 2.61Å; A178-H181 PolarHBondContact O-N 3.47Å; V179-H181 VanDerWaalsContact C-N 3.33Å; V179-H181 PolarHBondContact O-N 2.93Å; H181-A185 PolarHBondContact O-N 2.99Å; H181-A185 VanDerWaalsContact O-N 3.14Å
182	C	97.7	Very high	96.7	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-62.4	-47.7	173.5	-68.1	0	0	0	0	112.1	A178 V179 Q184 A185 G186 I187 L189	A178-C182 PolarHBondContact O-N 3.46Å; A178-C182 VanDerWaalsContact O-N 3.09Å; A178-C182 PolarHBondContact O-SG 3.08Å; A178-C182 VanDerWaalsContact O-SG 3.36Å; V179-C182 PolarHBondContact O-N 3.11Å; C182-Q184 VanDerWaalsContact C-N 3.31Å; C182-Q184 PolarHBondContact O-N 2.82Å; C182-A185 CarbonylContact O-C 3.59Å; C182-A185 PolarHBondContact O-N 3.15Å; C182-A185 VanDerWaalsContact O-N 3.11Å; C182-G186 PolarHBondContact O-N 2.89Å; C182-I187 CarbonylContact C-O 3.56Å; C182-I187 VanDerWaalsContact C-O 3.31Å; C182-I187 HydrophobicContact CB-CB 4.12Å; C182-I187 HydrophobicContact CB-CG2 4.37Å; C182-I187 WeakPolarHBondContact O-CB 3.46Å; C182-I187 PolarHBondContact O-N 3.21Å; C182-L189 HydrophobicContact CB-CD1 4.13Å; C182-L189 HydrophobicContact CB-CD2 4.24Å; C182-L189 HydrophobicContact CB-CG 4.2Å
183	H	97.4	Very high	96.6	Very high	12 Å²	12	24.8 Å²	24.8	6%	0.056	13%	0.127	C	C	.	.	H	α-helix	trans	-60.9	-38.8	-179.8	-77.6	-165	0	0	0	112.4	V179 A180 G186 I187 R250 D253	V179-H183 WeakPolarHBondContact CG1-NE2 3.32Å; V179-H183 WeakPolarHBondContact O-CB 3.41Å; V179-H183 PolarHBondContact O-CD2 3.15Å; V179-H183 PolarHBondContact O-N 3.12Å; A180-H183 PolarHBondContact O-N 2.82Å; H183-G186 PolarHBondContact O-N 3.24Å; H183-I187 PolarHBondContact CD2-O 2.96Å; H183-I187 PolarHBondContact N-O 3.34Å; H183-R250 PolarHBondContact O-NE 3.45Å; H183-R250 PolarHBondContact O-NH2 3.03Å; H183-D253 IonicContact CD2-OD2 2.63Å; H183-D253 IonicContact CE1-OD2 2.73Å; H183-D253 IonicContact NE2-OD2 3.97Å; H183-D253 PolarHBondContact NE2-OD2 3.41Å
184	Q	95.9	Very high	96.5	Very high	143 Å²	143	19.3 Å²	19.3	67%	0.668	11%	0.107	S	C	*	.	H	α-helix	trans	-66.6	-36.4	175.1	-74.4	168.9	10.9	0	0	112.4	A180 C182 G186	A180-Q184 WeakPolarHBondContact O-CB 3.5Å; A180-Q184 WeakPolarHBondContact O-CG 3.46Å; A180-Q184 PolarHBondContact O-N 3.43Å; C182-Q184 VanDerWaalsContact C-N 3.31Å; C182-Q184 PolarHBondContact O-N 2.82Å; Q184-G186 PolarHBondContact O-N 2.89Å
185	A	95.5	Very high	96.3	Very high	34 Å²	34	25.3 Å²	25.3	28%	0.281	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	8.6	174.8	0	0	0	0	0	114.2	L123 H181 C182	L123-A185 HydrophobicContact CD1-CB 3.39Å; H181-A185 PolarHBondContact O-N 2.99Å; H181-A185 VanDerWaalsContact O-N 3.14Å; C182-A185 CarbonylContact O-C 3.59Å; C182-A185 PolarHBondContact O-N 3.15Å; C182-A185 VanDerWaalsContact O-N 3.11Å
186	G	95.8	Very high	96.1	Very high	2 Å²	2	26 Å²	26	2%	0.021	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.5	29.3	-178.7	0	0	0	0	0	113.9	C182 H183 Q184 L218	C182-G186 PolarHBondContact O-N 2.89Å; H183-G186 PolarHBondContact O-N 3.24Å; Q184-G186 PolarHBondContact O-N 2.89Å; G186-L218 WeakPolarHBondContact O-CB 3.19Å; G186-L218 WeakPolarHBondContact O-CG 3.35Å; G186-L218 PolarHBondContact O-N 2.58Å
187	I	96.4	Very high	96.1	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	126.1	176.3	-57.4	-178.1	0	0	0	110.1	A119 V122 L123 C182 H183 L189 C215 I217	A119-I187 HydrophobicContact CB-CD1 4.22Å; V122-I187 HydrophobicContact CG2-CD1 4.11Å; L123-I187 HydrophobicContact CB-CD1 3.98Å; L123-I187 HydrophobicContact CD1-CD1 4.1Å; L123-I187 HydrophobicContact CG-CD1 4.43Å; C182-I187 CarbonylContact C-O 3.56Å; C182-I187 VanDerWaalsContact C-O 3.31Å; C182-I187 HydrophobicContact CB-CB 4.12Å; C182-I187 HydrophobicContact CB-CG2 4.37Å; C182-I187 WeakPolarHBondContact O-CB 3.46Å; C182-I187 PolarHBondContact O-N 3.21Å; H183-I187 PolarHBondContact CD2-O 2.96Å; H183-I187 PolarHBondContact N-O 3.34Å; I187-L189 HydrophobicContact CG2-CD2 4.19Å; I187-C215 HydrophobicContact CG2-CB 3.71Å; I187-C215 WeakPolarHBondContact CG2-SG 3.29Å; I187-I217 HydrophobicContact CG1-CG1 4.44Å
188	V	96.1	Very high	96	Very high	1 Å²	1	24.5 Å²	24.5	1%	0.006	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	135.9	167	176.3	0	0	0	0	109	C215 R216 L218 D224 M226 G249 R250	V188-C215 CarbonylContact O-C 3.58Å; V188-C215 WeakPolarHBondContact O-CA 3.48Å; V188-C215 VanDerWaalsContact O-CB 3.28Å; V188-C215 WeakPolarHBondContact O-CB 3.29Å; V188-R216 PolarHBondContact N-O 3Å; V188-R216 PolarHBondContact O-N 3.28Å; V188-L218 HydrophobicContact CG2-CD1 4.2Å; V188-L218 HydrophobicContact CG2-CD2 4.12Å; V188-L218 HydrophobicContact CG2-CG 4.35Å; V188-D224 HydrophobicContact CG2-CB 4.1Å; V188-M226 HydrophobicContact CB-SD 4.07Å; V188-M226 HydrophobicContact CG1-CE 3.93Å; V188-M226 HydrophobicContact CG1-SD 3.68Å; V188-M226 HydrophobicContact CG2-SD 4.47Å; V188-G249 VanDerWaalsContact CG1-C 3.5Å; V188-G249 WeakPolarHBondContact CG1-O 3.44Å; V188-R250 HydrophobicContact CG2-CG 4.06Å
189	L	95.3	Very high	96	Very high	2 Å²	2	24.5 Å²	24.5	1%	0.01	12%	0.124	C	C	.	.			trans	-92.5	-27.4	-170.5	-67	173.2	0	0	0	114.2	V179 C182 I187 D191 L192 L209 L212 C215 D253	V179-L189 HydrophobicContact CB-CD1 4.37Å; V179-L189 HydrophobicContact CG1-CD1 4.36Å; V179-L189 HydrophobicContact CG2-CD1 3.93Å; C182-L189 HydrophobicContact CB-CD1 4.13Å; C182-L189 HydrophobicContact CB-CD2 4.24Å; C182-L189 HydrophobicContact CB-CG 4.2Å; I187-L189 HydrophobicContact CG2-CD2 4.19Å; L189-D191 PolarHBondContact O-N 3.38Å; L189-L192 HydrophobicContact CB-CD2 4.06Å; L189-L192 HydrophobicContact CB-CG 3.97Å; L189-L192 HydrophobicContact CD1-CD2 3.8Å; L189-L192 HydrophobicContact CD1-CG 4.4Å; L189-L209 HydrophobicContact CD1-CD2 3.97Å; L189-L209 HydrophobicContact CD2-CD2 3.78Å; L189-L212 HydrophobicContact CD2-CD2 3.76Å; L189-C215 HydrophobicContact CD2-CB 4.02Å; L189-D253 PolarHBondContact N-OD2 3.16Å
190	G	91.6	Very high	95.9	Very high	31 Å²	31	26.5 Å²	26.5	32%	0.32	14%	0.14	S	C	.	.	S	Bend	trans	72.2	-36.6	163.4	0	0	0	0	0	116.4	D253	G190-D253 PolarHBondContact N-OD1 3.32Å
191	D	89.7	Confident	95.9	Very high	30 Å²	30	27.9 Å²	27.9	16%	0.16	15%	0.147	C	C	.	.			trans	-125.1	50.2	-175.6	173.2	52.4	0	0	0	110.1	L189 K193 K196	L189-D191 PolarHBondContact O-N 3.38Å; D191-K193 PolarHBondContact O-N 3.45Å; D191-K193 WeakPolarHBondContact OD1-CD 3.44Å; D191-K193 WeakPolarHBondContact OD1-CE 3.34Å; D191-K193 IonicContact OD1-NZ 2.79Å; D191-K193 PolarHBondContact OD1-NZ 3.36Å; D191-K193 WeakPolarHBondContact OD2-CE 3.4Å; D191-K193 IonicContact OD2-NZ 2.81Å; D191-K193 PolarHBondContact OD2-NZ 3.3Å; D191-K196 WeakPolarHBondContact O-CD 3.34Å; D191-K196 WeakPolarHBondContact OD2-CD 3.45Å; D191-K196 IonicContact OD2-NZ 3.69Å; D191-K196 PolarHBondContact OD2-NZ 2.78Å
192	L	94.9	Very high	95.7	Very high	2 Å²	2	34 Å²	34	1%	0.01	18%	0.175	C	C	.	.			trans	-71.7	115.7	178.6	-81.2	-179.4	0	0	0	111.5	V179 L189 F197 Y235 D253 L257 M260	V179-L192 HydrophobicContact CG1-CD1 4.16Å; V179-L192 HydrophobicContact CG2-CD1 3.76Å; V179-L192 HydrophobicContact CG2-CD2 3.96Å; L189-L192 HydrophobicContact CB-CD2 4.06Å; L189-L192 HydrophobicContact CB-CG 3.97Å; L189-L192 HydrophobicContact CD1-CD2 3.8Å; L189-L192 HydrophobicContact CD1-CG 4.4Å; L192-F197 HydrophobicContact CD2-CE2 3.7Å; L192-F197 HydrophobicContact CD2-CZ 3.73Å; L192-Y235 WeakPolarHBondContact O-CD1 3.41Å; L192-D253 HydrophobicContact CD1-CB 3.59Å; L192-L257 HydrophobicContact CD1-CD2 4.39Å; L192-L257 HydrophobicContact CD1-CG 4.08Å; L192-M260 HydrophobicContact CB-SD 4.44Å
193	K	95.1	Very high	95.7	Very high	55 Å²	55	42.7 Å²	42.7	24%	0.239	21%	0.213	C	C	.	.			trans	-151.1	152.3	179.1	61.8	-162.3	170.1	-156.1	0	111.1	D191 R195 K196 Y235	D191-K193 PolarHBondContact O-N 3.45Å; D191-K193 WeakPolarHBondContact OD1-CD 3.44Å; D191-K193 WeakPolarHBondContact OD1-CE 3.34Å; D191-K193 IonicContact OD1-NZ 2.79Å; D191-K193 PolarHBondContact OD1-NZ 3.36Å; D191-K193 WeakPolarHBondContact OD2-CE 3.4Å; D191-K193 IonicContact OD2-NZ 2.81Å; D191-K193 PolarHBondContact OD2-NZ 3.3Å; K193-R195 PolarHBondContact O-N 2.89Å; K193-K196 HydrophobicContact CG-CD 4.36Å; K193-K196 HydrophobicContact CG-CG 4.08Å; K193-K196 PolarHBondContact O-N 2.87Å; K193-Y235 HydrophobicContact CB-CD1 4.34Å; K193-Y235 HydrophobicContact CB-CD2 4.24Å; K193-Y235 HydrophobicContact CB-CE1 3.97Å; K193-Y235 HydrophobicContact CB-CE2 3.85Å; K193-Y235 HydrophobicContact CB-CG 4.45Å
194	L	96.8	Very high	95.6	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-53.6	-30.9	-177.3	-74.8	169.2	0	0	0	114.1	M153 H154 V157 K196 F197 Y235 M260 T263 M264	M153-L194 HydrophobicContact CB-CB 4.42Å; M153-L194 HydrophobicContact CB-CD2 4.03Å; M153-L194 HydrophobicContact CE-CD2 4.09Å; H154-L194 HydrophobicContact CB-CB 3.69Å; V157-L194 HydrophobicContact CG2-CD1 4.27Å; L194-K196 VanDerWaalsContact C-N 3.33Å; L194-K196 PolarHBondContact O-N 2.72Å; L194-F197 PolarHBondContact O-N 3.41Å; L194-Y235 PolarHBondContact N-OH 3.44Å; L194-M260 HydrophobicContact CD2-CB 4.18Å; L194-M260 HydrophobicContact CD2-CE 3.84Å; L194-M260 HydrophobicContact CD2-CG 4.35Å; L194-M260 HydrophobicContact CG-CB 4.3Å; L194-M260 HydrophobicContact CG-CE 4.37Å; L194-M260 HydrophobicContact CG-CG 4.16Å; L194-T263 HydrophobicContact CD1-CG2 3.79Å; L194-M264 HydrophobicContact CD1-CG 4.36Å; L194-M264 HydrophobicContact CD2-CG 3.71Å; L194-M264 HydrophobicContact CD2-SD 3.84Å
195	R	94.7	Very high	95.6	Very high	150 Å²	150	44.8 Å²	44.8	57%	0.566	22%	0.224	S	C	*	.	G	3₁₀ helix	trans	-66.8	-26.5	177	177.8	172.1	-84	-172.9	-9.9	114	H154 K193 F197	H154-R195 HydrophobicContact CB-CB 4.3Å; K193-R195 PolarHBondContact O-N 2.89Å; R195-F197 PolarHBondContact O-N 2.91Å
196	K	95.1	Very high	95.7	Very high	13 Å²	13	45.6 Å²	45.6	6%	0.057	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-78.2	1	176.6	-71.6	-178.9	92.2	160.4	0	113.4	D191 K193 L194 L209 E210	D191-K196 WeakPolarHBondContact O-CD 3.34Å; D191-K196 WeakPolarHBondContact OD2-CD 3.45Å; D191-K196 IonicContact OD2-NZ 3.69Å; D191-K196 PolarHBondContact OD2-NZ 2.78Å; K193-K196 HydrophobicContact CG-CD 4.36Å; K193-K196 HydrophobicContact CG-CG 4.08Å; K193-K196 PolarHBondContact O-N 2.87Å; L194-K196 VanDerWaalsContact C-N 3.33Å; L194-K196 PolarHBondContact O-N 2.72Å; K196-L209 HydrophobicContact CB-CD1 4.1Å; K196-L209 CarbonylContact O-C 3.54Å; K196-L209 WeakPolarHBondContact O-CA 3.39Å; K196-E210 WeakPolarHBondContact O-CB 3.41Å; K196-E210 PolarHBondContact O-N 3.06Å
197	F	97.9	Very high	95.9	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	114.7	178.3	-71.2	-85.2	0	0	0	109.3	D152 M153 V175 A178 V179 L192 L194 R195 V207 R208 L209 M260	D152-F197 CarbonylContact C-O 3.59Å; D152-F197 WeakPolarHBondContact CA-O 3.37Å; M153-F197 HydrophobicContact CB-CB 4.44Å; M153-F197 HydrophobicContact CG-CB 4Å; M153-F197 PolarHBondContact N-O 2.77Å; M153-F197 HydrophobicContact SD-CB 3.63Å; M153-F197 HydrophobicContact SD-CG 4.46Å; V175-F197 HydrophobicContact CB-CD1 4.38Å; V175-F197 HydrophobicContact CB-CE1 4.22Å; V175-F197 HydrophobicContact CG1-CD1 4.37Å; V175-F197 HydrophobicContact CG1-CD2 4.46Å; V175-F197 HydrophobicContact CG1-CE1 3.94Å; V175-F197 HydrophobicContact CG1-CE2 4.04Å; V175-F197 HydrophobicContact CG1-CZ 3.76Å; V175-F197 HydrophobicContact CG2-CB 4.47Å; V175-F197 HydrophobicContact CG2-CD1 3.84Å; V175-F197 HydrophobicContact CG2-CE1 4.19Å; V175-F197 HydrophobicContact CG2-CG 4Å; A178-F197 HydrophobicContact CB-CE1 4.19Å; V179-F197 HydrophobicContact CG2-CZ 4.45Å; L192-F197 HydrophobicContact CD2-CE2 3.7Å; L192-F197 HydrophobicContact CD2-CZ 3.73Å; L194-F197 PolarHBondContact O-N 3.41Å; R195-F197 PolarHBondContact O-N 2.91Å; F197-V207 HydrophobicContact CB-CG1 3.79Å; F197-V207 HydrophobicContact CD1-CG1 3.89Å; F197-V207 HydrophobicContact CG-CG1 4.29Å; F197-R208 WeakPolarHBondContact CA-O 3.44Å; F197-L209 HydrophobicContact CD1-CB 4.32Å; F197-L209 HydrophobicContact CE1-CB 3.88Å; F197-L209 HydrophobicContact CE1-CD1 4.07Å; F197-L209 HydrophobicContact CE2-CD1 4.22Å; F197-L209 HydrophobicContact CZ-CB 4.47Å; F197-L209 HydrophobicContact CZ-CD1 3.84Å; F197-M260 HydrophobicContact CD2-CE 3.43Å; F197-M260 VanDerWaalsContact CD2-CE 3.43Å; F197-M260 HydrophobicContact CD2-SD 4.39Å; F197-M260 HydrophobicContact CE2-CE 3.58Å; F197-M260 HydrophobicContact CE2-SD 4.05Å; F197-M260 HydrophobicContact CG-CE 4.26Å
198	V	97.6	Very high	95.9	Very high	1 Å²	1	46.1 Å²	46.1	1%	0.006	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	153.1	-172.3	-59.9	0	0	0	0	111.3	D149 G151 D152 R208 E210	D149-V198 HydrophobicContact CB-CB 3.83Å; D149-V198 HydrophobicContact CB-CG2 3.73Å; G151-V198 WeakPolarHBondContact O-CA 3.48Å; D152-V198 HydrophobicContact CB-CG1 4.07Å; V198-R208 HydrophobicContact CG2-CG 3.83Å; V198-R208 PolarHBondContact N-O 2.87Å; V198-R208 PolarHBondContact O-N 3.48Å; V198-E210 HydrophobicContact CG1-CB 4.21Å; V198-E210 HydrophobicContact CG1-CG 4.23Å; V198-E210 HydrophobicContact CG2-CB 4.27Å; V198-E210 HydrophobicContact CG2-CG 4.41Å
199	F	98.3	Very high	96	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	134.6	178.4	-62.1	-72.5	0	0	0	110.9	D149 F150 G151 M153 L156 L171 R204 H206 V207	D149-F199 WeakPolarHBondContact CA-O 3.35Å; F150-F199 HydrophobicContact CB-CB 4.15Å; F150-F199 PolarHBondContact N-O 2.76Å; G151-F199 VanDerWaalsContact O-CD2 3.23Å; G151-F199 WeakPolarHBondContact O-CD2 3.48Å; G151-F199 PolarHBondContact O-N 2.87Å; M153-F199 HydrophobicContact CG-CE1 4.46Å; M153-F199 HydrophobicContact CG-CE2 4.3Å; M153-F199 HydrophobicContact CG-CZ 3.84Å; L156-F199 HydrophobicContact CB-CE2 4.11Å; L156-F199 HydrophobicContact CB-CZ 4.32Å; L156-F199 HydrophobicContact CD2-CE2 4.16Å; L156-F199 HydrophobicContact CD2-CZ 3.58Å; L171-F199 HydrophobicContact CD1-CE1 4.18Å; L171-F199 HydrophobicContact CD1-CZ 4.24Å; L171-F199 HydrophobicContact CD2-CE1 4.09Å; F199-R204 HydrophobicContact CB-CB 4.26Å; F199-R204 HydrophobicContact CB-CG 3.96Å; F199-R204 VanDerWaalsContact CD1-C 3.49Å; F199-R204 VanDerWaalsContact CD1-CA 3.44Å; F199-R204 HydrophobicContact CD1-CB 3.6Å; F199-R204 HydrophobicContact CD1-CG 4.16Å; F199-R204 WeakPolarHBondContact CD1-O 3.41Å; F199-R204 HydrophobicContact CD2-CB 3.9Å; F199-R204 HydrophobicContact CD2-CG 3.66Å; F199-R204 HydrophobicContact CE1-CB 3.87Å; F199-R204 VanDerWaalsContact CE1-O 3.26Å; F199-R204 WeakPolarHBondContact CE1-O 3.5Å; F199-R204 HydrophobicContact CE2-CB 4.19Å; F199-R204 HydrophobicContact CE2-CG 4.26Å; F199-R204 HydrophobicContact CG-CB 3.62Å; F199-R204 HydrophobicContact CG-CG 3.63Å; F199-R204 HydrophobicContact CZ-CB 4.18Å; F199-H206 WeakPolarHBondContact CA-O 3.31Å; F199-V207 HydrophobicContact CD1-CG2 3.78Å; F199-V207 HydrophobicContact CE1-CG2 3.48Å; F199-V207 VanDerWaalsContact CE1-CG2 3.48Å; F199-V207 HydrophobicContact CZ-CG2 4.35Å
200	A	96.7	Very high	96	Very high	42 Å²	42	47.4 Å²	47.4	35%	0.347	23%	0.229	S	C	.	.	S	Bend	trans	-93.7	-3.9	174.3	0	0	0	0	0	112.9	F150 H206 R208	F150-A200 WeakPolarHBondContact CE2-O 3.2Å; A200-H206 PolarHBondContact N-O 2.71Å; A200-R208 HydrophobicContact CB-CG 4.42Å
201	D	96.3	Very high	96	Very high	33 Å²	33	46.2 Å²	46.2	18%	0.176	22%	0.216	C	C	.	.	S	Bend	trans	-132.6	146	-179.9	68.6	-53.4	0	0	0	111.6	K203 R204 T205 H206	D201-K203 PolarHBondContact O-N 2.95Å; D201-K203 WeakPolarHBondContact OD2-CB 3.19Å; D201-R204 WeakPolarHBondContact O-CA 3.29Å; D201-R204 PolarHBondContact O-N 3.05Å; D201-R204 PolarHBondContact OD2-N 3.28Å; D201-T205 PolarHBondContact OD1-N 2.86Å; D201-T205 PolarHBondContact OD2-N 2.78Å; D201-T205 PolarHBondContact OD2-OG1 3.35Å; D201-H206 PolarHBondContact OD1-N 3.32Å
202	E	95.6	Very high	96.2	Very high	163 Å²	163	45 Å²	45	76%	0.762	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-30.5	177.9	-171.9	178.6	-157.9	0	0	112.9	F150 R204	F150-E202 HydrophobicContact CD1-CB 3.79Å; F150-E202 HydrophobicContact CD1-CG 4.23Å; F150-E202 HydrophobicContact CE1-CB 3.79Å; F150-E202 HydrophobicContact CE1-CG 4.37Å; F150-E202 HydrophobicContact CG-CB 4.49Å; F150-E202 HydrophobicContact CZ-CB 4.49Å; E202-R204 PolarHBondContact O-N 3.35Å
203	K	96.3	Very high	96	Very high	182 Å²	182	46.2 Å²	46.2	79%	0.791	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-4.8	176.2	-56.5	178	-177.3	176.3	0	113	D201 T205	D201-K203 PolarHBondContact O-N 2.95Å; D201-K203 WeakPolarHBondContact OD2-CB 3.19Å; K203-T205 VanDerWaalsContact C-N 3.28Å; K203-T205 HydrophobicContact CB-CG2 4.04Å; K203-T205 PolarHBondContact O-N 2.99Å
204	R	96.5	Very high	95.6	Very high	112 Å²	112	48 Å²	48	42%	0.423	23%	0.227	S	C	.	.	S	Bend	trans	53.4	40	178.7	-61.4	-176.1	169.3	148.3	0.1	113.9	F150 F199 D201 E202	F150-R204 VanDerWaalsContact O-CZ 3.27Å; F150-R204 PolarHBondContact O-NE 2.9Å; F150-R204 PolarHBondContact O-NH2 3.24Å; F199-R204 HydrophobicContact CB-CB 4.26Å; F199-R204 HydrophobicContact CB-CG 3.96Å; F199-R204 VanDerWaalsContact CD1-C 3.49Å; F199-R204 VanDerWaalsContact CD1-CA 3.44Å; F199-R204 HydrophobicContact CD1-CB 3.6Å; F199-R204 HydrophobicContact CD1-CG 4.16Å; F199-R204 WeakPolarHBondContact CD1-O 3.41Å; F199-R204 HydrophobicContact CD2-CB 3.9Å; F199-R204 HydrophobicContact CD2-CG 3.66Å; F199-R204 HydrophobicContact CE1-CB 3.87Å; F199-R204 VanDerWaalsContact CE1-O 3.26Å; F199-R204 WeakPolarHBondContact CE1-O 3.5Å; F199-R204 HydrophobicContact CE2-CB 4.19Å; F199-R204 HydrophobicContact CE2-CG 4.26Å; F199-R204 HydrophobicContact CG-CB 3.62Å; F199-R204 HydrophobicContact CG-CG 3.63Å; F199-R204 HydrophobicContact CZ-CB 4.18Å; D201-R204 WeakPolarHBondContact O-CA 3.29Å; D201-R204 PolarHBondContact O-N 3.05Å; D201-R204 PolarHBondContact OD2-N 3.28Å; E202-R204 PolarHBondContact O-N 3.35Å
205	T	96.3	Very high	95.4	Very high	87 Å²	87	49.1 Å²	49.1	53%	0.534	24%	0.235	S	C	.	.			trans	-99.1	-25.5	178.9	64.8	0	0	0	0	113.8	Q174 D201 K203	Q174-T205 PolarHBondContact NE2-O 2.97Å; D201-T205 PolarHBondContact OD1-N 2.86Å; D201-T205 PolarHBondContact OD2-N 2.78Å; D201-T205 PolarHBondContact OD2-OG1 3.35Å; K203-T205 VanDerWaalsContact C-N 3.28Å; K203-T205 HydrophobicContact CB-CG2 4.04Å; K203-T205 PolarHBondContact O-N 2.99Å
206	H	97.8	Very high	95.4	Very high	52 Å²	52	46.4 Å²	46.4	24%	0.241	23%	0.225	C	C	.	.			trans	-114.6	123.6	-176.7	-175.9	93.3	0	0	0	111.3	R127 N128 F199 A200 D201	R127-H206 PolarHBondContact O-CE1 2.91Å; R127-H206 PolarHBondContact O-NE2 2.6Å; N128-H206 PolarHBondContact ND2-CE1 2.73Å; N128-H206 VanDerWaalsContact ND2-CE1 3.28Å; F199-H206 WeakPolarHBondContact CA-O 3.31Å; A200-H206 PolarHBondContact N-O 2.71Å; D201-H206 PolarHBondContact OD1-N 3.32Å
207	V	98.2	Very high	95.3	Very high	0 Å²	0	48 Å²	48	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	137.7	-173.4	171	0	0	0	0	110.6	N128 M153 L171 Q174 V175 F197 F199	N128-V207 WeakPolarHBondContact CA-O 3.23Å; N128-V207 WeakPolarHBondContact CB-O 3.44Å; N128-V207 PolarHBondContact ND2-O 2.92Å; M153-V207 HydrophobicContact CG-CG2 4.34Å; M153-V207 HydrophobicContact SD-CG1 3.74Å; M153-V207 HydrophobicContact SD-CG2 3.97Å; L171-V207 HydrophobicContact CB-CG2 4.45Å; L171-V207 HydrophobicContact CD2-CG2 3.87Å; Q174-V207 HydrophobicContact CB-CB 4.16Å; V175-V207 HydrophobicContact CG2-CG1 4.21Å; F197-V207 HydrophobicContact CB-CG1 3.79Å; F197-V207 HydrophobicContact CD1-CG1 3.89Å; F197-V207 HydrophobicContact CG-CG1 4.29Å; F199-V207 HydrophobicContact CD1-CG2 3.78Å; F199-V207 HydrophobicContact CE1-CG2 3.48Å; F199-V207 VanDerWaalsContact CE1-CG2 3.48Å; F199-V207 HydrophobicContact CZ-CG2 4.35Å
208	R	97.6	Very high	95.1	Very high	12 Å²	12	48.8 Å²	48.8	5%	0.045	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	146.4	169	59.6	-179.2	170.7	122.5	-3.9	111.9	N128 D147 K148 F197 V198 A200 E210	N128-R208 CarbonylContact O-C 3.55Å; N128-R208 VanDerWaalsContact O-CA 3.3Å; N128-R208 WeakPolarHBondContact O-CA 3.2Å; D147-R208 PolarHBondContact O-NH1 3.38Å; D147-R208 PolarHBondContact O-NH2 2.71Å; K148-R208 PolarHBondContact O-NH2 2.98Å; F197-R208 WeakPolarHBondContact CA-O 3.44Å; V198-R208 HydrophobicContact CG2-CG 3.83Å; V198-R208 PolarHBondContact N-O 2.87Å; V198-R208 PolarHBondContact O-N 3.48Å; A200-R208 HydrophobicContact CB-CG 4.42Å; R208-E210 PolarHBondContact O-N 3.42Å
209	L	97.8	Very high	94.7	Very high	1 Å²	1	58.6 Å²	58.6	1%	0.005	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	126.1	162.6	177.2	64.4	0	0	0	108.7	N128 V129 A130 A178 L189 K196 F197 L212	N128-L209 PolarHBondContact O-N 2.95Å; V129-L209 HydrophobicContact CG1-CB 4.45Å; V129-L209 HydrophobicContact CG1-CD2 4.41Å; V129-L209 HydrophobicContact CG2-CB 4.39Å; A130-L209 WeakPolarHBondContact CB-O 3.28Å; A130-L209 PolarHBondContact N-O 2.85Å; A178-L209 HydrophobicContact CB-CB 4.39Å; L189-L209 HydrophobicContact CD1-CD2 3.97Å; L189-L209 HydrophobicContact CD2-CD2 3.78Å; K196-L209 HydrophobicContact CB-CD1 4.1Å; K196-L209 CarbonylContact O-C 3.54Å; K196-L209 WeakPolarHBondContact O-CA 3.39Å; F197-L209 HydrophobicContact CD1-CB 4.32Å; F197-L209 HydrophobicContact CE1-CB 3.88Å; F197-L209 HydrophobicContact CE1-CD1 4.07Å; F197-L209 HydrophobicContact CE2-CD1 4.22Å; F197-L209 HydrophobicContact CZ-CB 4.47Å; F197-L209 HydrophobicContact CZ-CD1 3.84Å; L209-L212 HydrophobicContact CD2-CD2 3.64Å
210	E	94.9	Very high	94.2	Very high	29 Å²	29	61.2 Å²	61.2	14%	0.136	30%	0.297	C	S	.	.			trans	-66.2	-44.6	-173.7	-169.2	-140.5	111.3	0	0	112.3	R88 K106 A130 K196 V198 R208	R88-E210 IonicContact NH2-OE1 2.66Å; R88-E210 IonicContact NH2-OE2 2.71Å; R88-E210 PolarHBondContact NH2-OE2 2.63Å; K106-E210 WeakPolarHBondContact CE-OE1 3.32Å; K106-E210 IonicContact NZ-OE1 3.7Å; K106-E210 PolarHBondContact NZ-OE1 2.85Å; A130-E210 WeakPolarHBondContact CB-O 3.44Å; K196-E210 WeakPolarHBondContact O-CB 3.41Å; K196-E210 PolarHBondContact O-N 3.06Å; V198-E210 HydrophobicContact CG1-CB 4.21Å; V198-E210 HydrophobicContact CG1-CG 4.23Å; V198-E210 HydrophobicContact CG2-CB 4.27Å; V198-E210 HydrophobicContact CG2-CG 4.41Å; R208-E210 PolarHBondContact O-N 3.42Å
211	S	91.8	Very high	93.6	Very high	6 Å²	6	62.4 Å²	62.4	4%	0.042	30%	0.302	C	S	.	.			trans	-155.3	160.4	-174.6	67.7	0	0	0	0	115.2	Y120 E213	Y120-S211 VanDerWaalsContact OH-CA 3.31Å; Y120-S211 WeakPolarHBondContact OH-CA 3.19Å; S211-E213 WeakPolarHBondContact CB-OE1 3.43Å
212	L	94	Very high	92.9	Very high	4 Å²	4	67.3 Å²	67.3	2%	0.021	33%	0.328	C	S	.	.			trans	-114.4	12.8	174.1	-58.4	174.6	0	0	0	112.8	A119 Y120 L123 V129 L189 L209 D214 C215	A119-L212 HydrophobicContact CB-CB 3.58Å; A119-L212 HydrophobicContact CB-CD1 3.91Å; A119-L212 HydrophobicContact CB-CG 4.35Å; Y120-L212 HydrophobicContact CD1-CD1 3.73Å; Y120-L212 HydrophobicContact CD1-CG 4.31Å; Y120-L212 HydrophobicContact CE1-CB 4.18Å; Y120-L212 HydrophobicContact CE1-CD1 3.92Å; Y120-L212 HydrophobicContact CE1-CG 3.97Å; Y120-L212 HydrophobicContact CE2-CB 4.09Å; Y120-L212 HydrophobicContact CG-CD1 4.12Å; Y120-L212 PolarHBondContact OH-N 3.37Å; Y120-L212 VanDerWaalsContact OH-N 3.08Å; L123-L212 HydrophobicContact CB-CD1 4.49Å; L123-L212 HydrophobicContact CD2-CD1 3.63Å; V129-L212 HydrophobicContact CG1-CD1 4.23Å; V129-L212 HydrophobicContact CG1-CD2 4.35Å; V129-L212 HydrophobicContact CG1-CG 4.34Å; L189-L212 HydrophobicContact CD2-CD2 3.76Å; L209-L212 HydrophobicContact CD2-CD2 3.64Å; L212-D214 PolarHBondContact O-N 2.77Å; L212-D214 VanDerWaalsContact O-N 3.17Å; L212-C215 PolarHBondContact O-N 3.14Å; L212-C215 PolarHBondContact O-SG 3.36Å
213	E	90.3	Very high	92.6	Very high	29 Å²	29	68.4 Å²	68.4	14%	0.136	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-24.9	-171.4	-80.3	135.6	-128	0	0	115.2	K106 F108 K116 Y120 S211	K106-E213 VanDerWaalsContact CD-OE1 3.25Å; K106-E213 WeakPolarHBondContact CD-OE1 3.42Å; K106-E213 WeakPolarHBondContact CD-OE2 3.49Å; K106-E213 IonicContact NZ-OE1 3.83Å; K106-E213 PolarHBondContact NZ-OE1 3.2Å; K106-E213 IonicContact NZ-OE2 3.44Å; K106-E213 PolarHBondContact NZ-OE2 3.4Å; F108-E213 HydrophobicContact CE1-CG 4.2Å; F108-E213 HydrophobicContact CZ-CG 3.85Å; K116-E213 HydrophobicContact CB-CG 4.29Å; K116-E213 HydrophobicContact CD-CB 4.07Å; K116-E213 HydrophobicContact CD-CG 4.47Å; K116-E213 WeakPolarHBondContact CD-O 3.45Å; K116-E213 PolarHBondContact NZ-O 3.42Å; Y120-E213 PolarHBondContact OH-OE1 2.8Å; S211-E213 WeakPolarHBondContact CB-OE1 3.43Å
214	D	87.6	Confident	92.3	Very high	91 Å²	91	61 Å²	61	49%	0.487	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.4	24.2	-176.1	-46	-62.3	0	0	0	111.8	K116 L212	K116-D214 IonicContact NZ-OD1 2.68Å; K116-D214 PolarHBondContact NZ-OD1 2.97Å; L212-D214 PolarHBondContact O-N 2.77Å; L212-D214 VanDerWaalsContact O-N 3.17Å
215	C	93.1	Very high	92	Very high	24 Å²	24	58.2 Å²	58.2	16%	0.162	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-91	154.6	176.6	78.8	0	0	0	0	111.8	A119 I187 V188 L189 L212	A119-C215 WeakPolarHBondContact CB-SG 3.26Å; I187-C215 HydrophobicContact CG2-CB 3.71Å; I187-C215 WeakPolarHBondContact CG2-SG 3.29Å; V188-C215 CarbonylContact O-C 3.58Å; V188-C215 WeakPolarHBondContact O-CA 3.48Å; V188-C215 VanDerWaalsContact O-CB 3.28Å; V188-C215 WeakPolarHBondContact O-CB 3.29Å; L189-C215 HydrophobicContact CD2-CB 4.02Å; L212-C215 PolarHBondContact O-N 3.14Å; L212-C215 PolarHBondContact O-SG 3.36Å
216	R	93.3	Very high	91.5	Very high	94 Å²	94	54.5 Å²	54.5	36%	0.355	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	116.3	177.8	-172.1	171.4	172.1	155.1	-7	109.9	V188 S225 M226 D228	V188-R216 PolarHBondContact N-O 3Å; V188-R216 PolarHBondContact O-N 3.28Å; R216-S225 PolarHBondContact NH2-O 3.47Å; R216-M226 HydrophobicContact CB-SD 4.23Å; R216-M226 HydrophobicContact CG-SD 4.48Å; R216-D228 IonicContact CZ-OD2 2.7Å; R216-D228 IonicContact NH1-OD1 2.79Å; R216-D228 IonicContact NH1-OD2 2.71Å; R216-D228 PolarHBondContact NH1-OD2 3.48Å
217	I	94.5	Very high	90.8	Very high	47 Å²	47	55.2 Å²	55.2	24%	0.241	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	129.2	168.3	-54.2	167.3	0	0	0	107.5	R118 A119 V122 I187	R118-I217 HydrophobicContact CB-CD1 4.07Å; R118-I217 HydrophobicContact CG-CD1 3.68Å; A119-I217 HydrophobicContact CB-CD1 4.37Å; A119-I217 HydrophobicContact CB-CG1 4.48Å; V122-I217 HydrophobicContact CG2-CD1 4.04Å; V122-I217 HydrophobicContact CG2-CG1 4.36Å; V122-I217 HydrophobicContact CG2-CG2 4.4Å; I187-I217 HydrophobicContact CG1-CG1 4.44Å
218	L	93.4	Very high	89.8	Confident	16 Å²	16	58.1 Å²	58.1	8%	0.084	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-85.3	137.6	179.1	-55.2	179.9	0	0	0	110.9	G186 V188 D224	G186-L218 WeakPolarHBondContact O-CB 3.19Å; G186-L218 WeakPolarHBondContact O-CG 3.35Å; G186-L218 PolarHBondContact O-N 2.58Å; V188-L218 HydrophobicContact CG2-CD1 4.2Å; V188-L218 HydrophobicContact CG2-CD2 4.12Å; V188-L218 HydrophobicContact CG2-CG 4.35Å; L218-D224 HydrophobicContact CD1-CB 3.64Å; L218-D224 HydrophobicContact CD2-CB 4.41Å
219	E	88.7	Confident	88.4	Confident	206 Å²	206	62.4 Å²	62.4	96%	0.963	32%	0.323	S	S	*	.	S	Bend	trans	-74.1	-37.8	175.6	-59.6	-177.2	156.5	0	0	111.8
220	D	88.5	Confident	87.1	Confident	55 Å²	55	69.6 Å²	69.6	29%	0.294	36%	0.356	S	S	.	.	S	Bend	trans	-115.2	115.8	167	171.9	4.7	0	0	0	107.7	N222 R223	D220-N222 PolarHBondContact O-N 2.84Å; D220-N222 WeakPolarHBondContact OD1-CB 3.4Å; D220-N222 PolarHBondContact OD1-N 2.8Å; D220-N222 PolarHBondContact OD1-ND2 3.36Å; D220-R223 HydrophobicContact CB-CB 4.14Å; D220-R223 HydrophobicContact CB-CG 4.24Å; D220-R223 PolarHBondContact O-N 3.41Å; D220-R223 VanDerWaalsContact OD2-CD 3.23Å; D220-R223 WeakPolarHBondContact OD2-CD 3.47Å; D220-R223 VanDerWaalsContact OD2-CG 3.29Å; D220-R223 WeakPolarHBondContact OD2-CG 3.29Å; D220-R223 IonicContact OD2-NE 3.64Å; D220-R223 PolarHBondContact OD2-NE 3.47Å
221	P	82.3	Confident	85.9	Confident	68 Å²	68	70.1 Å²	70.1	44%	0.442	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-13.9	178	-27.3	36	0	0	0	115.1	R250	P221-R250 VanDerWaalsContact O-CZ 3.27Å; P221-R250 PolarHBondContact O-NH1 3.04Å; P221-R250 PolarHBondContact O-NH2 3.16Å
222	N	82.9	Confident	85.4	Confident	135 Å²	135	71.9 Å²	71.9	72%	0.722	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.9	-7.5	176.3	-50.2	-79.1	0	0	0	113.3	D220	D220-N222 PolarHBondContact O-N 2.84Å; D220-N222 WeakPolarHBondContact OD1-CB 3.4Å; D220-N222 PolarHBondContact OD1-N 2.8Å; D220-N222 PolarHBondContact OD1-ND2 3.36Å
223	R	88.6	Confident	84.9	Confident	186 Å²	186	74.8 Å²	74.8	70%	0.702	40%	0.4	S	S	*	.			trans	-120.3	82.3	-177.3	-68.7	176.1	175.9	-148.8	-6	111.2	D220 S225	D220-R223 HydrophobicContact CB-CB 4.14Å; D220-R223 HydrophobicContact CB-CG 4.24Å; D220-R223 PolarHBondContact O-N 3.41Å; D220-R223 VanDerWaalsContact OD2-CD 3.23Å; D220-R223 WeakPolarHBondContact OD2-CD 3.47Å; D220-R223 VanDerWaalsContact OD2-CG 3.29Å; D220-R223 WeakPolarHBondContact OD2-CG 3.29Å; D220-R223 IonicContact OD2-NE 3.64Å; D220-R223 PolarHBondContact OD2-NE 3.47Å; R223-S225 PolarHBondContact O-N 3.47Å
224	D	90.7	Very high	84.8	Confident	26 Å²	26	74 Å²	74	14%	0.139	40%	0.399	C	S	.	.			trans	-84.2	28.5	176.2	73.5	-46.4	0	0	0	113.6	V188 L218 M226 S248 G249 R250	V188-D224 HydrophobicContact CG2-CB 4.1Å; L218-D224 HydrophobicContact CD1-CB 3.64Å; L218-D224 HydrophobicContact CD2-CB 4.41Å; D224-M226 WeakPolarHBondContact O-CG 3.36Å; D224-M226 PolarHBondContact O-N 3.09Å; D224-S248 WeakPolarHBondContact OD2-CA 3.42Å; D224-S248 WeakPolarHBondContact OD2-CB 3.39Å; D224-S248 PolarHBondContact OD2-OG 2.83Å; D224-G249 PolarHBondContact O-N 3.25Å; D224-G249 PolarHBondContact OD2-N 3.47Å; D224-G249 VanDerWaalsContact OD2-N 3.14Å; D224-R250 HydrophobicContact CB-CG 3.95Å; D224-R250 VanDerWaalsContact OD2-CB 3.26Å; D224-R250 WeakPolarHBondContact OD2-CB 3.48Å; D224-R250 WeakPolarHBondContact OD2-CG 3.42Å; D224-R250 PolarHBondContact OD2-N 3.29Å
225	S	89.4	Confident	85.1	Confident	55 Å²	55	70.1 Å²	70.1	39%	0.385	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	120	-171.5	-146.6	0	0	0	0	111.2	R216 R223 P246 Y247	R216-S225 PolarHBondContact NH2-O 3.47Å; R223-S225 PolarHBondContact O-N 3.47Å; S225-P246 VanDerWaalsContact OG-CB 3.32Å; S225-P246 WeakPolarHBondContact OG-CB 3.32Å; S225-P246 WeakPolarHBondContact OG-CG 3.31Å; S225-Y247 CarbonylContact C-O 3.53Å; S225-Y247 WeakPolarHBondContact CA-O 3.34Å
226	M	86.4	Confident	85.1	Confident	8 Å²	8	70 Å²	70	4%	0.039	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	157	-173.6	-49.6	-160.1	-41.4	0	0	112.9	V188 R216 D224 P246 Y247	V188-M226 HydrophobicContact CB-SD 4.07Å; V188-M226 HydrophobicContact CG1-CE 3.93Å; V188-M226 HydrophobicContact CG1-SD 3.68Å; V188-M226 HydrophobicContact CG2-SD 4.47Å; R216-M226 HydrophobicContact CB-SD 4.23Å; R216-M226 HydrophobicContact CG-SD 4.48Å; D224-M226 WeakPolarHBondContact O-CG 3.36Å; D224-M226 PolarHBondContact O-N 3.09Å; M226-P246 CarbonylContact O-C 3.6Å; M226-P246 WeakPolarHBondContact O-CA 3.34Å; M226-P246 WeakPolarHBondContact O-CB 3.41Å; M226-Y247 HydrophobicContact CB-CE1 4.04Å; M226-Y247 HydrophobicContact CB-CE2 4.34Å; M226-Y247 HydrophobicContact CE-CE2 3.83Å; M226-Y247 VanDerWaalsContact CE-OH 3.26Å; M226-Y247 WeakPolarHBondContact CE-OH 3.43Å; M226-Y247 PolarHBondContact N-O 2.97Å; M226-Y247 WeakPolarHBondContact O-CD1 3.4Å; M226-Y247 WeakPolarHBondContact O-CE1 3.42Å; M226-Y247 PolarHBondContact O-N 3.2Å
227	S	83.4	Confident	85.1	Confident	68 Å²	68	65.6 Å²	65.6	48%	0.476	36%	0.359	S	S	.	.			trans	-117.6	-9.3	-177.6	38.5	0	0	0	0	113.4
228	D	77.4	Confident	85	Confident	61 Å²	61	63.4 Å²	63.4	33%	0.326	35%	0.348	S	S	.	.			trans	-99.8	120.5	-151.2	-38	-44.1	0	0	0	110.4	R216 H230 Y247	R216-D228 IonicContact CZ-OD2 2.7Å; R216-D228 IonicContact NH1-OD1 2.79Å; R216-D228 IonicContact NH1-OD2 2.71Å; R216-D228 PolarHBondContact NH1-OD2 3.48Å; D228-H230 VanDerWaalsContact C-N 3.32Å; D228-H230 PolarHBondContact O-N 3.25Å; D228-Y247 PolarHBondContact O-OH 3.3Å
229	T	67.6	Low	85	Confident	101 Å²	101	63.2 Å²	63.2	62%	0.62	35%	0.347	S	S	*	.			trans	-94.9	43	-166.1	51.2	0	0	0	0	113.6	I240	T229-I240 HydrophobicContact CG2-CG2 4.21Å
230	H	69.9	Low	85.1	Confident	152 Å²	152	54.9 Å²	54.9	70%	0.704	31%	0.308	S	S	*	.			trans	-99.3	136.7	-179.1	-56.8	-50.9	0	0	0	112.1	D228	D228-H230 VanDerWaalsContact C-N 3.32Å; D228-H230 PolarHBondContact O-N 3.25Å
231	G	69.6	Low	85.1	Confident	40 Å²	40	53.7 Å²	53.7	41%	0.412	30%	0.302	S	S	.	.	S	Bend	trans	163.7	166.4	175.6	0	0	0	0	0	113.5
232	C	81.2	Confident	85.2	Confident	44 Å²	44	53.4 Å²	53.4	30%	0.297	30%	0.301	S	S	.	.			trans	-75.5	127.6	172.8	-179.7	0	0	0	0	110.2	A234 Y235 V236	C232-A234 PolarHBondContact O-N 2.82Å; C232-Y235 HydrophobicContact CB-CD2 3.87Å; C232-Y235 PolarHBondContact O-N 3.5Å; C232-V236 PolarHBondContact O-N 2.9Å
233	P	84.8	Confident	84.7	Confident	64 Å²	64	49.7 Å²	49.7	42%	0.416	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.1	-28.7	-172.8	-32.9	37.3	0	0	0	116.8	Y235 L279 F280	P233-Y235 VanDerWaalsContact C-N 3.3Å; P233-Y235 PolarHBondContact O-N 3.04Å; P233-L279 HydrophobicContact CB-CD2 4.11Å; P233-F280 HydrophobicContact CB-CE1 4.14Å; P233-F280 HydrophobicContact CB-CZ 4.48Å
234	A	88.4	Confident	83.8	Confident	13 Å²	13	44 Å²	44	11%	0.107	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-15.5	177.2	0	0	0	0	0	114.3	C232 V259 Y269	C232-A234 PolarHBondContact O-N 2.82Å; A234-V259 WeakPolarHBondContact O-CG1 3.48Å; A234-Y269 HydrophobicContact CB-CD1 3.88Å; A234-Y269 HydrophobicContact CB-CD2 3.94Å; A234-Y269 HydrophobicContact CB-CE1 4.07Å; A234-Y269 HydrophobicContact CB-CE2 4.11Å; A234-Y269 HydrophobicContact CB-CG 3.83Å
235	Y	92.9	Very high	83.1	Confident	10 Å²	10	46.6 Å²	46.6	4%	0.039	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.3	-12.1	-177.1	-66	-98	0	0	0	113.3	L192 K193 L194 C232 P233 W255 S256 V259 M260 Y269	L192-Y235 WeakPolarHBondContact O-CD1 3.41Å; K193-Y235 HydrophobicContact CB-CD1 4.34Å; K193-Y235 HydrophobicContact CB-CD2 4.24Å; K193-Y235 HydrophobicContact CB-CE1 3.97Å; K193-Y235 HydrophobicContact CB-CE2 3.85Å; K193-Y235 HydrophobicContact CB-CG 4.45Å; L194-Y235 PolarHBondContact N-OH 3.44Å; C232-Y235 HydrophobicContact CB-CD2 3.87Å; C232-Y235 PolarHBondContact O-N 3.5Å; P233-Y235 VanDerWaalsContact C-N 3.3Å; P233-Y235 PolarHBondContact O-N 3.04Å; Y235-W255 VanDerWaalsContact O-CD1 3.23Å; Y235-S256 PolarHBondContact O-OG 3.28Å; Y235-V259 HydrophobicContact CD1-CB 3.83Å; Y235-V259 HydrophobicContact CD1-CG1 3.47Å; Y235-V259 VanDerWaalsContact CD1-CG1 3.47Å; Y235-V259 HydrophobicContact CD2-CG1 4.48Å; Y235-V259 HydrophobicContact CE1-CB 4.21Å; Y235-V259 HydrophobicContact CE1-CG1 3.64Å; Y235-V259 HydrophobicContact CG-CG1 3.94Å; Y235-M260 HydrophobicContact CD1-CG 4.45Å; Y235-M260 HydrophobicContact CE1-CG 3.73Å; Y235-Y269 HydrophobicContact CD2-CE1 4.46Å; Y235-Y269 HydrophobicContact CE2-CD1 4.5Å; Y235-Y269 AromaticContact CE2-CE1 3.58Å; Y235-Y269 HydrophobicContact CE2-CE1 3.58Å; Y235-Y269 AromaticContact CZ-CE1 3.7Å
236	V	92.6	Very high	83	Confident	21 Å²	21	48.3 Å²	48.3	13%	0.127	31%	0.31	C	S	.	.			trans	-60.9	140.2	179.2	-175.2	0	0	0	0	110.7	C232 I240 L241 W255	C232-V236 PolarHBondContact O-N 2.9Å; V236-I240 HydrophobicContact CG1-CB 3.79Å; V236-I240 HydrophobicContact CG1-CD1 4.21Å; V236-I240 HydrophobicContact CG1-CG2 3.74Å; V236-L241 HydrophobicContact CG1-CD1 4.41Å; V236-L241 HydrophobicContact CG1-CD2 3.85Å; V236-L241 HydrophobicContact CG1-CG 3.79Å; V236-W255 PolarHBondContact O-NE1 2.9Å
237	S	93.1	Very high	83.2	Confident	1 Å²	1	48.5 Å²	48.5	1%	0.007	31%	0.311	C	S	.	.			trans	-91.6	159.5	-177.3	61	0	0	0	0	113.8	E239 I240 L241	S237-E239 VanDerWaalsContact C-N 3.32Å; S237-E239 VanDerWaalsContact CB-CD 3.49Å; S237-E239 WeakPolarHBondContact CB-OE1 3.13Å; S237-E239 WeakPolarHBondContact CB-OE2 3.39Å; S237-E239 PolarHBondContact O-N 2.97Å; S237-E239 PolarHBondContact OG-OE1 2.88Å; S237-E239 PolarHBondContact OG-OE2 3.35Å; S237-I240 PolarHBondContact O-N 3.1Å; S237-I240 WeakPolarHBondContact OG-CD1 3.47Å; S237-I240 WeakPolarHBondContact OG-CG1 3.01Å; S237-L241 PolarHBondContact O-N 3.42Å
238	P	93.7	Very high	83.8	Confident	2 Å²	2	46.9 Å²	46.9	1%	0.013	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-36	-174.7	-26.7	36.3	0	0	0	114.6	L241 S242 W255 I283 K308	P238-L241 PolarHBondContact O-N 3.12Å; P238-S242 WeakPolarHBondContact O-CB 3.42Å; P238-S242 PolarHBondContact O-N 3.38Å; P238-S242 PolarHBondContact O-OG 3.38Å; P238-W255 HydrophobicContact CG-CE3 4.17Å; P238-W255 HydrophobicContact CG-CH2 3.56Å; P238-W255 HydrophobicContact CG-CZ2 3.99Å; P238-W255 HydrophobicContact CG-CZ3 3.66Å; P238-I283 HydrophobicContact CG-CG2 4.1Å; P238-K308 HydrophobicContact CB-CG 4.17Å; P238-K308 HydrophobicContact CG-CG 4.43Å
239	E	92.3	Very high	84.6	Confident	12 Å²	12	44 Å²	44	6%	0.056	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-40.1	-179.1	61.9	-77.8	-174.5	0	0	112.5	S237 L241 S242 S244 Y247 P310 R313	S237-E239 VanDerWaalsContact C-N 3.32Å; S237-E239 VanDerWaalsContact CB-CD 3.49Å; S237-E239 WeakPolarHBondContact CB-OE1 3.13Å; S237-E239 WeakPolarHBondContact CB-OE2 3.39Å; S237-E239 PolarHBondContact O-N 2.97Å; S237-E239 PolarHBondContact OG-OE1 2.88Å; S237-E239 PolarHBondContact OG-OE2 3.35Å; E239-L241 VanDerWaalsContact C-N 3.33Å; E239-L241 PolarHBondContact O-N 3.22Å; E239-S242 PolarHBondContact O-N 2.92Å; E239-S244 PolarHBondContact O-N 2.84Å; E239-Y247 HydrophobicContact CG-CD2 4.33Å; E239-Y247 HydrophobicContact CG-CG 4.37Å; E239-P310 HydrophobicContact CB-CG 3.97Å; E239-P310 HydrophobicContact CG-CG 3.88Å; E239-R313 IonicContact OE1-CZ 3.75Å; E239-R313 IonicContact OE1-NH1 3.47Å; E239-R313 PolarHBondContact OE1-NH1 3.14Å; E239-R313 IonicContact OE1-NH2 3.7Å; E239-R313 IonicContact OE2-CZ 3.71Å; E239-R313 IonicContact OE2-NH1 3.78Å; E239-R313 PolarHBondContact OE2-NH1 3.03Å; E239-R313 IonicContact OE2-NH2 2.74Å; E239-R313 PolarHBondContact OE2-NH2 3.05Å
240	I	90.9	Very high	86	Confident	30 Å²	30	41.5 Å²	41.5	15%	0.154	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-62.2	-43.5	174.2	-59.7	174.6	0	0	0	109.9	T229 V236 S237 S242 Y247 A252	T229-I240 HydrophobicContact CG2-CG2 4.21Å; V236-I240 HydrophobicContact CG1-CB 3.79Å; V236-I240 HydrophobicContact CG1-CD1 4.21Å; V236-I240 HydrophobicContact CG1-CG2 3.74Å; S237-I240 PolarHBondContact O-N 3.1Å; S237-I240 WeakPolarHBondContact OG-CD1 3.47Å; S237-I240 WeakPolarHBondContact OG-CG1 3.01Å; I240-S242 VanDerWaalsContact C-N 3.26Å; I240-S242 PolarHBondContact O-N 3.04Å; I240-Y247 HydrophobicContact CD1-CD2 4.42Å; I240-Y247 HydrophobicContact CD1-CE1 4.44Å; I240-Y247 HydrophobicContact CD1-CE2 3.73Å; I240-Y247 HydrophobicContact CG1-CD1 4.2Å; I240-Y247 HydrophobicContact CG1-CD2 4Å; I240-Y247 HydrophobicContact CG1-CE1 3.95Å; I240-Y247 HydrophobicContact CG1-CE2 3.74Å; I240-Y247 HydrophobicContact CG1-CG 4.23Å; I240-A252 HydrophobicContact CD1-CB 4.25Å
241	L	89.1	Confident	87.3	Confident	31 Å²	31	35.3 Å²	35.3	16%	0.162	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-76.8	-7.6	179.4	-63.1	178.7	0	0	0	114.8	V236 S237 P238 E239 F280 I283 R284	V236-L241 HydrophobicContact CG1-CD1 4.41Å; V236-L241 HydrophobicContact CG1-CD2 3.85Å; V236-L241 HydrophobicContact CG1-CG 3.79Å; S237-L241 PolarHBondContact O-N 3.42Å; P238-L241 PolarHBondContact O-N 3.12Å; E239-L241 VanDerWaalsContact C-N 3.33Å; E239-L241 PolarHBondContact O-N 3.22Å; L241-F280 HydrophobicContact CD1-CB 3.94Å; L241-F280 HydrophobicContact CD1-CD1 3.63Å; L241-F280 HydrophobicContact CD1-CG 4.07Å; L241-F280 HydrophobicContact CD2-CB 4.37Å; L241-F280 HydrophobicContact CD2-CD1 3.61Å; L241-F280 HydrophobicContact CD2-CD2 4.44Å; L241-F280 HydrophobicContact CD2-CE1 3.94Å; L241-F280 HydrophobicContact CD2-CG 3.89Å; L241-F280 HydrophobicContact CD2-CZ 4.49Å; L241-F280 HydrophobicContact CG-CD1 4.29Å; L241-I283 HydrophobicContact CD1-CB 3.69Å; L241-I283 HydrophobicContact CD1-CD1 4Å; L241-I283 HydrophobicContact CD1-CG1 4.45Å; L241-I283 HydrophobicContact CD1-CG2 3.51Å; L241-R284 HydrophobicContact CB-CG 3.89Å; L241-R284 WeakPolarHBondContact O-CD 3.43Å; L241-R284 PolarHBondContact O-NH1 3.45Å
242	S	83.6	Confident	88.5	Confident	61 Å²	61	33.8 Å²	33.8	43%	0.427	22%	0.218	S	C	.	.	G	3₁₀ helix	trans	-99.4	-0.5	179.8	-59.4	0	0	0	0	112.8	P238 E239 I240 S244	P238-S242 WeakPolarHBondContact O-CB 3.42Å; P238-S242 PolarHBondContact O-N 3.38Å; P238-S242 PolarHBondContact O-OG 3.38Å; E239-S242 PolarHBondContact O-N 2.92Å; I240-S242 VanDerWaalsContact C-N 3.26Å; I240-S242 PolarHBondContact O-N 3.04Å; S242-S244 PolarHBondContact O-N 3.02Å
243	G	72.6	Confident	89.3	Confident	57 Å²	57	31.7 Å²	31.7	59%	0.588	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	68.8	19.3	-175.6	0	0	0	0	0	113.3	T245	G243-T245 PolarHBondContact O-N 2.86Å
244	S	69.6	Low	90	Very high	67 Å²	67	28.6 Å²	28.6	47%	0.469	18%	0.184	S	C	.	.			trans	-80.5	51.9	-176.7	-52.9	0	0	0	0	111.5	E239 S242 P246	E239-S244 PolarHBondContact O-N 2.84Å; S242-S244 PolarHBondContact O-N 3.02Å; S244-P246 CarbonylContact O-C 3.45Å
245	T	76.5	Confident	90.4	Very high	81 Å²	81	28 Å²	28	50%	0.497	18%	0.179	S	C	.	.			trans	-84.7	137.6	177.8	50.7	0	0	0	0	111.1	G243 Y247	G243-T245 PolarHBondContact O-N 2.86Å; T245-Y247 HydrophobicContact CG2-CD1 4.48Å
246	P	87.9	Confident	90.6	Very high	90 Å²	90	27.9 Å²	27.9	58%	0.584	18%	0.18	S	C	*	.	S	Bend	cis	-84.8	147.5	0.4	36.9	-36.6	0	0	0	112.3	S225 M226 S244	S225-P246 VanDerWaalsContact OG-CB 3.32Å; S225-P246 WeakPolarHBondContact OG-CB 3.32Å; S225-P246 WeakPolarHBondContact OG-CG 3.31Å; M226-P246 CarbonylContact O-C 3.6Å; M226-P246 WeakPolarHBondContact O-CA 3.34Å; M226-P246 WeakPolarHBondContact O-CB 3.41Å; S244-P246 CarbonylContact O-C 3.45Å
247	Y	91.1	Very high	90.9	Very high	13 Å²	13	26.9 Å²	26.9	5%	0.051	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	160	-174.9	68.8	-85.7	0	0	0	112.4	S225 M226 D228 E239 I240 T245 G249 A252	S225-Y247 CarbonylContact C-O 3.53Å; S225-Y247 WeakPolarHBondContact CA-O 3.34Å; M226-Y247 HydrophobicContact CB-CE1 4.04Å; M226-Y247 HydrophobicContact CB-CE2 4.34Å; M226-Y247 HydrophobicContact CE-CE2 3.83Å; M226-Y247 VanDerWaalsContact CE-OH 3.26Å; M226-Y247 WeakPolarHBondContact CE-OH 3.43Å; M226-Y247 PolarHBondContact N-O 2.97Å; M226-Y247 WeakPolarHBondContact O-CD1 3.4Å; M226-Y247 WeakPolarHBondContact O-CE1 3.42Å; M226-Y247 PolarHBondContact O-N 3.2Å; D228-Y247 PolarHBondContact O-OH 3.3Å; E239-Y247 HydrophobicContact CG-CD2 4.33Å; E239-Y247 HydrophobicContact CG-CG 4.37Å; I240-Y247 HydrophobicContact CD1-CD2 4.42Å; I240-Y247 HydrophobicContact CD1-CE1 4.44Å; I240-Y247 HydrophobicContact CD1-CE2 3.73Å; I240-Y247 HydrophobicContact CG1-CD1 4.2Å; I240-Y247 HydrophobicContact CG1-CD2 4Å; I240-Y247 HydrophobicContact CG1-CE1 3.95Å; I240-Y247 HydrophobicContact CG1-CE2 3.74Å; I240-Y247 HydrophobicContact CG1-CG 4.23Å; T245-Y247 HydrophobicContact CG2-CD1 4.48Å; Y247-G249 PolarHBondContact O-N 2.74Å; Y247-A252 HydrophobicContact CD2-CB 4.14Å; Y247-A252 HydrophobicContact CE2-CB 3.77Å
248	S	94.6	Very high	91.2	Very high	34 Å²	34	26.9 Å²	26.9	24%	0.238	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	111.1	174.1	164.2	0	0	0	0	110.9	D224 R250 M251 A252	D224-S248 WeakPolarHBondContact OD2-CA 3.42Å; D224-S248 WeakPolarHBondContact OD2-CB 3.39Å; D224-S248 PolarHBondContact OD2-OG 2.83Å; S248-R250 VanDerWaalsContact C-N 3.35Å; S248-R250 PolarHBondContact O-N 2.89Å; S248-M251 PolarHBondContact O-N 2.82Å; S248-M251 WeakPolarHBondContact OG-CB 3.13Å; S248-M251 VanDerWaalsContact OG-CG 3.32Å; S248-M251 WeakPolarHBondContact OG-CG 3.34Å; S248-M251 PolarHBondContact OG-N 2.86Å; S248-M251 VanDerWaalsContact OG-N 3.14Å; S248-A252 PolarHBondContact O-N 2.85Å; S248-A252 VanDerWaalsContact O-N 3.12Å
249	G	94.9	Very high	91.4	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-64.8	-35.3	177.4	0	0	0	0	0	113.4	V188 D224 Y247 A252 D253	V188-G249 VanDerWaalsContact CG1-C 3.5Å; V188-G249 WeakPolarHBondContact CG1-O 3.44Å; D224-G249 PolarHBondContact O-N 3.25Å; D224-G249 PolarHBondContact OD2-N 3.47Å; D224-G249 VanDerWaalsContact OD2-N 3.14Å; Y247-G249 PolarHBondContact O-N 2.74Å; G249-A252 PolarHBondContact O-N 2.91Å; G249-D253 PolarHBondContact O-N 3.49Å
250	R	96.8	Very high	91.7	Very high	49 Å²	49	26.2 Å²	26.2	19%	0.185	17%	0.17	C	C	.	.	H	α-helix	trans	-63.8	-42.6	173.8	-67.7	-177.1	174	121.6	-7.2	111.1	H183 V188 P221 D224 S248 A252 D253 M254	H183-R250 PolarHBondContact O-NE 3.45Å; H183-R250 PolarHBondContact O-NH2 3.03Å; V188-R250 HydrophobicContact CG2-CG 4.06Å; P221-R250 VanDerWaalsContact O-CZ 3.27Å; P221-R250 PolarHBondContact O-NH1 3.04Å; P221-R250 PolarHBondContact O-NH2 3.16Å; D224-R250 HydrophobicContact CB-CG 3.95Å; D224-R250 VanDerWaalsContact OD2-CB 3.26Å; D224-R250 WeakPolarHBondContact OD2-CB 3.48Å; D224-R250 WeakPolarHBondContact OD2-CG 3.42Å; D224-R250 PolarHBondContact OD2-N 3.29Å; S248-R250 VanDerWaalsContact C-N 3.35Å; S248-R250 PolarHBondContact O-N 2.89Å; R250-A252 VanDerWaalsContact C-N 3.32Å; R250-A252 PolarHBondContact O-N 2.81Å; R250-D253 WeakPolarHBondContact O-CB 3.25Å; R250-D253 PolarHBondContact O-N 2.84Å; R250-M254 VanDerWaalsContact O-CG 3.29Å; R250-M254 WeakPolarHBondContact O-CG 3.36Å; R250-M254 PolarHBondContact O-N 3.13Å
251	M	96.9	Very high	92	Very high	21 Å²	21	24.8 Å²	24.8	10%	0.103	16%	0.163	C	C	.	.	H	α-helix	trans	-71	-26.9	179.3	-66.2	-55.7	108	0	0	113.1	S248 M254 W255 P310 R313 T315	S248-M251 PolarHBondContact O-N 2.82Å; S248-M251 WeakPolarHBondContact OG-CB 3.13Å; S248-M251 VanDerWaalsContact OG-CG 3.32Å; S248-M251 WeakPolarHBondContact OG-CG 3.34Å; S248-M251 PolarHBondContact OG-N 2.86Å; S248-M251 VanDerWaalsContact OG-N 3.14Å; M251-M254 HydrophobicContact CE-CG 3.91Å; M251-M254 PolarHBondContact O-N 2.97Å; M251-M254 HydrophobicContact SD-CG 4.25Å; M251-W255 PolarHBondContact O-N 3.4Å; M251-P310 HydrophobicContact CB-CB 3.83Å; M251-P310 HydrophobicContact CG-CB 4.24Å; M251-P310 WeakPolarHBondContact CG-O 3.32Å; M251-R313 PolarHBondContact O-NH1 2.86Å; M251-R313 HydrophobicContact SD-CB 3.88Å; M251-T315 HydrophobicContact CE-CG2 4.1Å
252	A	95.9	Very high	92.5	Very high	8 Å²	8	23.3 Å²	23.3	7%	0.066	16%	0.155	C	C	.	.	H	α-helix	trans	-68.7	-38.7	168.9	0	0	0	0	0	112.3	I240 Y247 S248 G249 R250 M254 W255 S256	I240-A252 HydrophobicContact CD1-CB 4.25Å; Y247-A252 HydrophobicContact CD2-CB 4.14Å; Y247-A252 HydrophobicContact CE2-CB 3.77Å; S248-A252 PolarHBondContact O-N 2.85Å; S248-A252 VanDerWaalsContact O-N 3.12Å; G249-A252 PolarHBondContact O-N 2.91Å; R250-A252 VanDerWaalsContact C-N 3.32Å; R250-A252 PolarHBondContact O-N 2.81Å; A252-M254 VanDerWaalsContact C-N 3.34Å; A252-W255 PolarHBondContact O-N 2.96Å; A252-S256 PolarHBondContact O-N 2.9Å; A252-S256 PolarHBondContact O-OG 3Å
253	D	97.3	Very high	93.2	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-60	-42.1	168.8	-83.3	-17.6	0	0	0	111.3	H183 L189 G190 L192 G249 R250 W255 S256 L257	H183-D253 IonicContact CD2-OD2 2.63Å; H183-D253 IonicContact CE1-OD2 2.73Å; H183-D253 IonicContact NE2-OD2 3.97Å; H183-D253 PolarHBondContact NE2-OD2 3.41Å; L189-D253 PolarHBondContact N-OD2 3.16Å; G190-D253 PolarHBondContact N-OD1 3.32Å; L192-D253 HydrophobicContact CD1-CB 3.59Å; G249-D253 PolarHBondContact O-N 3.49Å; R250-D253 WeakPolarHBondContact O-CB 3.25Å; R250-D253 PolarHBondContact O-N 2.84Å; D253-W255 PolarHBondContact O-N 3.18Å; D253-S256 WeakPolarHBondContact O-CB 3.43Å; D253-S256 PolarHBondContact O-N 3.15Å; D253-L257 WeakPolarHBondContact O-CG 3.36Å; D253-L257 PolarHBondContact O-N 2.9Å
254	M	98.4	Very high	94.4	Very high	0 Å²	0	18 Å²	18	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-65.7	-37.9	178.5	-59.2	-42.1	-59.9	0	0	113.1	R250 M251 A252 L257 G258 L305 R313 L314 A316 L319	R250-M254 VanDerWaalsContact O-CG 3.29Å; R250-M254 WeakPolarHBondContact O-CG 3.36Å; R250-M254 PolarHBondContact O-N 3.13Å; M251-M254 HydrophobicContact CE-CG 3.91Å; M251-M254 PolarHBondContact O-N 2.97Å; M251-M254 HydrophobicContact SD-CG 4.25Å; A252-M254 VanDerWaalsContact C-N 3.34Å; M254-L257 HydrophobicContact CE-CD1 3.63Å; M254-L257 WeakPolarHBondContact O-CB 3.46Å; M254-L257 PolarHBondContact O-N 3.17Å; M254-L257 HydrophobicContact SD-CD1 3.94Å; M254-G258 PolarHBondContact O-N 3.38Å; M254-G258 VanDerWaalsContact O-N 3.12Å; M254-L305 HydrophobicContact CB-CD2 4.44Å; M254-L305 HydrophobicContact CE-CD2 3.91Å; M254-R313 HydrophobicContact CB-CB 4.48Å; M254-L314 WeakPolarHBondContact CE-O 3.48Å; M254-L314 VanDerWaalsContact CG-O 3.29Å; M254-L314 WeakPolarHBondContact CG-O 3.33Å; M254-A316 HydrophobicContact CE-CB 4.12Å; M254-A316 HydrophobicContact SD-CB 3.82Å; M254-A316 PolarHBondContact SD-N 3.5Å; M254-L319 HydrophobicContact CE-CB 4.16Å; M254-L319 HydrophobicContact CE-CD2 3.48Å; M254-L319 VanDerWaalsContact CE-CD2 3.48Å; M254-L319 HydrophobicContact CE-CG 4.44Å
255	W	97.8	Very high	95.8	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-61.5	-46	170.8	171.7	-88	0	0	0	111.5	Y235 V236 P238 M251 A252 D253 L257 G258 V259 F271 I283 L306	Y235-W255 VanDerWaalsContact O-CD1 3.23Å; V236-W255 PolarHBondContact O-NE1 2.9Å; P238-W255 HydrophobicContact CG-CE3 4.17Å; P238-W255 HydrophobicContact CG-CH2 3.56Å; P238-W255 HydrophobicContact CG-CZ2 3.99Å; P238-W255 HydrophobicContact CG-CZ3 3.66Å; M251-W255 PolarHBondContact O-N 3.4Å; A252-W255 PolarHBondContact O-N 2.96Å; D253-W255 PolarHBondContact O-N 3.18Å; W255-L257 VanDerWaalsContact C-N 3.28Å; W255-L257 PolarHBondContact O-N 3.3Å; W255-G258 WeakPolarHBondContact O-CA 3.47Å; W255-G258 PolarHBondContact O-N 3.28Å; W255-V259 PolarHBondContact O-N 3.11Å; W255-F271 AromaticContact CH2-CE2 3.49Å; W255-F271 HydrophobicContact CH2-CE2 3.49Å; W255-F271 VanDerWaalsContact CH2-CE2 3.49Å; W255-F271 AromaticContact CH2-CZ 3.64Å; W255-F271 HydrophobicContact CH2-CZ 3.64Å; W255-F271 AromaticContact CZ2-CD2 3.92Å; W255-F271 HydrophobicContact CZ2-CD2 3.92Å; W255-F271 AromaticContact CZ2-CE2 3.25Å; W255-F271 HydrophobicContact CZ2-CE2 3.25Å; W255-F271 AromaticContact CZ2-CZ 3.89Å; W255-F271 HydrophobicContact CZ2-CZ 3.89Å; W255-I283 HydrophobicContact CZ2-CG2 3.89Å; W255-L306 HydrophobicContact CD2-CD2 3.91Å; W255-L306 HydrophobicContact CE3-CB 4.42Å; W255-L306 HydrophobicContact CE3-CD2 3.93Å; W255-L306 HydrophobicContact CG-CD2 4.49Å; W255-L306 HydrophobicContact CH2-CD2 4.37Å; W255-L306 HydrophobicContact CZ2-CD2 4.35Å; W255-L306 HydrophobicContact CZ3-CB 4.14Å; W255-L306 HydrophobicContact CZ3-CD2 4.16Å; W255-L306 WeakPolarHBondContact CZ3-O 3.03Å
256	S	97.7	Very high	96.7	Very high	8 Å²	8	12.7 Å²	12.7	6%	0.056	7%	0.073	C	C	.	.	H	α-helix	trans	-60.4	-37.3	177.9	-57.7	0	0	0	0	112	Y235 A252 D253 V259 M260	Y235-S256 PolarHBondContact O-OG 3.28Å; A252-S256 PolarHBondContact O-N 2.9Å; A252-S256 PolarHBondContact O-OG 3Å; D253-S256 WeakPolarHBondContact O-CB 3.43Å; D253-S256 PolarHBondContact O-N 3.15Å; S256-V259 WeakPolarHBondContact O-CB 3.23Å; S256-V259 PolarHBondContact O-N 2.88Å; S256-M260 WeakPolarHBondContact O-CG 3.26Å; S256-M260 PolarHBondContact O-N 2.84Å
257	L	98.6	Very high	97.1	Very high	0 Å²	0	10 Å²	10	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-62	-39.3	170.4	-76.4	175.7	0	0	0	112.8	F172 V175 V176 V179 L192 D253 M254 W255 M260 L261 L319	F172-L257 HydrophobicContact CE2-CB 4.36Å; F172-L257 HydrophobicContact CE2-CD2 3.92Å; F172-L257 WeakPolarHBondContact CE2-O 3.44Å; F172-L257 HydrophobicContact CZ-CB 4.02Å; F172-L257 HydrophobicContact CZ-CD2 4.19Å; F172-L257 WeakPolarHBondContact CZ-O 3.3Å; V175-L257 HydrophobicContact CG1-CD2 3.47Å; V175-L257 VanDerWaalsContact CG1-CD2 3.47Å; V176-L257 HydrophobicContact CG2-CD1 4.41Å; V176-L257 HydrophobicContact CG2-CD2 4.49Å; V179-L257 HydrophobicContact CB-CD1 4.18Å; V179-L257 HydrophobicContact CG1-CD1 4.06Å; V179-L257 HydrophobicContact CG2-CD1 4.15Å; V179-L257 HydrophobicContact CG2-CD2 4.06Å; V179-L257 HydrophobicContact CG2-CG 4.43Å; L192-L257 HydrophobicContact CD1-CD2 4.39Å; L192-L257 HydrophobicContact CD1-CG 4.08Å; D253-L257 WeakPolarHBondContact O-CG 3.36Å; D253-L257 PolarHBondContact O-N 2.9Å; M254-L257 HydrophobicContact CE-CD1 3.63Å; M254-L257 WeakPolarHBondContact O-CB 3.46Å; M254-L257 PolarHBondContact O-N 3.17Å; M254-L257 HydrophobicContact SD-CD1 3.94Å; W255-L257 VanDerWaalsContact C-N 3.28Å; W255-L257 PolarHBondContact O-N 3.3Å; L257-M260 HydrophobicContact CD2-SD 4.13Å; L257-M260 PolarHBondContact O-N 2.82Å; L257-L261 PolarHBondContact O-N 3.49Å; L257-L319 HydrophobicContact CD1-CD2 4.03Å
258	G	98.4	Very high	97.3	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-60.6	-42.5	171.5	0	0	0	0	0	112.7	M254 W255 L261 Y262	M254-G258 PolarHBondContact O-N 3.38Å; M254-G258 VanDerWaalsContact O-N 3.12Å; W255-G258 WeakPolarHBondContact O-CA 3.47Å; W255-G258 PolarHBondContact O-N 3.28Å; G258-L261 PolarHBondContact O-N 3.11Å; G258-Y262 WeakPolarHBondContact O-CB 3.42Å; G258-Y262 PolarHBondContact O-N 2.79Å
259	V	98.3	Very high	97.3	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-63.5	-43.4	174.8	175.6	0	0	0	0	111.4	A234 Y235 W255 S256 T263 Y269 P270 L306	A234-V259 WeakPolarHBondContact O-CG1 3.48Å; Y235-V259 HydrophobicContact CD1-CB 3.83Å; Y235-V259 HydrophobicContact CD1-CG1 3.47Å; Y235-V259 VanDerWaalsContact CD1-CG1 3.47Å; Y235-V259 HydrophobicContact CD2-CG1 4.48Å; Y235-V259 HydrophobicContact CE1-CB 4.21Å; Y235-V259 HydrophobicContact CE1-CG1 3.64Å; Y235-V259 HydrophobicContact CG-CG1 3.94Å; W255-V259 PolarHBondContact O-N 3.11Å; S256-V259 WeakPolarHBondContact O-CB 3.23Å; S256-V259 PolarHBondContact O-N 2.88Å; V259-T263 WeakPolarHBondContact O-CB 3.32Å; V259-T263 PolarHBondContact O-N 2.81Å; V259-T263 PolarHBondContact O-OG1 2.57Å; V259-Y269 HydrophobicContact CG1-CD1 4.02Å; V259-P270 HydrophobicContact CB-CG 4.32Å; V259-P270 HydrophobicContact CG1-CG 4.2Å; V259-P270 HydrophobicContact CG2-CG 3.98Å; V259-L306 HydrophobicContact CG2-CD2 4.04Å
260	M	98.4	Very high	97.4	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-59.3	-50.8	175	-71	176.6	64.4	0	0	111.5	F172 V175 L192 L194 F197 Y235 S256 L257 Y262 T263 M264	F172-M260 HydrophobicContact CE2-CB 4.29Å; V175-M260 HydrophobicContact CG1-CE 3.55Å; V175-M260 HydrophobicContact CG1-SD 4.28Å; V175-M260 HydrophobicContact CG2-CE 4.16Å; L192-M260 HydrophobicContact CB-SD 4.44Å; L194-M260 HydrophobicContact CD2-CB 4.18Å; L194-M260 HydrophobicContact CD2-CE 3.84Å; L194-M260 HydrophobicContact CD2-CG 4.35Å; L194-M260 HydrophobicContact CG-CB 4.3Å; L194-M260 HydrophobicContact CG-CE 4.37Å; L194-M260 HydrophobicContact CG-CG 4.16Å; F197-M260 HydrophobicContact CD2-CE 3.43Å; F197-M260 VanDerWaalsContact CD2-CE 3.43Å; F197-M260 HydrophobicContact CD2-SD 4.39Å; F197-M260 HydrophobicContact CE2-CE 3.58Å; F197-M260 HydrophobicContact CE2-SD 4.05Å; F197-M260 HydrophobicContact CG-CE 4.26Å; Y235-M260 HydrophobicContact CD1-CG 4.45Å; Y235-M260 HydrophobicContact CE1-CG 3.73Å; S256-M260 WeakPolarHBondContact O-CG 3.26Å; S256-M260 PolarHBondContact O-N 2.84Å; L257-M260 HydrophobicContact CD2-SD 4.13Å; L257-M260 PolarHBondContact O-N 2.82Å; M260-Y262 PolarHBondContact O-N 3.48Å; M260-T263 PolarHBondContact O-N 2.81Å; M260-M264 VanDerWaalsContact O-CG 3.31Å; M260-M264 WeakPolarHBondContact O-CG 3.4Å; M260-M264 PolarHBondContact O-N 2.79Å
261	L	98.6	Very high	97.3	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-62.3	-44	-179.1	179.7	60.4	0	0	0	112.2	F172 L257 G258 T263 M264 L265 L301 L302 W324	F172-L261 HydrophobicContact CB-CD1 4.42Å; F172-L261 HydrophobicContact CD1-CB 4.44Å; F172-L261 HydrophobicContact CD1-CD1 3.91Å; F172-L261 HydrophobicContact CD1-CD2 4.27Å; F172-L261 HydrophobicContact CD1-CG 4.43Å; F172-L261 HydrophobicContact CD2-CB 4.28Å; F172-L261 HydrophobicContact CD2-CD1 4.47Å; F172-L261 HydrophobicContact CE1-CB 4.05Å; F172-L261 HydrophobicContact CE1-CD1 4.27Å; F172-L261 HydrophobicContact CE1-CD2 3.9Å; F172-L261 HydrophobicContact CE1-CG 4.29Å; F172-L261 HydrophobicContact CE2-CB 3.87Å; F172-L261 HydrophobicContact CG-CD1 4.02Å; F172-L261 HydrophobicContact CZ-CB 3.75Å; F172-L261 HydrophobicContact CZ-CD2 4.37Å; F172-L261 HydrophobicContact CZ-CG 4.48Å; L257-L261 PolarHBondContact O-N 3.49Å; G258-L261 PolarHBondContact O-N 3.11Å; L261-T263 VanDerWaalsContact C-N 3.31Å; L261-T263 PolarHBondContact O-N 3.27Å; L261-M264 PolarHBondContact O-N 2.91Å; L261-L265 HydrophobicContact CD1-CD1 3.75Å; L261-L265 HydrophobicContact CD1-CG 4.07Å; L261-L265 HydrophobicContact CG-CD1 3.98Å; L261-L265 WeakPolarHBondContact O-CG 3.43Å; L261-L265 PolarHBondContact O-N 3.37Å; L261-L301 HydrophobicContact CD2-CB 4.47Å; L261-L301 HydrophobicContact CD2-CD2 3.61Å; L261-L301 HydrophobicContact CD2-CG 3.93Å; L261-L302 HydrophobicContact CB-CD2 3.94Å; L261-L302 HydrophobicContact CD2-CD2 3.84Å; L261-L302 HydrophobicContact CD2-CG 4.17Å; L261-L302 HydrophobicContact CG-CD2 3.8Å; L261-L302 HydrophobicContact CG-CG 4.42Å; L261-W324 HydrophobicContact CD1-CH2 3.53Å; L261-W324 HydrophobicContact CD1-CZ2 4.1Å; L261-W324 HydrophobicContact CD1-CZ3 4.04Å
262	Y	98.5	Very high	97	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-59.6	-46.1	175.8	-172.1	-76.7	0	0	0	110.3	G258 M260 M264 L265 V266 R268 P270 C288 C289 L290 L302	G258-Y262 WeakPolarHBondContact O-CB 3.42Å; G258-Y262 PolarHBondContact O-N 2.79Å; M260-Y262 PolarHBondContact O-N 3.48Å; Y262-M264 VanDerWaalsContact C-N 3.34Å; Y262-M264 PolarHBondContact O-N 3.14Å; Y262-L265 PolarHBondContact O-N 3.1Å; Y262-V266 HydrophobicContact CD1-CB 3.89Å; Y262-V266 HydrophobicContact CD1-CG1 4.47Å; Y262-V266 HydrophobicContact CD1-CG2 3.92Å; Y262-V266 HydrophobicContact CD2-CG2 4.26Å; Y262-V266 HydrophobicContact CE1-CB 3.63Å; Y262-V266 HydrophobicContact CE1-CG1 3.71Å; Y262-V266 HydrophobicContact CE1-CG2 3.77Å; Y262-V266 HydrophobicContact CE2-CG2 4.14Å; Y262-V266 HydrophobicContact CG-CG2 4.16Å; Y262-V266 VanDerWaalsContact O-CB 3.26Å; Y262-V266 WeakPolarHBondContact O-CB 3.36Å; Y262-V266 WeakPolarHBondContact O-CG2 3.42Å; Y262-V266 PolarHBondContact O-N 3.34Å; Y262-R268 VanDerWaalsContact CD1-O 3.24Å; Y262-R268 WeakPolarHBondContact CD1-O 3.47Å; Y262-R268 WeakPolarHBondContact CE1-O 3.32Å; Y262-R268 VanDerWaalsContact OH-CZ 3.3Å; Y262-R268 PolarHBondContact OH-NH1 2.95Å; Y262-R268 PolarHBondContact OH-NH2 2.98Å; Y262-P270 HydrophobicContact CD1-CB 3.79Å; Y262-P270 HydrophobicContact CD1-CG 4.25Å; Y262-P270 HydrophobicContact CD2-CB 3.86Å; Y262-P270 VanDerWaalsContact CE1-CA 3.47Å; Y262-P270 HydrophobicContact CE1-CB 4.05Å; Y262-P270 HydrophobicContact CE2-CB 4.09Å; Y262-P270 HydrophobicContact CG-CB 3.69Å; Y262-P270 HydrophobicContact CG-CG 4.18Å; Y262-C288 WeakPolarHBondContact CE2-SG 3.45Å; Y262-C289 WeakPolarHBondContact CE2-O 3.46Å; Y262-C289 PolarHBondContact OH-O 3.41Å; Y262-L290 HydrophobicContact CD2-CD2 4.09Å; Y262-L290 HydrophobicContact CE2-CD2 3.97Å; Y262-L302 HydrophobicContact CD2-CD1 4.19Å
263	T	98	Very high	96.8	Very high	8 Å²	8	21.3 Å²	21.3	5%	0.049	11%	0.107	C	C	.	.	H	α-helix	trans	-65	-37.8	-178.7	-52.5	0	0	0	0	111.7	V157 L194 V259 M260 L261 G267 Y269	V157-T263 WeakPolarHBondContact CG1-O 3.44Å; L194-T263 HydrophobicContact CD1-CG2 3.79Å; V259-T263 WeakPolarHBondContact O-CB 3.32Å; V259-T263 PolarHBondContact O-N 2.81Å; V259-T263 PolarHBondContact O-OG1 2.57Å; M260-T263 PolarHBondContact O-N 2.81Å; L261-T263 VanDerWaalsContact C-N 3.31Å; L261-T263 PolarHBondContact O-N 3.27Å; T263-G267 VanDerWaalsContact O-CA 3.32Å; T263-G267 WeakPolarHBondContact O-CA 3.39Å; T263-G267 PolarHBondContact O-N 3.5Å; T263-Y269 HydrophobicContact CG2-CD1 4.2Å; T263-Y269 HydrophobicContact CG2-CE1 4.06Å; T263-Y269 VanDerWaalsContact OG1-CD1 3.29Å; T263-Y269 WeakPolarHBondContact OG1-CD1 3.28Å
264	M	98.4	Very high	96.5	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-62.4	-46.2	173.4	-71.6	167.9	66.2	0	0	112.7	M153 V157 L163 A168 L171 F172 L194 M260 L261 Y262	M153-M264 HydrophobicContact CE-CE 3.46Å; M153-M264 VanDerWaalsContact CE-CE 3.46Å; M153-M264 HydrophobicContact CE-CG 4.47Å; M153-M264 HydrophobicContact CE-SD 3.59Å; M153-M264 VanDerWaalsContact CE-SD 3.59Å; V157-M264 HydrophobicContact CG2-CB 4.42Å; V157-M264 HydrophobicContact CG2-CG 3.93Å; L163-M264 HydrophobicContact CD1-CB 4.26Å; L163-M264 HydrophobicContact CD1-CE 3.82Å; L163-M264 HydrophobicContact CD1-CG 4.28Å; L163-M264 PolarHBondContact N-O 2.63Å; A168-M264 HydrophobicContact CB-CE 4.12Å; L171-M264 HydrophobicContact CB-CE 4.11Å; F172-M264 HydrophobicContact CB-CE 3.98Å; F172-M264 HydrophobicContact CB-SD 4.35Å; F172-M264 HydrophobicContact CD2-SD 4.06Å; L194-M264 HydrophobicContact CD1-CG 4.36Å; L194-M264 HydrophobicContact CD2-CG 3.71Å; L194-M264 HydrophobicContact CD2-SD 3.84Å; M260-M264 VanDerWaalsContact O-CG 3.31Å; M260-M264 WeakPolarHBondContact O-CG 3.4Å; M260-M264 PolarHBondContact O-N 2.79Å; L261-M264 PolarHBondContact O-N 2.91Å; Y262-M264 VanDerWaalsContact C-N 3.34Å; Y262-M264 PolarHBondContact O-N 3.14Å
265	L	98.1	Very high	96.3	Very high	9 Å²	9	30.3 Å²	30.3	5%	0.047	16%	0.162	C	C	.	.	H	α-helix	trans	-81.3	-31.6	-174.9	-67.7	174	0	0	0	113.8	R162 E165 A168 L261 Y262 L294 A298 L302 W324	R162-L265 WeakPolarHBondContact CD-O 3.46Å; E165-L265 HydrophobicContact CB-CD2 4.32Å; E165-L265 HydrophobicContact CG-CD2 3.98Å; A168-L265 HydrophobicContact CB-CD2 3.54Å; A168-L265 HydrophobicContact CB-CG 4.35Å; L261-L265 HydrophobicContact CD1-CD1 3.75Å; L261-L265 HydrophobicContact CD1-CG 4.07Å; L261-L265 HydrophobicContact CG-CD1 3.98Å; L261-L265 WeakPolarHBondContact O-CG 3.43Å; L261-L265 PolarHBondContact O-N 3.37Å; Y262-L265 PolarHBondContact O-N 3.1Å; L265-L294 HydrophobicContact CB-CD2 3.91Å; L265-L294 HydrophobicContact CD1-CD2 4.39Å; L265-A298 HydrophobicContact CD1-CB 4.19Å; L265-L302 HydrophobicContact CD1-CD1 4.44Å; L265-W324 HydrophobicContact CD1-CZ2 4.42Å; L265-W324 HydrophobicContact CD2-CZ2 4.47Å
266	V	97.2	Very high	95.9	Very high	27 Å²	27	34 Å²	34	16%	0.164	19%	0.186	C	C	.	.	H	α-helix	trans	-107	-22.3	-171.2	-173.4	0	0	0	0	112.5	Y262 R268 P291 L294	Y262-V266 HydrophobicContact CD1-CB 3.89Å; Y262-V266 HydrophobicContact CD1-CG1 4.47Å; Y262-V266 HydrophobicContact CD1-CG2 3.92Å; Y262-V266 HydrophobicContact CD2-CG2 4.26Å; Y262-V266 HydrophobicContact CE1-CB 3.63Å; Y262-V266 HydrophobicContact CE1-CG1 3.71Å; Y262-V266 HydrophobicContact CE1-CG2 3.77Å; Y262-V266 HydrophobicContact CE2-CG2 4.14Å; Y262-V266 HydrophobicContact CG-CG2 4.16Å; Y262-V266 VanDerWaalsContact O-CB 3.26Å; Y262-V266 WeakPolarHBondContact O-CB 3.36Å; Y262-V266 WeakPolarHBondContact O-CG2 3.42Å; Y262-V266 PolarHBondContact O-N 3.34Å; V266-R268 VanDerWaalsContact C-N 3.35Å; V266-R268 HydrophobicContact CG1-CG 3.99Å; V266-P291 HydrophobicContact CG1-CG 3.76Å; V266-P291 HydrophobicContact CG2-CG 3.88Å; V266-L294 HydrophobicContact CG2-CD1 4.17Å
267	G	95.8	Very high	95.6	Very high	34 Å²	34	36.3 Å²	36.3	35%	0.351	21%	0.206	S	C	.	.	S	Bend	trans	82.6	7.7	178	0	0	0	0	0	115.8	R161 T263	R161-G267 WeakPolarHBondContact O-CA 3.32Å; T263-G267 VanDerWaalsContact O-CA 3.32Å; T263-G267 WeakPolarHBondContact O-CA 3.39Å; T263-G267 PolarHBondContact O-N 3.5Å
268	R	94.6	Very high	95.4	Very high	125 Å²	125	39.1 Å²	39.1	47%	0.472	22%	0.223	S	C	.	.	S	Bend	trans	-150.3	162.4	175.1	55.5	165.3	-176.6	71.6	6.2	109.2	Y262 V266	Y262-R268 VanDerWaalsContact CD1-O 3.24Å; Y262-R268 WeakPolarHBondContact CD1-O 3.47Å; Y262-R268 WeakPolarHBondContact CE1-O 3.32Å; Y262-R268 VanDerWaalsContact OH-CZ 3.3Å; Y262-R268 PolarHBondContact OH-NH1 2.95Å; Y262-R268 PolarHBondContact OH-NH2 2.98Å; V266-R268 VanDerWaalsContact C-N 3.35Å; V266-R268 HydrophobicContact CG1-CG 3.99Å
269	Y	95.4	Very high	95.1	Very high	52 Å²	52	39.9 Å²	39.9	20%	0.204	23%	0.227	C	C	.	.			trans	-63.4	151.1	175.9	-64.1	-62.7	0	0	0	112.5	A234 Y235 V259 T263 F271	A234-Y269 HydrophobicContact CB-CD1 3.88Å; A234-Y269 HydrophobicContact CB-CD2 3.94Å; A234-Y269 HydrophobicContact CB-CE1 4.07Å; A234-Y269 HydrophobicContact CB-CE2 4.11Å; A234-Y269 HydrophobicContact CB-CG 3.83Å; Y235-Y269 HydrophobicContact CD2-CE1 4.46Å; Y235-Y269 HydrophobicContact CE2-CD1 4.5Å; Y235-Y269 AromaticContact CE2-CE1 3.58Å; Y235-Y269 HydrophobicContact CE2-CE1 3.58Å; Y235-Y269 AromaticContact CZ-CE1 3.7Å; V259-Y269 HydrophobicContact CG1-CD1 4.02Å; T263-Y269 HydrophobicContact CG2-CD1 4.2Å; T263-Y269 HydrophobicContact CG2-CE1 4.06Å; T263-Y269 VanDerWaalsContact OG1-CD1 3.29Å; T263-Y269 WeakPolarHBondContact OG1-CD1 3.28Å; Y269-F271 VanDerWaalsContact C-N 3.31Å; Y269-F271 VanDerWaalsContact CB-O 3.31Å; Y269-F271 WeakPolarHBondContact CB-O 3.46Å
270	P	95.9	Very high	94.9	Very high	14 Å²	14	42.5 Å²	42.5	9%	0.091	24%	0.238	C	C	.	.	S	Bend	trans	-66.6	-34.2	173.5	24.6	-31.1	0	0	0	112.2	V259 Y262 C288 L306	V259-P270 HydrophobicContact CB-CG 4.32Å; V259-P270 HydrophobicContact CG1-CG 4.2Å; V259-P270 HydrophobicContact CG2-CG 3.98Å; Y262-P270 HydrophobicContact CD1-CB 3.79Å; Y262-P270 HydrophobicContact CD1-CG 4.25Å; Y262-P270 HydrophobicContact CD2-CB 3.86Å; Y262-P270 VanDerWaalsContact CE1-CA 3.47Å; Y262-P270 HydrophobicContact CE1-CB 4.05Å; Y262-P270 HydrophobicContact CE2-CB 4.09Å; Y262-P270 HydrophobicContact CG-CB 3.69Å; Y262-P270 HydrophobicContact CG-CG 4.18Å; P270-C288 WeakPolarHBondContact CB-SG 3.15Å; P270-L306 HydrophobicContact CB-CD1 4.17Å; P270-L306 HydrophobicContact CG-CD1 4.36Å
271	F	94.6	Very high	94.6	Very high	6 Å²	6	44.5 Å²	44.5	3%	0.026	25%	0.253	C	S	.	.	S	Bend	trans	-119.2	126.1	174.4	-49.2	-76.5	0	0	0	108.1	W255 Y269 L279 K282 I283 C288	W255-F271 AromaticContact CH2-CE2 3.49Å; W255-F271 HydrophobicContact CH2-CE2 3.49Å; W255-F271 VanDerWaalsContact CH2-CE2 3.49Å; W255-F271 AromaticContact CH2-CZ 3.64Å; W255-F271 HydrophobicContact CH2-CZ 3.64Å; W255-F271 AromaticContact CZ2-CD2 3.92Å; W255-F271 HydrophobicContact CZ2-CD2 3.92Å; W255-F271 AromaticContact CZ2-CE2 3.25Å; W255-F271 HydrophobicContact CZ2-CE2 3.25Å; W255-F271 AromaticContact CZ2-CZ 3.89Å; W255-F271 HydrophobicContact CZ2-CZ 3.89Å; Y269-F271 VanDerWaalsContact C-N 3.31Å; Y269-F271 VanDerWaalsContact CB-O 3.31Å; Y269-F271 WeakPolarHBondContact CB-O 3.46Å; F271-L279 HydrophobicContact CB-CD1 3.88Å; F271-K282 HydrophobicContact CD1-CB 4.29Å; F271-I283 HydrophobicContact CB-CD1 4.41Å; F271-I283 HydrophobicContact CB-CG1 3.69Å; F271-I283 HydrophobicContact CD1-CG1 4.36Å; F271-I283 HydrophobicContact CD2-CG1 3.97Å; F271-I283 HydrophobicContact CG-CG1 3.73Å; F271-C288 HydrophobicContact CE1-CB 4.36Å; F271-C288 HydrophobicContact CZ-CB 4Å
272	H	91.3	Very high	94.3	Very high	125 Å²	125	48.4 Å²	48.4	58%	0.579	27%	0.269	S	S	*	.			trans	-149.3	135.6	179.6	-180	-85	0	0	0	109.7	K282	H272-K282 PolarHBondContact O-NZ 3.35Å
273	D	91.7	Very high	94.1	Very high	39 Å²	39	48.4 Å²	48.4	21%	0.209	27%	0.269	C	S	.	.			trans	-158.8	144.6	166.6	-152.2	-79.1	0	0	0	108.8	D275 T278 L279 K282	D273-D275 VanDerWaalsContact C-N 3.28Å; D273-D275 PolarHBondContact OD1-N 3.08Å; D273-T278 HydrophobicContact CB-CG2 4.24Å; D273-T278 VanDerWaalsContact OD2-CG2 3.23Å; D273-T278 WeakPolarHBondContact OD2-CG2 3.41Å; D273-L279 HydrophobicContact CB-CB 3.99Å; D273-K282 HydrophobicContact CB-CD 4.42Å; D273-K282 IonicContact OD2-NZ 3.06Å; D273-K282 PolarHBondContact OD2-NZ 2.82Å
274	P	90.6	Very high	93.8	Very high	124 Å²	124	52.4 Å²	52.4	81%	0.805	28%	0.284	S	S	*	.	S	Bend	trans	-65.6	-26.9	167.4	27.3	-36.5	0	0	0	113.6	P276	P274-P276 WeakPolarHBondContact O-CD 3.08Å
275	D	93.4	Very high	93.5	Very high	65 Å²	65	60.2 Å²	60.2	35%	0.348	31%	0.313	S	S	.	.	S	Bend	trans	-87.2	119.7	172.8	164.5	38.1	0	0	0	111.1	D273 A277 T278 L279	D273-D275 VanDerWaalsContact C-N 3.28Å; D273-D275 PolarHBondContact OD1-N 3.08Å; D275-A277 VanDerWaalsContact C-N 3.28Å; D275-A277 PolarHBondContact O-N 3.17Å; D275-A277 WeakPolarHBondContact OD1-CB 3.25Å; D275-A277 PolarHBondContact OD1-N 3.32Å; D275-T278 PolarHBondContact O-N 3.05Å; D275-T278 WeakPolarHBondContact OD2-CB 3.41Å; D275-T278 PolarHBondContact OD2-N 2.79Å; D275-T278 PolarHBondContact OD2-OG1 2.87Å; D275-L279 WeakPolarHBondContact O-CB 3.14Å; D275-L279 PolarHBondContact O-N 2.85Å
276	P	90.9	Very high	92.8	Very high	77 Å²	77	60.5 Å²	60.5	50%	0.5	32%	0.318	S	S	.	.	H	α-helix	trans	-56.9	-35.8	175.2	-25.3	35.4	0	0	0	113.9	P274 L279 F280	P274-P276 WeakPolarHBondContact O-CD 3.08Å; P276-L279 PolarHBondContact O-N 2.87Å; P276-F280 HydrophobicContact CB-CE2 4.03Å; P276-F280 HydrophobicContact CB-CZ 4.39Å; P276-F280 WeakPolarHBondContact O-CB 3.5Å; P276-F280 WeakPolarHBondContact O-CD2 3.46Å; P276-F280 WeakPolarHBondContact O-CG 3.28Å; P276-F280 PolarHBondContact O-N 3.36Å
277	A	91.5	Very high	92.2	Very high	58 Å²	58	66 Å²	66	48%	0.479	34%	0.342	S	S	.	.	H	α-helix	trans	-67.5	-42.4	-178.4	0	0	0	0	0	111.5	D275 F280 S281	D275-A277 VanDerWaalsContact C-N 3.28Å; D275-A277 PolarHBondContact O-N 3.17Å; D275-A277 WeakPolarHBondContact OD1-CB 3.25Å; D275-A277 PolarHBondContact OD1-N 3.32Å; A277-F280 PolarHBondContact O-N 3.12Å; A277-S281 WeakPolarHBondContact O-CB 3.3Å; A277-S281 PolarHBondContact O-N 3.31Å
278	T	93.1	Very high	91.7	Very high	58 Å²	58	65.9 Å²	65.9	36%	0.356	34%	0.335	S	S	.	.	H	α-helix	trans	-69.4	-38.3	174.3	-61.6	0	0	0	0	111.9	D273 D275 S281 K282	D273-T278 HydrophobicContact CB-CG2 4.24Å; D273-T278 VanDerWaalsContact OD2-CG2 3.23Å; D273-T278 WeakPolarHBondContact OD2-CG2 3.41Å; D275-T278 PolarHBondContact O-N 3.05Å; D275-T278 WeakPolarHBondContact OD2-CB 3.41Å; D275-T278 PolarHBondContact OD2-N 2.79Å; D275-T278 PolarHBondContact OD2-OG1 2.87Å; T278-S281 WeakPolarHBondContact O-CB 3.44Å; T278-S281 PolarHBondContact O-N 2.77Å; T278-K282 HydrophobicContact CG2-CD 4.36Å; T278-K282 WeakPolarHBondContact O-CG 3.44Å; T278-K282 PolarHBondContact O-N 2.88Å
279	L	93.1	Very high	91.5	Very high	16 Å²	16	64.5 Å²	64.5	8%	0.084	34%	0.344	C	S	.	.	H	α-helix	trans	-58.1	-50.4	170.7	176	59.5	0	0	0	111.3	P233 F271 D273 D275 P276 S281 K282 I283	P233-L279 HydrophobicContact CB-CD2 4.11Å; F271-L279 HydrophobicContact CB-CD1 3.88Å; D273-L279 HydrophobicContact CB-CB 3.99Å; D275-L279 WeakPolarHBondContact O-CB 3.14Å; D275-L279 PolarHBondContact O-N 2.85Å; P276-L279 PolarHBondContact O-N 2.87Å; L279-S281 VanDerWaalsContact C-N 3.3Å; L279-S281 PolarHBondContact O-N 3.22Å; L279-K282 WeakPolarHBondContact O-CB 3.41Å; L279-K282 PolarHBondContact O-N 3.04Å; L279-I283 HydrophobicContact CD1-CD1 4.02Å; L279-I283 HydrophobicContact CD1-CG1 4.39Å; L279-I283 HydrophobicContact CG-CD1 4.03Å; L279-I283 WeakPolarHBondContact O-CG1 3.1Å; L279-I283 PolarHBondContact O-N 3.46Å
280	F	92.9	Very high	91.3	Very high	55 Å²	55	64.2 Å²	64.2	24%	0.241	35%	0.346	C	S	.	.	H	α-helix	trans	-66.2	-31.6	178.3	-60.3	-31.1	0	0	0	112.5	P233 L241 P276 A277 I283 R284	P233-F280 HydrophobicContact CB-CE1 4.14Å; P233-F280 HydrophobicContact CB-CZ 4.48Å; L241-F280 HydrophobicContact CD1-CB 3.94Å; L241-F280 HydrophobicContact CD1-CD1 3.63Å; L241-F280 HydrophobicContact CD1-CG 4.07Å; L241-F280 HydrophobicContact CD2-CB 4.37Å; L241-F280 HydrophobicContact CD2-CD1 3.61Å; L241-F280 HydrophobicContact CD2-CD2 4.44Å; L241-F280 HydrophobicContact CD2-CE1 3.94Å; L241-F280 HydrophobicContact CD2-CG 3.89Å; L241-F280 HydrophobicContact CD2-CZ 4.49Å; L241-F280 HydrophobicContact CG-CD1 4.29Å; P276-F280 HydrophobicContact CB-CE2 4.03Å; P276-F280 HydrophobicContact CB-CZ 4.39Å; P276-F280 WeakPolarHBondContact O-CB 3.5Å; P276-F280 WeakPolarHBondContact O-CD2 3.46Å; P276-F280 WeakPolarHBondContact O-CG 3.28Å; P276-F280 PolarHBondContact O-N 3.36Å; A277-F280 PolarHBondContact O-N 3.12Å; F280-I283 HydrophobicContact CD1-CD1 4.42Å; F280-R284 WeakPolarHBondContact O-CB 3.42Å; F280-R284 WeakPolarHBondContact O-CG 3.36Å; F280-R284 PolarHBondContact O-N 2.89Å; F280-R284 PolarHBondContact O-NE 3.3Å
281	S	93.1	Very high	91.1	Very high	43 Å²	43	65.7 Å²	65.7	30%	0.301	36%	0.355	S	S	.	.	H	α-helix	trans	-63.7	-44.3	170.9	-167.4	0	0	0	0	112	A277 T278 L279 R285	A277-S281 WeakPolarHBondContact O-CB 3.3Å; A277-S281 PolarHBondContact O-N 3.31Å; T278-S281 WeakPolarHBondContact O-CB 3.44Å; T278-S281 PolarHBondContact O-N 2.77Å; L279-S281 VanDerWaalsContact C-N 3.3Å; L279-S281 PolarHBondContact O-N 3.22Å; S281-R285 WeakPolarHBondContact O-CG 3.48Å; S281-R285 PolarHBondContact O-N 2.94Å
282	K	93.1	Very high	90.9	Very high	81 Å²	81	74 Å²	74	35%	0.352	39%	0.394	S	S	.	.	H	α-helix	trans	-61.4	-45.8	174.3	-73.8	164.1	167.9	173.2	0	111.9	F271 H272 D273 T278 L279 R285 G286	F271-K282 HydrophobicContact CD1-CB 4.29Å; H272-K282 PolarHBondContact O-NZ 3.35Å; D273-K282 HydrophobicContact CB-CD 4.42Å; D273-K282 IonicContact OD2-NZ 3.06Å; D273-K282 PolarHBondContact OD2-NZ 2.82Å; T278-K282 HydrophobicContact CG2-CD 4.36Å; T278-K282 WeakPolarHBondContact O-CG 3.44Å; T278-K282 PolarHBondContact O-N 2.88Å; L279-K282 WeakPolarHBondContact O-CB 3.41Å; L279-K282 PolarHBondContact O-N 3.04Å; K282-R285 PolarHBondContact O-N 2.69Å; K282-G286 PolarHBondContact O-N 2.78Å
283	I	93.8	Very high	90.9	Very high	0 Å²	0	72 Å²	72	0%	0	41%	0.407	C	S	.	.	H	α-helix	trans	-62.8	-48.9	178.5	-66.2	165.7	0	0	0	111	P238 L241 W255 F271 L279 F280 R285 G286	P238-I283 HydrophobicContact CG-CG2 4.1Å; L241-I283 HydrophobicContact CD1-CB 3.69Å; L241-I283 HydrophobicContact CD1-CD1 4Å; L241-I283 HydrophobicContact CD1-CG1 4.45Å; L241-I283 HydrophobicContact CD1-CG2 3.51Å; W255-I283 HydrophobicContact CZ2-CG2 3.89Å; F271-I283 HydrophobicContact CB-CD1 4.41Å; F271-I283 HydrophobicContact CB-CG1 3.69Å; F271-I283 HydrophobicContact CD1-CG1 4.36Å; F271-I283 HydrophobicContact CD2-CG1 3.97Å; F271-I283 HydrophobicContact CG-CG1 3.73Å; L279-I283 HydrophobicContact CD1-CD1 4.02Å; L279-I283 HydrophobicContact CD1-CG1 4.39Å; L279-I283 HydrophobicContact CG-CD1 4.03Å; L279-I283 WeakPolarHBondContact O-CG1 3.1Å; L279-I283 PolarHBondContact O-N 3.46Å; F280-I283 HydrophobicContact CD1-CD1 4.42Å; I283-R285 PolarHBondContact O-N 3.3Å; I283-R285 VanDerWaalsContact O-N 3.16Å; I283-G286 PolarHBondContact O-N 3.39Å
284	R	92.3	Very high	91.1	Very high	93 Å²	93	71 Å²	71	35%	0.351	40%	0.402	S	S	.	.	H	α-helix	trans	-60.3	-24.9	177.8	-78.2	-175.8	-70.3	-107	-3.1	114.3	L241 F280 K308	L241-R284 HydrophobicContact CB-CG 3.89Å; L241-R284 WeakPolarHBondContact O-CD 3.43Å; L241-R284 PolarHBondContact O-NH1 3.45Å; F280-R284 WeakPolarHBondContact O-CB 3.42Å; F280-R284 WeakPolarHBondContact O-CG 3.36Å; F280-R284 PolarHBondContact O-N 2.89Å; F280-R284 PolarHBondContact O-NE 3.3Å; R284-K308 VanDerWaalsContact O-CE 3.28Å; R284-K308 WeakPolarHBondContact O-CE 3.49Å
285	R	90.7	Very high	91.3	Very high	164 Å²	164	66.5 Å²	66.5	62%	0.619	37%	0.374	S	S	*	.	H	α-helix	trans	-77.2	-23.8	172.4	-71	173.7	-174.7	-146.2	0.1	113.2	S281 K282 I283 Q287	S281-R285 WeakPolarHBondContact O-CG 3.48Å; S281-R285 PolarHBondContact O-N 2.94Å; K282-R285 PolarHBondContact O-N 2.69Å; I283-R285 PolarHBondContact O-N 3.3Å; I283-R285 VanDerWaalsContact O-N 3.16Å; R285-Q287 HydrophobicContact CB-CG 4.38Å; R285-Q287 PolarHBondContact O-N 2.72Å; R285-Q287 VanDerWaalsContact O-N 3.15Å
286	G	84.5	Confident	91.5	Very high	15 Å²	15	68.6 Å²	68.6	16%	0.155	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.4	4.5	-178.8	0	0	0	0	0	115.4	K282 I283 C288	K282-G286 PolarHBondContact O-N 2.78Å; I283-G286 PolarHBondContact O-N 3.39Å; G286-C288 PolarHBondContact O-N 2.98Å
287	Q	83	Confident	91.8	Very high	142 Å²	142	69.2 Å²	69.2	66%	0.664	39%	0.385	S	S	*	.			trans	-78.1	87.5	-173.6	-72.5	174.9	-27.5	0	0	111.2	R285	R285-Q287 HydrophobicContact CB-CG 4.38Å; R285-Q287 PolarHBondContact O-N 2.72Å; R285-Q287 VanDerWaalsContact O-N 3.15Å
288	C	86.6	Confident	92	Very high	31 Å²	31	66.4 Å²	66.4	21%	0.209	36%	0.363	C	S	.	.			trans	-88.7	114.7	176.8	-173.5	0	0	0	0	111.7	Y262 P270 F271 G286 L290 L306	Y262-C288 WeakPolarHBondContact CE2-SG 3.45Å; P270-C288 WeakPolarHBondContact CB-SG 3.15Å; F271-C288 HydrophobicContact CE1-CB 4.36Å; F271-C288 HydrophobicContact CZ-CB 4Å; G286-C288 PolarHBondContact O-N 2.98Å; C288-L290 PolarHBondContact O-N 2.63Å; C288-L306 HydrophobicContact CB-CD1 4.19Å
289	C	89.1	Confident	92.3	Very high	97 Å²	97	66.3 Å²	66.3	66%	0.655	36%	0.357	S	S	*	.			trans	-77.3	110.8	175.1	-59.5	0	0	0	0	111	Y262	Y262-C289 WeakPolarHBondContact CE2-O 3.46Å; Y262-C289 PolarHBondContact OH-O 3.41Å
290	L	92.8	Very high	92.4	Very high	46 Å²	46	68.1 Å²	68.1	24%	0.241	37%	0.371	C	S	.	.			trans	-89.3	126.6	178.4	-60.4	176.5	0	0	0	111.1	Y262 C288 K299 L302 Q303	Y262-L290 HydrophobicContact CD2-CD2 4.09Å; Y262-L290 HydrophobicContact CE2-CD2 3.97Å; C288-L290 PolarHBondContact O-N 2.63Å; L290-K299 HydrophobicContact CD1-CB 4.03Å; L290-K299 HydrophobicContact CD1-CG 4.24Å; L290-L302 HydrophobicContact CD2-CB 3.87Å; L290-L302 HydrophobicContact CD2-CD1 3.77Å; L290-L302 HydrophobicContact CD2-CG 4.46Å; L290-Q303 HydrophobicContact CD1-CG 3.72Å
291	P	91.4	Very high	92.7	Very high	44 Å²	44	65.5 Å²	65.5	29%	0.286	36%	0.359	S	S	.	.			trans	-63.3	146.3	174.7	-22.7	33.7	0	0	0	113.4	V266 G293 L294 K299	V266-P291 HydrophobicContact CG1-CG 3.76Å; V266-P291 HydrophobicContact CG2-CG 3.88Å; P291-G293 VanDerWaalsContact C-N 3.3Å; P291-G293 PolarHBondContact O-N 3.3Å; P291-L294 PolarHBondContact O-N 2.91Å; P291-K299 WeakPolarHBondContact O-CE 3.4Å
292	E	89.9	Confident	92.9	Very high	180 Å²	180	63.5 Å²	63.5	84%	0.841	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-34.8	-179.5	-64.9	-176.1	162.6	0	0	113.2	L294 K299	E292-L294 PolarHBondContact O-N 2.66Å; E292-L294 VanDerWaalsContact O-N 3.12Å; E292-K299 WeakPolarHBondContact O-CE 3.44Å; E292-K299 PolarHBondContact O-NZ 3.47Å
293	G	91.4	Very high	93.1	Very high	83 Å²	83	64.9 Å²	64.9	86%	0.856	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	3.7	-179	0	0	0	0	0	116.5	P291	P291-G293 VanDerWaalsContact C-N 3.3Å; P291-G293 PolarHBondContact O-N 3.3Å
294	L	95.4	Very high	93.3	Very high	18 Å²	18	66.1 Å²	66.1	9%	0.094	36%	0.361	C	S	.	.	S	Bend	trans	-84.3	142.9	171.2	-60.7	-176.4	0	0	0	111	L265 V266 P291 E292 A298 K299 L302	L265-L294 HydrophobicContact CB-CD2 3.91Å; L265-L294 HydrophobicContact CD1-CD2 4.39Å; V266-L294 HydrophobicContact CG2-CD1 4.17Å; P291-L294 PolarHBondContact O-N 2.91Å; E292-L294 PolarHBondContact O-N 2.66Å; E292-L294 VanDerWaalsContact O-N 3.12Å; L294-A298 HydrophobicContact CB-CB 4.33Å; L294-K299 HydrophobicContact CB-CG 3.89Å; L294-K299 WeakPolarHBondContact O-CE 3.33Å; L294-K299 PolarHBondContact O-NZ 2.71Å; L294-L302 HydrophobicContact CD1-CD1 3.77Å
295	S	96.1	Very high	93.6	Very high	31 Å²	31	61.7 Å²	61.7	22%	0.217	35%	0.345	C	S	.	.			trans	-61	153.5	176.9	76.9	0	0	0	0	111.9	E165 K297 A298 K299	E165-S295 VanDerWaalsContact CD-OG 3.24Å; E165-S295 PolarHBondContact OE1-OG 2.92Å; E165-S295 WeakPolarHBondContact OE2-CB 3.38Å; E165-S295 PolarHBondContact OE2-N 3.23Å; E165-S295 PolarHBondContact OE2-OG 2.96Å; S295-K297 PolarHBondContact O-N 3.2Å; S295-A298 WeakPolarHBondContact O-CB 3.46Å; S295-A298 PolarHBondContact O-N 2.98Å; S295-A298 WeakPolarHBondContact OG-CB 3.35Å; S295-A298 PolarHBondContact OG-N 3.33Å; S295-A298 VanDerWaalsContact OG-N 3.09Å; S295-K299 PolarHBondContact O-N 2.88Å
296	P	96.4	Very high	93.9	Very high	108 Å²	108	54.5 Å²	54.5	70%	0.701	32%	0.318	S	S	*	.	H	α-helix	trans	-55.2	-37.2	175.9	-26.7	35.4	0	0	0	112.7	K299 C300	P296-K299 PolarHBondContact O-N 3.35Å; P296-C300 VanDerWaalsContact O-CB 3.3Å; P296-C300 WeakPolarHBondContact O-CB 3.4Å; P296-C300 PolarHBondContact O-N 2.9Å
297	K	97	Very high	94.4	Very high	90 Å²	90	58.5 Å²	58.5	39%	0.391	33%	0.329	S	S	.	.	H	α-helix	trans	-65	-40.1	174.6	-70.3	179	165.7	-163.6	0	112.5	S295 L301 H322 P323 W324	S295-K297 PolarHBondContact O-N 3.2Å; K297-L301 WeakPolarHBondContact O-CB 3.43Å; K297-L301 PolarHBondContact O-N 3.3Å; K297-H322 PolarHBondContact O-CE1 3.47Å; K297-P323 WeakPolarHBondContact CD-O 3.19Å; K297-P323 WeakPolarHBondContact CE-O 3.04Å; K297-P323 PolarHBondContact NZ-O 3.29Å; K297-W324 HydrophobicContact CB-CB 4.08Å; K297-W324 HydrophobicContact CB-CG 4.37Å
298	A	97.3	Very high	94.9	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-68.9	-42.1	176.5	0	0	0	0	0	112	L265 L294 S295 L301 L302	L265-A298 HydrophobicContact CD1-CB 4.19Å; L294-A298 HydrophobicContact CB-CB 4.33Å; S295-A298 WeakPolarHBondContact O-CB 3.46Å; S295-A298 PolarHBondContact O-N 2.98Å; S295-A298 WeakPolarHBondContact OG-CB 3.35Å; S295-A298 PolarHBondContact OG-N 3.33Å; S295-A298 VanDerWaalsContact OG-N 3.09Å; A298-L301 PolarHBondContact O-N 3.24Å; A298-L302 WeakPolarHBondContact O-CG 3.43Å; A298-L302 PolarHBondContact O-N 3.11Å
299	K	97.6	Very high	95.3	Very high	56 Å²	56	60.3 Å²	60.3	24%	0.243	33%	0.332	C	S	.	.	H	α-helix	trans	-60.3	-50.6	175.3	-70.9	170.5	177.7	146.6	0	111.3	L290 P291 E292 L294 S295 P296 L301 L302 Q303	L290-K299 HydrophobicContact CD1-CB 4.03Å; L290-K299 HydrophobicContact CD1-CG 4.24Å; P291-K299 WeakPolarHBondContact O-CE 3.4Å; E292-K299 WeakPolarHBondContact O-CE 3.44Å; E292-K299 PolarHBondContact O-NZ 3.47Å; L294-K299 HydrophobicContact CB-CG 3.89Å; L294-K299 WeakPolarHBondContact O-CE 3.33Å; L294-K299 PolarHBondContact O-NZ 2.71Å; S295-K299 PolarHBondContact O-N 2.88Å; P296-K299 PolarHBondContact O-N 3.35Å; K299-L301 VanDerWaalsContact C-N 3.33Å; K299-L301 PolarHBondContact O-N 3.43Å; K299-L302 PolarHBondContact O-N 3.4Å; K299-Q303 WeakPolarHBondContact O-CG 3.44Å; K299-Q303 PolarHBondContact O-N 3.29Å; K299-Q303 PolarHBondContact O-OE1 3.31Å
300	C	97.1	Very high	95.6	Very high	54 Å²	54	56.8 Å²	56.8	37%	0.365	31%	0.308	S	S	.	.	H	α-helix	trans	-56.1	-46.3	175.8	-180	0	0	0	0	111.6	P296 L302 Q303 S304	P296-C300 VanDerWaalsContact O-CB 3.3Å; P296-C300 WeakPolarHBondContact O-CB 3.4Å; P296-C300 PolarHBondContact O-N 2.9Å; C300-L302 PolarHBondContact O-N 2.9Å; C300-Q303 PolarHBondContact O-N 2.91Å; C300-S304 PolarHBondContact O-N 3.29Å; C300-S304 PolarHBondContact O-OG 2.78Å; C300-S304 VanDerWaalsContact O-OG 3.07Å
301	L	98	Very high	95.8	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-61.8	-41.5	179.2	-171	57.4	0	0	0	113.2	L261 K297 A298 K299 S304 L305 L314 L319 H322 W324 F325	L261-L301 HydrophobicContact CD2-CB 4.47Å; L261-L301 HydrophobicContact CD2-CD2 3.61Å; L261-L301 HydrophobicContact CD2-CG 3.93Å; K297-L301 WeakPolarHBondContact O-CB 3.43Å; K297-L301 PolarHBondContact O-N 3.3Å; A298-L301 PolarHBondContact O-N 3.24Å; K299-L301 VanDerWaalsContact C-N 3.33Å; K299-L301 PolarHBondContact O-N 3.43Å; L301-S304 PolarHBondContact O-N 3.19Å; L301-L305 HydrophobicContact CD1-CD1 4.49Å; L301-L305 HydrophobicContact CG-CD1 4.39Å; L301-L305 WeakPolarHBondContact O-CG 3.26Å; L301-L305 PolarHBondContact O-N 2.75Å; L301-L314 HydrophobicContact CD1-CD1 4.02Å; L301-L319 HydrophobicContact CD1-CD1 3.25Å; L301-L319 HydrophobicContact CD2-CD1 4.15Å; L301-L319 HydrophobicContact CG-CD1 4.09Å; L301-H322 HydrophobicContact CD1-CB 3.85Å; L301-H322 VanDerWaalsContact CD1-CG 3.44Å; L301-H322 VanDerWaalsContact CD1-ND1 3.35Å; L301-H322 WeakPolarHBondContact CD1-ND1 3.45Å; L301-W324 HydrophobicContact CB-CB 4.45Å; L301-W324 HydrophobicContact CD2-CB 3.96Å; L301-W324 HydrophobicContact CD2-CD2 3.75Å; L301-W324 HydrophobicContact CD2-CE3 3.39Å; L301-W324 HydrophobicContact CD2-CG 4.01Å; L301-W324 HydrophobicContact CD2-CZ3 4.13Å; L301-F325 HydrophobicContact CD2-CE2 4.5Å
302	L	98	Very high	96	Very high	1 Å²	1	62.1 Å²	62.1	1%	0.005	34%	0.339	C	S	.	.	H	α-helix	trans	-65.6	-39.4	176.1	-72.8	169.1	0	0	0	111.9	L261 Y262 L265 L290 L294 A298 K299 C300 S304 L305 L306	L261-L302 HydrophobicContact CB-CD2 3.94Å; L261-L302 HydrophobicContact CD2-CD2 3.84Å; L261-L302 HydrophobicContact CD2-CG 4.17Å; L261-L302 HydrophobicContact CG-CD2 3.8Å; L261-L302 HydrophobicContact CG-CG 4.42Å; Y262-L302 HydrophobicContact CD2-CD1 4.19Å; L265-L302 HydrophobicContact CD1-CD1 4.44Å; L290-L302 HydrophobicContact CD2-CB 3.87Å; L290-L302 HydrophobicContact CD2-CD1 3.77Å; L290-L302 HydrophobicContact CD2-CG 4.46Å; L294-L302 HydrophobicContact CD1-CD1 3.77Å; A298-L302 WeakPolarHBondContact O-CG 3.43Å; A298-L302 PolarHBondContact O-N 3.11Å; K299-L302 PolarHBondContact O-N 3.4Å; C300-L302 PolarHBondContact O-N 2.9Å; L302-S304 VanDerWaalsContact C-N 3.3Å; L302-S304 PolarHBondContact O-N 2.61Å; L302-L305 PolarHBondContact O-N 2.82Å; L302-L306 WeakPolarHBondContact O-CB 3.47Å; L302-L306 PolarHBondContact O-N 3.05Å
303	Q	96.8	Very high	96.4	Very high	110 Å²	110	54 Å²	54	51%	0.514	30%	0.301	S	S	.	.	H	α-helix	trans	-65.4	-31.6	175.7	-69.5	170.3	-49.8	0	0	112.8	L290 K299 C300 R307	L290-Q303 HydrophobicContact CD1-CG 3.72Å; K299-Q303 WeakPolarHBondContact O-CG 3.44Å; K299-Q303 PolarHBondContact O-N 3.29Å; K299-Q303 PolarHBondContact O-OE1 3.31Å; C300-Q303 PolarHBondContact O-N 2.91Å; Q303-R307 WeakPolarHBondContact O-CD 3.45Å; Q303-R307 VanDerWaalsContact O-CG 3.29Å; Q303-R307 WeakPolarHBondContact O-CG 3.34Å; Q303-R307 PolarHBondContact O-NE 3.26Å
304	S	97.6	Very high	96.7	Very high	26 Å²	26	51.9 Å²	51.9	18%	0.182	27%	0.27	C	S	.	.	H	α-helix	trans	-85.6	-8.1	179.6	-55	0	0	0	0	114.3	C300 L301 L302 R313 L314	C300-S304 PolarHBondContact O-N 3.29Å; C300-S304 PolarHBondContact O-OG 2.78Å; C300-S304 VanDerWaalsContact O-OG 3.07Å; L301-S304 PolarHBondContact O-N 3.19Å; L302-S304 VanDerWaalsContact C-N 3.3Å; L302-S304 PolarHBondContact O-N 2.61Å; S304-R313 WeakPolarHBondContact O-CA 3.42Å; S304-L314 PolarHBondContact O-N 3.17Å; S304-L314 VanDerWaalsContact O-N 3.15Å
305	L	98	Very high	96.9	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-105.2	-36.2	171.9	-67.1	175.8	0	0	0	112.6	F172 M254 L301 L302 R307 L314 L319	F172-L305 HydrophobicContact CZ-CD1 4.37Å; M254-L305 HydrophobicContact CB-CD2 4.44Å; M254-L305 HydrophobicContact CE-CD2 3.91Å; L301-L305 HydrophobicContact CD1-CD1 4.49Å; L301-L305 HydrophobicContact CG-CD1 4.39Å; L301-L305 WeakPolarHBondContact O-CG 3.26Å; L301-L305 PolarHBondContact O-N 2.75Å; L302-L305 PolarHBondContact O-N 2.82Å; L305-R307 VanDerWaalsContact C-N 3.26Å; L305-R307 PolarHBondContact O-N 2.89Å; L305-L314 HydrophobicContact CD2-CB 4.31Å; L305-L319 HydrophobicContact CD1-CD1 3.96Å; L305-L319 HydrophobicContact CD1-CD2 4.12Å; L305-L319 HydrophobicContact CD2-CD1 4.2Å; L305-L319 HydrophobicContact CD2-CD2 3.99Å; L305-L319 HydrophobicContact CG-CD1 4.39Å
306	L	97.1	Very high	96.9	Very high	12 Å²	12	52.3 Å²	52.3	6%	0.063	27%	0.272	C	S	.	.	S	Bend	trans	-91.9	31.3	178.8	-60.3	177.1	0	0	0	112.6	W255 V259 P270 C288 L302	W255-L306 HydrophobicContact CD2-CD2 3.91Å; W255-L306 HydrophobicContact CE3-CB 4.42Å; W255-L306 HydrophobicContact CE3-CD2 3.93Å; W255-L306 HydrophobicContact CG-CD2 4.49Å; W255-L306 HydrophobicContact CH2-CD2 4.37Å; W255-L306 HydrophobicContact CZ2-CD2 4.35Å; W255-L306 HydrophobicContact CZ3-CB 4.14Å; W255-L306 HydrophobicContact CZ3-CD2 4.16Å; W255-L306 WeakPolarHBondContact CZ3-O 3.03Å; V259-L306 HydrophobicContact CG2-CD2 4.04Å; P270-L306 HydrophobicContact CB-CD1 4.17Å; P270-L306 HydrophobicContact CG-CD1 4.36Å; C288-L306 HydrophobicContact CB-CD1 4.19Å; L302-L306 WeakPolarHBondContact O-CB 3.47Å; L302-L306 PolarHBondContact O-N 3.05Å
307	R	95.9	Very high	96.9	Very high	99 Å²	99	49.9 Å²	49.9	37%	0.374	26%	0.261	S	S	.	.			trans	-65.5	135.4	168.5	-69.3	-58.5	-167.6	114.4	-1.1	110.1	Q303 L305 E312 R313	Q303-R307 WeakPolarHBondContact O-CD 3.45Å; Q303-R307 VanDerWaalsContact O-CG 3.29Å; Q303-R307 WeakPolarHBondContact O-CG 3.34Å; Q303-R307 PolarHBondContact O-NE 3.26Å; L305-R307 VanDerWaalsContact C-N 3.26Å; L305-R307 PolarHBondContact O-N 2.89Å; R307-E312 HydrophobicContact CB-CB 3.84Å; R307-E312 WeakPolarHBondContact CD-OE2 3.08Å; R307-E312 HydrophobicContact CG-CB 3.72Å; R307-E312 IonicContact CZ-OE2 3.86Å; R307-E312 IonicContact NE-OE2 2.64Å; R307-E312 IonicContact NH1-OE1 2.72Å; R307-E312 PolarHBondContact NH1-OE1 3.16Å; R307-E312 IonicContact NH1-OE2 3.64Å; R307-E312 PolarHBondContact NH1-OE2 3.07Å; R307-R313 HydrophobicContact CB-CG 3.94Å; R307-R313 PolarHBondContact O-NE 3.05Å; R307-R313 PolarHBondContact O-NH2 3.44Å; R307-R313 VanDerWaalsContact O-NH2 3.16Å
308	K	94.3	Very high	96.9	Very high	118 Å²	118	50.5 Å²	50.5	51%	0.513	27%	0.265	S	S	.	.	S	Bend	trans	-61.2	-51.7	175.8	-177.9	-171.3	171.3	-171.5	0	110.1	P238 R284 P310 R313	P238-K308 HydrophobicContact CB-CG 4.17Å; P238-K308 HydrophobicContact CG-CG 4.43Å; R284-K308 VanDerWaalsContact O-CE 3.28Å; R284-K308 WeakPolarHBondContact O-CE 3.49Å; K308-P310 WeakPolarHBondContact O-CD 3.29Å; K308-R313 PolarHBondContact O-NH2 3.11Å
309	E	94.6	Very high	97	Very high	94 Å²	94	50.5 Å²	50.5	44%	0.439	27%	0.265	S	S	.	.	S	Bend	trans	-70	120.8	177.3	175.8	44.8	-129.7	0	0	109.9	S311 E312	E309-S311 VanDerWaalsContact C-N 3.27Å; E309-S311 WeakPolarHBondContact CG-OG 3.3Å; E309-S311 PolarHBondContact O-N 2.79Å; E309-S311 WeakPolarHBondContact OE1-CB 3.43Å; E309-S311 PolarHBondContact OE1-N 3.07Å; E309-S311 VanDerWaalsContact OE1-N 3.1Å; E309-S311 PolarHBondContact OE1-OG 3.23Å; E309-E312 HydrophobicContact CB-CB 4.45Å; E309-E312 HydrophobicContact CB-CG 3.93Å; E309-E312 HydrophobicContact CG-CG 3.91Å; E309-E312 PolarHBondContact O-N 2.83Å
310	P	95.4	Very high	96.9	Very high	23 Å²	23	49.5 Å²	49.5	15%	0.149	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-59.3	-36.3	-178.9	-26.5	35.8	0	0	0	113.5	E239 M251 K308 E312 R313	E239-P310 HydrophobicContact CB-CG 3.97Å; E239-P310 HydrophobicContact CG-CG 3.88Å; M251-P310 HydrophobicContact CB-CB 3.83Å; M251-P310 HydrophobicContact CG-CB 4.24Å; M251-P310 WeakPolarHBondContact CG-O 3.32Å; K308-P310 WeakPolarHBondContact O-CD 3.29Å; P310-E312 PolarHBondContact O-N 2.96Å; P310-R313 WeakPolarHBondContact O-CB 3.23Å; P310-R313 PolarHBondContact O-N 2.9Å
311	S	95.6	Very high	96.9	Very high	100 Å²	100	50.2 Å²	50.2	70%	0.699	27%	0.272	S	S	*	.	G	3₁₀ helix	trans	-72	-11.1	-178.5	59.4	0	0	0	0	114.8	E309	E309-S311 VanDerWaalsContact C-N 3.27Å; E309-S311 WeakPolarHBondContact CG-OG 3.3Å; E309-S311 PolarHBondContact O-N 2.79Å; E309-S311 WeakPolarHBondContact OE1-CB 3.43Å; E309-S311 PolarHBondContact OE1-N 3.07Å; E309-S311 VanDerWaalsContact OE1-N 3.1Å; E309-S311 PolarHBondContact OE1-OG 3.23Å
312	E	96.9	Very high	96.9	Very high	102 Å²	102	51.3 Å²	51.3	48%	0.477	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-89.3	-3.6	172.2	-63.9	-173.3	139.8	0	0	113.7	R307 E309 P310	R307-E312 HydrophobicContact CB-CB 3.84Å; R307-E312 WeakPolarHBondContact CD-OE2 3.08Å; R307-E312 HydrophobicContact CG-CB 3.72Å; R307-E312 IonicContact CZ-OE2 3.86Å; R307-E312 IonicContact NE-OE2 2.64Å; R307-E312 IonicContact NH1-OE1 2.72Å; R307-E312 PolarHBondContact NH1-OE1 3.16Å; R307-E312 IonicContact NH1-OE2 3.64Å; R307-E312 PolarHBondContact NH1-OE2 3.07Å; E309-E312 HydrophobicContact CB-CB 4.45Å; E309-E312 HydrophobicContact CB-CG 3.93Å; E309-E312 HydrophobicContact CG-CG 3.91Å; E309-E312 PolarHBondContact O-N 2.83Å; P310-E312 PolarHBondContact O-N 2.96Å
313	R	98.1	Very high	96.8	Very high	10 Å²	10	54.2 Å²	54.2	4%	0.038	30%	0.296	C	S	.	.	S	Bend	trans	-82.9	140.9	-176.9	-60.8	177.8	-165.6	146.6	14.2	110.9	E239 M251 M254 S304 R307 K308 P310 T315	E239-R313 IonicContact OE1-CZ 3.75Å; E239-R313 IonicContact OE1-NH1 3.47Å; E239-R313 PolarHBondContact OE1-NH1 3.14Å; E239-R313 IonicContact OE1-NH2 3.7Å; E239-R313 IonicContact OE2-CZ 3.71Å; E239-R313 IonicContact OE2-NH1 3.78Å; E239-R313 PolarHBondContact OE2-NH1 3.03Å; E239-R313 IonicContact OE2-NH2 2.74Å; E239-R313 PolarHBondContact OE2-NH2 3.05Å; M251-R313 PolarHBondContact O-NH1 2.86Å; M251-R313 HydrophobicContact SD-CB 3.88Å; M254-R313 HydrophobicContact CB-CB 4.48Å; S304-R313 WeakPolarHBondContact O-CA 3.42Å; R307-R313 HydrophobicContact CB-CG 3.94Å; R307-R313 PolarHBondContact O-NE 3.05Å; R307-R313 PolarHBondContact O-NH2 3.44Å; R307-R313 VanDerWaalsContact O-NH2 3.16Å; K308-R313 PolarHBondContact O-NH2 3.11Å; P310-R313 WeakPolarHBondContact O-CB 3.23Å; P310-R313 PolarHBondContact O-N 2.9Å; R313-T315 PolarHBondContact O-N 3.14Å
314	L	98.3	Very high	96.8	Very high	38 Å²	38	49 Å²	49	20%	0.199	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-59.7	135.5	170.2	-63.3	171.8	0	0	0	110.5	M254 L301 S304 L305 E318	M254-L314 WeakPolarHBondContact CE-O 3.48Å; M254-L314 VanDerWaalsContact CG-O 3.29Å; M254-L314 WeakPolarHBondContact CG-O 3.33Å; L301-L314 HydrophobicContact CD1-CD1 4.02Å; S304-L314 PolarHBondContact O-N 3.17Å; S304-L314 VanDerWaalsContact O-N 3.15Å; L305-L314 HydrophobicContact CD2-CB 4.31Å; L314-E318 HydrophobicContact CB-CB 4.4Å; L314-E318 HydrophobicContact CD2-CB 4.07Å
315	T	98.3	Very high	96.7	Very high	54 Å²	54	48.3 Å²	48.3	33%	0.331	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-66.9	163.3	165.3	65.8	0	0	0	0	111.3	M251 R313 A317 E318 L319	M251-T315 HydrophobicContact CE-CG2 4.1Å; R313-T315 PolarHBondContact O-N 3.14Å; T315-A317 PolarHBondContact O-N 2.86Å; T315-A317 VanDerWaalsContact O-N 3.15Å; T315-E318 VanDerWaalsContact CB-OE2 3.23Å; T315-E318 WeakPolarHBondContact CB-OE2 3.41Å; T315-E318 VanDerWaalsContact CG2-OE2 3.27Å; T315-E318 WeakPolarHBondContact CG2-OE2 3.33Å; T315-E318 PolarHBondContact N-OE2 3.23Å; T315-E318 PolarHBondContact O-N 3.17Å; T315-E318 VanDerWaalsContact OG1-CD 3.32Å; T315-E318 WeakPolarHBondContact OG1-CG 3.32Å; T315-E318 PolarHBondContact OG1-N 2.92Å; T315-E318 PolarHBondContact OG1-OE2 3.44Å; T315-L319 VanDerWaalsContact O-CB 3.26Å; T315-L319 WeakPolarHBondContact O-CB 3.31Å; T315-L319 PolarHBondContact O-N 3.27Å
316	A	97.4	Very high	96.3	Very high	3 Å²	3	53.3 Å²	53.3	3%	0.025	29%	0.289	C	S	.	.	H	α-helix	trans	-60.5	-24	176.6	0	0	0	0	0	113.6	V179 A180 M254 L320	V179-A316 HydrophobicContact CG1-CB 4.44Å; A180-A316 HydrophobicContact CB-CB 3.8Å; M254-A316 HydrophobicContact CE-CB 4.12Å; M254-A316 HydrophobicContact SD-CB 3.82Å; M254-A316 PolarHBondContact SD-N 3.5Å; A316-L320 WeakPolarHBondContact O-CG 3.17Å
317	A	95.6	Very high	95	Very high	57 Å²	57	59.3 Å²	59.3	47%	0.471	32%	0.32	S	S	.	.	H	α-helix	trans	-76.8	-48.9	175.5	0	0	0	0	0	112	T315 L319 L320	T315-A317 PolarHBondContact O-N 2.86Å; T315-A317 VanDerWaalsContact O-N 3.15Å; A317-L319 VanDerWaalsContact C-N 3.29Å; A317-L319 PolarHBondContact O-N 2.84Å; A317-L320 PolarHBondContact O-N 2.85Å
318	E	97.8	Very high	93.6	Very high	103 Å²	103	59 Å²	59	48%	0.481	33%	0.331	S	S	.	.	H	α-helix	trans	-65.4	-35.6	177.2	-64.3	156.7	131.5	0	0	111.4	L314 T315 L320 A321 H322	L314-E318 HydrophobicContact CB-CB 4.4Å; L314-E318 HydrophobicContact CD2-CB 4.07Å; T315-E318 VanDerWaalsContact CB-OE2 3.23Å; T315-E318 WeakPolarHBondContact CB-OE2 3.41Å; T315-E318 VanDerWaalsContact CG2-OE2 3.27Å; T315-E318 WeakPolarHBondContact CG2-OE2 3.33Å; T315-E318 PolarHBondContact N-OE2 3.23Å; T315-E318 PolarHBondContact O-N 3.17Å; T315-E318 VanDerWaalsContact OG1-CD 3.32Å; T315-E318 WeakPolarHBondContact OG1-CG 3.32Å; T315-E318 PolarHBondContact OG1-N 2.92Å; T315-E318 PolarHBondContact OG1-OE2 3.44Å; E318-L320 VanDerWaalsContact C-N 3.28Å; E318-L320 PolarHBondContact O-N 2.95Å; E318-A321 PolarHBondContact O-N 2.65Å; E318-H322 PolarHBondContact O-N 3.18Å
319	L	97.9	Very high	91.6	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-55.3	-42.6	173.4	179.2	54.4	0	0	0	111.6	F172 V176 M254 L257 L301 L305 T315 A317 A321 H322 F325	F172-L319 HydrophobicContact CE1-CD2 4.37Å; V176-L319 HydrophobicContact CB-CD2 4.23Å; V176-L319 HydrophobicContact CG1-CB 4.19Å; V176-L319 HydrophobicContact CG1-CD2 3.65Å; V176-L319 HydrophobicContact CG1-CG 3.79Å; V176-L319 HydrophobicContact CG2-CD2 3.43Å; V176-L319 VanDerWaalsContact CG2-CD2 3.43Å; V176-L319 HydrophobicContact CG2-CG 3.98Å; M254-L319 HydrophobicContact CE-CB 4.16Å; M254-L319 HydrophobicContact CE-CD2 3.48Å; M254-L319 VanDerWaalsContact CE-CD2 3.48Å; M254-L319 HydrophobicContact CE-CG 4.44Å; L257-L319 HydrophobicContact CD1-CD2 4.03Å; L301-L319 HydrophobicContact CD1-CD1 3.25Å; L301-L319 HydrophobicContact CD2-CD1 4.15Å; L301-L319 HydrophobicContact CG-CD1 4.09Å; L305-L319 HydrophobicContact CD1-CD1 3.96Å; L305-L319 HydrophobicContact CD1-CD2 4.12Å; L305-L319 HydrophobicContact CD2-CD1 4.2Å; L305-L319 HydrophobicContact CD2-CD2 3.99Å; L305-L319 HydrophobicContact CG-CD1 4.39Å; T315-L319 VanDerWaalsContact O-CB 3.26Å; T315-L319 WeakPolarHBondContact O-CB 3.31Å; T315-L319 PolarHBondContact O-N 3.27Å; A317-L319 VanDerWaalsContact C-N 3.29Å; A317-L319 PolarHBondContact O-N 2.84Å; L319-A321 PolarHBondContact O-N 2.84Å; L319-H322 VanDerWaalsContact O-CB 3.28Å; L319-H322 WeakPolarHBondContact O-CB 3.48Å; L319-H322 PolarHBondContact O-N 2.98Å; L319-H322 VanDerWaalsContact O-N 3.14Å; L319-F325 HydrophobicContact CD1-CE2 4.04Å; L319-F325 HydrophobicContact CG-CE2 4.2Å; L319-F325 WeakPolarHBondContact O-CD2 3.22Å; L319-F325 WeakPolarHBondContact O-CE2 3.49Å
320	L	96.7	Very high	89.5	Confident	36 Å²	36	55.4 Å²	55.4	19%	0.188	33%	0.328	C	S	.	.	H	α-helix	trans	-66.6	-24.2	178	-71.3	167.7	0	0	0	113.9	R173 V176 L177 A180 A316 A317 E318	R173-L320 HydrophobicContact CG-CD2 4.28Å; V176-L320 HydrophobicContact CB-CD2 3.94Å; V176-L320 HydrophobicContact CG1-CD1 4.41Å; V176-L320 HydrophobicContact CG1-CD2 3.62Å; V176-L320 HydrophobicContact CG1-CG 3.64Å; L177-L320 HydrophobicContact CD2-CD1 3.8Å; L177-L320 HydrophobicContact CD2-CD2 3.92Å; L177-L320 HydrophobicContact CG-CD2 3.87Å; A180-L320 HydrophobicContact CB-CD1 3.83Å; A316-L320 WeakPolarHBondContact O-CG 3.17Å; A317-L320 PolarHBondContact O-N 2.85Å; E318-L320 VanDerWaalsContact C-N 3.28Å; E318-L320 PolarHBondContact O-N 2.95Å
321	A	96.6	Very high	87.7	Confident	68 Å²	68	60 Å²	60	56%	0.562	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	-4.8	175.7	0	0	0	0	0	113.3	E318 L319	E318-A321 PolarHBondContact O-N 2.65Å; L319-A321 PolarHBondContact O-N 2.84Å
322	H	97.8	Very high	85.6	Confident	24 Å²	24	63 Å²	63	11%	0.111	36%	0.361	C	S	.	.	S	Bend	trans	-65.5	131.7	-174.6	-172.8	-101.1	0	0	0	112.1	K297 L301 E318 L319 W324 F325	K297-H322 PolarHBondContact O-CE1 3.47Å; L301-H322 HydrophobicContact CD1-CB 3.85Å; L301-H322 VanDerWaalsContact CD1-CG 3.44Å; L301-H322 VanDerWaalsContact CD1-ND1 3.35Å; L301-H322 WeakPolarHBondContact CD1-ND1 3.45Å; E318-H322 PolarHBondContact O-N 3.18Å; L319-H322 VanDerWaalsContact O-CB 3.28Å; L319-H322 WeakPolarHBondContact O-CB 3.48Å; L319-H322 PolarHBondContact O-N 2.98Å; L319-H322 VanDerWaalsContact O-N 3.14Å; H322-W324 VanDerWaalsContact ND1-CB 3.31Å; H322-W324 WeakPolarHBondContact ND1-CB 3.43Å; H322-W324 PolarHBondContact ND1-N 3.21Å; H322-W324 PolarHBondContact O-N 3.33Å; H322-F325 PolarHBondContact O-N 3.33Å
323	P	96.2	Very high	83.5	Confident	61 Å²	61	62.6 Å²	62.6	40%	0.396	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-6.9	-174.6	-28.3	36.1	0	0	0	117	K297 F325	K297-P323 WeakPolarHBondContact CD-O 3.19Å; K297-P323 WeakPolarHBondContact CE-O 3.04Å; K297-P323 PolarHBondContact NZ-O 3.29Å; P323-F325 VanDerWaalsContact C-N 3.35Å
324	W	97.1	Very high	81.5	Confident	0 Å²	0	66 Å²	66	0%	0	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-29.9	167.7	-175.7	71.5	0	0	0	113.3	E165 A168 R169 F172 L261 L265 K297 L301 H322	E165-W324 VanDerWaalsContact CD-NE1 3.34Å; E165-W324 HydrophobicContact CG-CZ2 3.8Å; E165-W324 PolarHBondContact OE1-NE1 2.91Å; A168-W324 HydrophobicContact CB-CH2 4.46Å; R169-W324 HydrophobicContact CB-CH2 3.82Å; R169-W324 HydrophobicContact CB-CZ2 4.04Å; R169-W324 HydrophobicContact CB-CZ3 4.12Å; R169-W324 HydrophobicContact CG-CZ3 4.39Å; R169-W324 PolarHBondContact NE-O 2.65Å; R169-W324 PolarHBondContact NH2-O 3.04Å; F172-W324 HydrophobicContact CB-CZ3 4.39Å; F172-W324 AromaticContact CD1-CZ3 3.94Å; F172-W324 HydrophobicContact CD1-CZ3 3.94Å; L261-W324 HydrophobicContact CD1-CH2 3.53Å; L261-W324 HydrophobicContact CD1-CZ2 4.1Å; L261-W324 HydrophobicContact CD1-CZ3 4.04Å; L265-W324 HydrophobicContact CD1-CZ2 4.42Å; L265-W324 HydrophobicContact CD2-CZ2 4.47Å; K297-W324 HydrophobicContact CB-CB 4.08Å; K297-W324 HydrophobicContact CB-CG 4.37Å; L301-W324 HydrophobicContact CB-CB 4.45Å; L301-W324 HydrophobicContact CD2-CB 3.96Å; L301-W324 HydrophobicContact CD2-CD2 3.75Å; L301-W324 HydrophobicContact CD2-CE3 3.39Å; L301-W324 HydrophobicContact CD2-CG 4.01Å; L301-W324 HydrophobicContact CD2-CZ3 4.13Å; H322-W324 VanDerWaalsContact ND1-CB 3.31Å; H322-W324 WeakPolarHBondContact ND1-CB 3.43Å; H322-W324 PolarHBondContact ND1-N 3.21Å; H322-W324 PolarHBondContact O-N 3.33Å
325	F	95.3	Very high	79.3	Confident	12 Å²	12	68.2 Å²	68.2	5%	0.053	41%	0.408	C	S	.	.	S	Bend	trans	-78.6	-20	177.8	-74.4	-64.1	0	0	0	113.6	R169 F172 R173 V176 L301 L319 H322 P323	R169-F325 HydrophobicContact CG-CD1 4.14Å; F172-F325 HydrophobicContact CD1-CE1 4.07Å; F172-F325 AromaticContact CD1-CZ 3.62Å; F172-F325 HydrophobicContact CD1-CZ 3.62Å; F172-F325 HydrophobicContact CE1-CZ 4.11Å; R173-F325 HydrophobicContact CB-CD1 3.7Å; R173-F325 HydrophobicContact CB-CE1 3.54Å; R173-F325 HydrophobicContact CB-CZ 4.43Å; R173-F325 HydrophobicContact CG-CD1 3.94Å; R173-F325 HydrophobicContact CG-CE1 4.06Å; V176-F325 HydrophobicContact CG2-CZ 4.2Å; L301-F325 HydrophobicContact CD2-CE2 4.5Å; L319-F325 HydrophobicContact CD1-CE2 4.04Å; L319-F325 HydrophobicContact CG-CE2 4.2Å; L319-F325 WeakPolarHBondContact O-CD2 3.22Å; L319-F325 WeakPolarHBondContact O-CE2 3.49Å; H322-F325 PolarHBondContact O-N 3.33Å; P323-F325 VanDerWaalsContact C-N 3.35Å
326	H	88.9	Confident	76.8	Confident	106 Å²	106	70.5 Å²	70.5	49%	0.491	43%	0.426	S	S	.	.	S	Bend	trans	-66.1	134.8	172.7	-56.4	174.3	0	0	0	108.8
327	L	71.6	Confident	74.2	Confident	138 Å²	138	73.2 Å²	73.2	72%	0.723	46%	0.455	S	S	*	.	P	Polyproline II helix	trans	-61.5	151.5	169.4	-76.5	82.3	0	0	0	109
328	P	64.6	Low	71.8	Confident	92 Å²	92	78.9 Å²	78.9	60%	0.597	47%	0.471	S	S	*	.	P	Polyproline II helix	trans	-57.9	145.1	156.3	29.4	-33.8	0	0	0	108.5
329	P	54.1	Low	69.3	Low	93 Å²	93	82.6 Å²	82.6	60%	0.604	49%	0.489	S	S	*	.	P	Polyproline II helix	trans	-55.5	144.4	169.9	25.8	-33.7	0	0	0	109.3	D333 V334	P329-D333 HydrophobicContact CB-CB 4.11Å; P329-V334 HydrophobicContact CG-CG2 4.48Å
330	S	50.3	Low	66.9	Low	43 Å²	43	91.7 Å²	91.7	30%	0.301	53%	0.531	S	S	.	.	P	Polyproline II helix	trans	-68.2	157.4	171.9	76.4	0	0	0	0	109.7	Q332 D333	S330-Q332 PolarHBondContact O-N 3.02Å; S330-Q332 PolarHBondContact OG-N 3.1Å; S330-D333 WeakPolarHBondContact CA-OD2 3.45Å; S330-D333 VanDerWaalsContact CB-OD2 3.22Å; S330-D333 WeakPolarHBondContact CB-OD2 3.42Å; S330-D333 PolarHBondContact N-OD2 3.48Å; S330-D333 PolarHBondContact O-N 3.44Å; S330-D333 VanDerWaalsContact OG-CG 3.28Å; S330-D333 PolarHBondContact OG-N 3.36Å; S330-D333 PolarHBondContact OG-OD2 3.19Å
331	P	57.6	Low	64.1	Low	119 Å²	119	96.7 Å²	96.7	77%	0.773	56%	0.563	S	S	*	*	H	α-helix	trans	-57.8	-17.6	172.6	-25.7	35.7	0	0	0	114
332	Q	51.5	Low	61.1	Low	163 Å²	163	100.4 Å²	100.4	76%	0.762	57%	0.573	S	S	*	*	H	α-helix	trans	-81.1	-34.4	176.6	-64.7	-177.4	-23.1	0	0	112.3	S330 V334 A335 S336	S330-Q332 PolarHBondContact O-N 3.02Å; S330-Q332 PolarHBondContact OG-N 3.1Å; Q332-V334 VanDerWaalsContact C-N 3.28Å; Q332-V334 PolarHBondContact O-N 3.13Å; Q332-A335 PolarHBondContact O-N 2.9Å; Q332-S336 PolarHBondContact O-OG 2.68Å
333	D	52.2	Low	58.5	Low	94 Å²	94	105.1 Å²	105.1	50%	0.503	61%	0.609	S	S	.	*	H	α-helix	trans	-66.2	-32.9	178.6	-57	-64.6	0	0	0	111.8	P329 S330 S336	P329-D333 HydrophobicContact CB-CB 4.11Å; S330-D333 WeakPolarHBondContact CA-OD2 3.45Å; S330-D333 VanDerWaalsContact CB-OD2 3.22Å; S330-D333 WeakPolarHBondContact CB-OD2 3.42Å; S330-D333 PolarHBondContact N-OD2 3.48Å; S330-D333 PolarHBondContact O-N 3.44Å; S330-D333 VanDerWaalsContact OG-CG 3.28Å; S330-D333 PolarHBondContact OG-N 3.36Å; S330-D333 PolarHBondContact OG-OD2 3.19Å; D333-S336 PolarHBondContact O-N 3.16Å; D333-S336 PolarHBondContact O-OG 2.93Å
334	V	55.5	Low	55.8	Low	83 Å²	83	106 Å²	106	50%	0.503	62%	0.622	S	S	.	*	H	α-helix	trans	-69.8	-39.9	178.7	-170	0	0	0	0	111.2	P329 Q332 S336 G337	P329-V334 HydrophobicContact CG-CG2 4.48Å; Q332-V334 VanDerWaalsContact C-N 3.28Å; Q332-V334 PolarHBondContact O-N 3.13Å; V334-S336 PolarHBondContact O-N 3.2Å; V334-S336 VanDerWaalsContact O-N 3.15Å; V334-G337 PolarHBondContact O-N 2.98Å
335	A	51.6	Low	53.5	Low	84 Å²	84	114.8 Å²	114.8	69%	0.694	66%	0.663	S	S	*	*	H	α-helix	trans	-65.7	-15.2	179.1	0	0	0	0	0	113.9	Q332	Q332-A335 PolarHBondContact O-N 2.9Å
336	S	46.3	Very low	50.7	Low	101 Å²	101	123.5 Å²	123.5	71%	0.706	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.7	2	172.7	43.6	0	0	0	0	114.7	Q332 D333 V334	Q332-S336 PolarHBondContact O-OG 2.68Å; D333-S336 PolarHBondContact O-N 3.16Å; D333-S336 PolarHBondContact O-OG 2.93Å; V334-S336 PolarHBondContact O-N 3.2Å; V334-S336 VanDerWaalsContact O-N 3.15Å
337	G	43.9	Very low	48.5	Very low	61 Å²	61	123.9 Å²	123.9	63%	0.629	71%	0.714	S	S	*	*	S	Bend	trans	-99.1	-15.2	-178.3	0	0	0	0	0	115.7	V334 Q339	V334-G337 PolarHBondContact O-N 2.98Å; G337-Q339 PolarHBondContact O-N 2.85Å
338	E	43.7	Very low	46.7	Very low	175 Å²	175	123.7 Å²	123.7	82%	0.818	72%	0.718	S	S	*	*			trans	-95.7	62.4	-171.7	-64	-170.3	145	0	0	112.9
339	Q	45.3	Very low	45.4	Very low	182 Å²	182	124.2 Å²	124.2	85%	0.85	72%	0.721	S	S	*	*	S	Bend	trans	-144.5	131.8	164.5	-125.1	167.7	-4.5	0	0	112.4	G337	G337-Q339 PolarHBondContact O-N 2.85Å
340	E	47.6	Very low	44.7	Very low	190 Å²	190	124.5 Å²	124.5	89%	0.888	73%	0.725	S	S	*	*			trans	61.2	71.2	175.1	-56.7	-164.3	156.8	0	0	117.9
341	V	37.7	Very low	44.1	Very low	142 Å²	142	131.6 Å²	131.6	86%	0.861	75%	0.751	S	S	*	*			trans	-115.5	123.2	134.1	-178.2	0	0	0	0	107.9
342	N	35.4	Very low	43.3	Very low	145 Å²	145	134.1 Å²	134.1	78%	0.775	75%	0.753	S	S	*	*			trans	-65.6	133.5	-169.9	-172.8	17.3	0	0	0	112.4	A344	N342-A344 PolarHBondContact O-N 2.94Å
343	S	41.4	Very low	43	Very low	124 Å²	124	132.3 Å²	132.3	87%	0.867	75%	0.752	S	S	*	*			trans	-77.4	82.1	175.8	-56	0	0	0	0	111.2
344	A	40.8	Very low	42.5	Very low	80 Å²	80	136.3 Å²	136.3	66%	0.661	77%	0.768	S	S	*	*			trans	-107	134.6	166.6	0	0	0	0	0	109.9	N342	N342-A344 PolarHBondContact O-N 2.94Å
345	E	47.5	Very low	41.9	Very low	184 Å²	184	140.9 Å²	140.9	86%	0.86	78%	0.784	S	S	*	*			trans	-53.7	132.5	-166.4	-63.1	156.5	108.4	0	0	114.9
346	Q	37.2	Very low	41.4	Very low	195 Å²	195	144 Å²	144	91%	0.911	79%	0.789	S	S	*	*			trans	-128	71.9	158.1	-167.6	170.1	3.4	0	0	109.6
347	T	42	Very low	41.3	Very low	114 Å²	114	146.6 Å²	146.6	70%	0.699	80%	0.795	S	S	*	*			trans	-67.5	141.6	168.5	39	0	0	0	0	110.4
348	V	33.7	Very low	41.3	Very low	133 Å²	133	150.3 Å²	150.3	81%	0.806	80%	0.8	S	S	*	*			trans	-77.9	126.7	174.5	-177	0	0	0	0	108.1	S350	V348-S350 PolarHBondContact O-N 3.06Å; V348-S350 VanDerWaalsContact O-N 3.1Å
349	P	37.6	Very low	41.3	Very low	104 Å²	104	148.1 Å²	148.1	68%	0.675	79%	0.794	S	S	*	*			trans	-69.3	109.3	174.8	27.7	-32.9	0	0	0	109.8	F351	P349-F351 PolarHBondContact O-N 2.98Å
350	S	39.7	Very low	41.1	Very low	99 Å²	99	148.9 Å²	148.9	69%	0.692	79%	0.794	S	S	*	*			trans	-69.9	116.4	166.5	46.5	0	0	0	0	109.3	V348 E352	V348-S350 PolarHBondContact O-N 3.06Å; V348-S350 VanDerWaalsContact O-N 3.1Å; S350-E352 PolarHBondContact O-N 3.08Å
351	F	37.4	Very low	40.9	Very low	192 Å²	192	149.2 Å²	149.2	84%	0.842	82%	0.815	S	S	*	*			trans	-72.2	106.5	166.2	-86.4	-97.8	0	0	0	108.8	P349	P349-F351 PolarHBondContact O-N 2.98Å
352	E	40.6	Very low	41	Very low	172 Å²	172	149.6 Å²	149.6	80%	0.804	81%	0.813	S	S	*	*			trans	-72.6	133.9	161.7	-65.4	-177.5	155.5	0	0	108.2	S350	S350-E352 PolarHBondContact O-N 3.08Å
353	V	45.5	Very low	41.3	Very low	124 Å²	124	149.8 Å²	149.8	75%	0.752	82%	0.815	S	S	*	*			trans	-100.3	106.8	175.9	178.2	0	0	0	0	106.7	E355	V353-E355 PolarHBondContact O-N 2.9Å; V353-E355 VanDerWaalsContact O-N 3.07Å
354	E	42.6	Very low	41.3	Very low	178 Å²	178	151.2 Å²	151.2	83%	0.832	81%	0.812	S	S	*	*			trans	-72	98.5	171	-68.9	-172.3	145.7	0	0	109.3	N356	E354-N356 VanDerWaalsContact C-N 3.3Å; E354-N356 PolarHBondContact O-N 3.38Å
355	E	43.2	Very low	41.4	Very low	180 Å²	180	155.4 Å²	155.4	84%	0.841	82%	0.821	S	S	*	*			trans	-66.9	90.5	164.1	-70.6	-174.9	139.7	0	0	108.6	V353 D357	V353-E355 PolarHBondContact O-N 2.9Å; V353-E355 VanDerWaalsContact O-N 3.07Å; E355-D357 PolarHBondContact O-N 2.7Å
356	N	39.7	Very low	41	Very low	150 Å²	150	153.6 Å²	153.6	80%	0.802	82%	0.819	S	S	*	*			trans	-86.8	53.3	-175.6	-155.4	12.2	0	0	0	112.1	E354 D358	E354-N356 VanDerWaalsContact C-N 3.3Å; E354-N356 PolarHBondContact O-N 3.38Å; N356-D358 PolarHBondContact O-N 2.71Å
357	D	44.6	Very low	41.2	Very low	155 Å²	155	150.9 Å²	150.9	83%	0.829	81%	0.813	S	S	*	*			trans	-83.6	93.9	164.5	-93.1	-20.6	0	0	0	108.5	E355	E355-D357 PolarHBondContact O-N 2.7Å
358	D	44.9	Very low	41.2	Very low	139 Å²	139	153.5 Å²	153.5	74%	0.743	82%	0.821	S	S	*	*				-169.1	151	113.1	-121.2	-25	0	0	0	116.8	N356	N356-D358 PolarHBondContact O-N 2.71Å
359	L	43.7	Very low	41.8	Very low	129 Å²	129	155.1 Å²	155.1	68%	0.675	82%	0.822	S	S	*	*			trans	77	94.8	150.3	-103.9	63.4	0	0	0	124.5
360	F	41	Very low	42.1	Very low	197 Å²	197	159.3 Å²	159.3	86%	0.864	83%	0.834	S	S	*	*				46.5	116.3	126.8	-76.1	-116.6	0	0	0	119.8
361	C	42.5	Very low	42.3	Very low	197 Å²	197	164.8 Å²	164.8	100%	1.331	85%	0.847	S	S	*	*				-164.2	0	91.8	-158.8	0	0	0	0	113.1

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