A0A077Z0P7_TRITR Loading...

Kazal type serine protease inhibitor

AlphaFold DB , UniProt , Accession A0A077Z0P7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 271 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.5	Very low	40.3	Very low	254 Å²	254	172.8 Å²	172.8	100%	1.251	86%	0.864	S	S	*	*				0	125.7	0	-78.2	168.8	146.1	0	0	108
2	G	47.5	Very low	40.7	Very low	85 Å²	85	166.1 Å²	166.1	88%	0.876	86%	0.856	S	S	*	*			trans	105.2	66.3	166.5	0	0	0	0	0	116.5
3	D	34.2	Very low	40.7	Very low	136 Å²	136	161.9 Å²	161.9	73%	0.727	85%	0.85	S	S	*	*			trans	-76.7	138.1	165.3	-162	0.5	0	0	0	109.5
4	M	46.1	Very low	41.3	Very low	196 Å²	196	157.9 Å²	157.9	97%	0.966	85%	0.852	S	S	*	*			trans	-144.9	91.2	161.2	-82.1	-151.6	-158.7	0	0	111.1
5	R	36.6	Very low	41.6	Very low	217 Å²	217	162.7 Å²	162.7	82%	0.819	85%	0.853	S	S	*	*			trans	-72.8	148.7	152.7	-70.3	174.7	170.2	-174.8	-2.7	110.8
6	C	35.9	Very low	41.8	Very low	105 Å²	105	161.9 Å²	161.9	71%	0.709	85%	0.849	S	S	*	*			trans	160.3	145.8	137.8	-86.2	0	0	0	0	108.2
7	R	40.8	Very low	41.8	Very low	229 Å²	229	163.5 Å²	163.5	86%	0.864	85%	0.847	S	S	*	*			cis	-166.7	147.8	-1.2	-112.1	168	-161.6	-136.6	4.6	106.6
8	L	37.1	Very low	42.3	Very low	157 Å²	157	164.2 Å²	164.2	82%	0.822	85%	0.85	S	S	*	*			trans	-60	149.4	165.4	-78.6	140.2	0	0	0	112.1
9	L	43.9	Very low	42.7	Very low	169 Å²	169	161.1 Å²	161.1	89%	0.885	84%	0.844	S	S	*	*			trans	-135.1	138.9	149	-91.7	171.2	0	0	0	111.4
10	H	38.1	Very low	42.7	Very low	158 Å²	158	160 Å²	160	73%	0.731	84%	0.838	S	S	*	*			trans	-82.2	-177.7	-171	-99.6	-108.6	0	0	0	113.9
11	F	43.1	Very low	42.9	Very low	195 Å²	195	160.8 Å²	160.8	86%	0.855	84%	0.835	S	S	*	*			trans	106.9	135.1	157.8	-63.8	-73.2	0	0	0	114
12	A	44.6	Very low	43.4	Very low	92 Å²	92	154.6 Å²	154.6	76%	0.76	81%	0.811	S	S	*	*			cis	-160.9	166.6	-7.9	0	0	0	0	0	108.4
13	S	40.8	Very low	43.2	Very low	112 Å²	112	156.6 Å²	156.6	78%	0.783	81%	0.806	S	S	*	*			trans	-79.1	157.9	-172.4	54.9	0	0	0	0	115.1
14	A	49	Very low	44	Very low	106 Å²	106	157.7 Å²	157.7	88%	0.876	81%	0.811	S	S	*	*			trans	-147.3	131.2	147.2	0	0	0	0	0	110.4
15	R	45.6	Very low	44.2	Very low	230 Å²	230	152.4 Å²	152.4	87%	0.868	79%	0.793	S	S	*	*			trans	-93.3	158.6	-174.5	-64.4	173.9	169.9	-177.7	-3.7	111.3
16	L	45.9	Very low	45	Very low	150 Å²	150	149.9 Å²	149.9	79%	0.785	80%	0.795	S	S	*	*				-177.9	109.2	122.3	-118.7	72.9	0	0	0	110.2
17	K	41.8	Very low	45.8	Very low	189 Å²	189	150 Å²	150	82%	0.822	80%	0.795	S	S	*	*				84	103.8	96.2	-80.2	-170.9	-175.4	179.1	0	115
18	I	49.6	Very low	46.4	Very low	176 Å²	176	145.2 Å²	145.2	90%	0.903	79%	0.791	S	S	*	*			trans	-129	133.9	148.5	-62.8	176.3	0	0	0	107
19	S	51.2	Low	46.7	Very low	104 Å²	104	142.7 Å²	142.7	73%	0.727	79%	0.786	S	S	*	*			trans	-89.8	124.9	-169.3	-172.1	0	0	0	0	112.8
20	L	41.5	Very low	46.9	Very low	139 Å²	139	142.5 Å²	142.5	73%	0.728	79%	0.785	S	S	*	*			trans	12.4	159.2	140.4	-116.8	83	0	0	0	124
21	F	47	Very low	47.2	Very low	177 Å²	177	138.8 Å²	138.8	78%	0.776	78%	0.782	S	S	*	*			trans	115	121.6	153.4	-73.2	-65.3	0	0	0	113.3
22	V	50.3	Low	47.4	Very low	125 Å²	125	136.4 Å²	136.4	76%	0.758	78%	0.778	S	S	*	*			cis	-154.7	154.5	13.9	153.9	0	0	0	0	109.4
23	V	44.9	Very low	47.4	Very low	127 Å²	127	138.9 Å²	138.9	77%	0.77	78%	0.777	S	S	*	*			trans	-81.5	152.9	-176.3	-176.9	0	0	0	0	112.5
24	L	49.9	Very low	47.4	Very low	158 Å²	158	143.4 Å²	143.4	83%	0.827	78%	0.783	S	S	*	*			trans	-169.5	100.3	141.3	-94.3	152.7	0	0	0	108.5
25	S	51.4	Low	47.5	Very low	85 Å²	85	143.8 Å²	143.8	59%	0.594	78%	0.777	S	S	*	*				61.4	130.5	111.9	60.6	0	0	0	0	115.3
26	L	53.7	Low	47.6	Very low	164 Å²	164	139.1 Å²	139.1	86%	0.859	78%	0.776	S	S	*	*			cis	-173.4	-178.6	22.2	-109.2	169.5	0	0	0	107.4
27	P	52.5	Low	47.7	Very low	107 Å²	107	135.5 Å²	135.5	70%	0.695	78%	0.775	S	S	*	*			trans	-120.3	-167.5	-130.3	38.5	-18.9	0	0	0	115.6
28	V	51.8	Low	47.8	Very low	129 Å²	129	135.5 Å²	135.5	78%	0.782	78%	0.78	S	S	*	*			trans	120.7	98.2	153.7	-172.1	0	0	0	0	115.3
29	S	44	Very low	47.3	Very low	104 Å²	104	133.9 Å²	133.9	73%	0.727	77%	0.773	S	S	*	*			trans	1	135.4	139.3	-48.9	0	0	0	0	119.5
30	L	47.3	Very low	46.7	Very low	165 Å²	165	139.6 Å²	139.6	86%	0.864	78%	0.781	S	S	*	*				-167.4	142.3	96.1	-144.3	67.2	0	0	0	111.2
31	A	45.6	Very low	46.3	Very low	81 Å²	81	139.3 Å²	139.3	67%	0.669	78%	0.779	S	S	*	*			trans	-77.9	-166.6	-177.7	0	0	0	0	0	112.6
32	L	48	Very low	45.6	Very low	145 Å²	145	139.2 Å²	139.2	76%	0.759	78%	0.781	S	S	*	*			trans	102.9	124.1	162.1	-57	-175.4	0	0	0	112.9
33	L	43.2	Very low	44.7	Very low	143 Å²	143	138 Å²	138	75%	0.749	78%	0.778	S	S	*	*			cis	-160.3	143	15.4	-84.2	128.1	0	0	0	109.8
34	F	41	Very low	44.3	Very low	208 Å²	208	137.3 Å²	137.3	91%	0.912	77%	0.774	S	S	*	*			trans	-121.8	130.6	152.3	-84.5	-83.4	0	0	0	107.4
35	P	51.9	Low	44	Very low	113 Å²	113	136.8 Å²	136.8	73%	0.734	77%	0.772	S	S	*	*			trans	-108.3	166.3	166.2	27.6	-11.4	0	0	0	113.5
36	P	47.2	Very low	43.2	Very low	133 Å²	133	143.4 Å²	143.4	86%	0.864	79%	0.786	S	S	*	*			trans	-116.7	-178.2	-150.5	40	-25.8	0	0	0	114.5
37	G	48.1	Very low	42.8	Very low	74 Å²	74	147.1 Å²	147.1	76%	0.763	79%	0.789	S	S	*	*			trans	119.5	140.9	166.2	0	0	0	0	0	112.9
38	M	44.1	Very low	42	Very low	188 Å²	188	145.4 Å²	145.4	93%	0.926	79%	0.791	S	S	*	*			cis	-155.9	154.8	14.8	-110.9	-156	-100	0	0	110.7
39	D	38.9	Very low	41.2	Very low	142 Å²	142	142.3 Å²	142.3	76%	0.759	79%	0.785	S	S	*	*			trans	-61.9	154.5	171.5	-53.6	-70.6	0	0	0	114.1
40	Y	37.7	Very low	41.6	Very low	225 Å²	225	145.1 Å²	145.1	88%	0.882	79%	0.792	S	S	*	*				-173.6	149.5	109.3	-123	-100.3	0	0	0	113.9
41	L	33.6	Very low	41	Very low	132 Å²	132	142.8 Å²	142.8	69%	0.691	78%	0.784	S	S	*	*			trans	-79.1	155.7	-174.1	-78	152.8	0	0	0	114.6
42	Q	33.2	Very low	40.6	Very low	176 Å²	176	148.3 Å²	148.3	82%	0.822	79%	0.794	S	S	*	*			trans	26.7	124.8	137.6	-62.5	176.8	-43	0	0	120.1
43	S	31.1	Very low	39.9	Very low	98 Å²	98	152.4 Å²	152.4	69%	0.685	80%	0.799	S	S	*	*			trans	178.1	102.5	139.1	169.3	0	0	0	0	107.7
44	T	37	Very low	39.6	Very low	113 Å²	113	152.4 Å²	152.4	69%	0.693	80%	0.8	S	S	*	*				45.1	115.5	107.4	58.6	0	0	0	0	114.3
45	N	43.8	Very low	39.7	Very low	148 Å²	148	151.2 Å²	151.2	79%	0.791	80%	0.797	S	S	*	*				169.5	111	122.5	-75.4	-19.1	0	0	0	109.6
46	Y	33.4	Very low	39	Very low	223 Å²	223	151 Å²	151	88%	0.875	79%	0.794	S	S	*	*			trans	-111.8	105.2	175.5	-160.7	-93.1	0	0	0	107.5
47	W	45.4	Very low	38.5	Very low	242 Å²	242	152.5 Å²	152.5	92%	0.917	79%	0.794	S	S	*	*			trans	-146.1	122.9	163.1	-63.8	98.7	0	0	0	103.1
48	G	36.5	Very low	38.2	Very low	72 Å²	72	153.4 Å²	153.4	74%	0.742	79%	0.789	S	S	*	*				103.1	103.8	52.8	0	0	0	0	0	107.3
49	G	34.6	Very low	38.4	Very low	64 Å²	64	153.1 Å²	153.1	66%	0.66	79%	0.786	S	S	*	*			trans	86.2	141.9	174.1	0	0	0	0	0	114.6
50	D	51.1	Low	38.3	Very low	163 Å²	163	151.5 Å²	151.5	87%	0.872	78%	0.78	S	S	*	*			cis	-152.9	151	10.7	-58.3	-47.6	0	0	0	108.7	F52	D50-F52 PolarHBondContact O-N 2.9Å
51	V	36	Very low	38.4	Very low	116 Å²	116	147.9 Å²	147.9	70%	0.703	78%	0.776	S	S	*	*			trans	-78	114.5	175.8	173.9	0	0	0	0	108.8
52	F	37.4	Very low	38.5	Very low	197 Å²	197	146.8 Å²	146.8	86%	0.864	78%	0.775	S	S	*	*			trans	-121.3	117.5	158.1	-124.6	-94	0	0	0	108.7	D50 D54	D50-F52 PolarHBondContact O-N 2.9Å; F52-D54 PolarHBondContact O-N 2.66Å
53	W	31.9	Very low	38.7	Very low	230 Å²	230	143.9 Å²	143.9	87%	0.871	77%	0.771	S	S	*	*			trans	-77.2	116.2	171.2	-70.1	93.1	0	0	0	107.5
54	D	38.3	Very low	39.4	Very low	143 Å²	143	146.9 Å²	146.9	77%	0.765	77%	0.772	S	S	*	*			trans	-126.9	132.4	158	-149.5	-6.1	0	0	0	110.8	F52 T56	F52-D54 PolarHBondContact O-N 2.66Å; D54-T56 VanDerWaalsContact C-N 3.31Å; D54-T56 PolarHBondContact O-N 3.33Å; D54-T56 VanDerWaalsContact O-N 3.11Å
55	Q	41.8	Very low	40.1	Very low	184 Å²	184	150.2 Å²	150.2	86%	0.86	78%	0.777	S	S	*	*			trans	-85.3	57.7	-167.7	-70.9	179.1	-18.9	0	0	111.2
56	T	37.7	Very low	40.7	Very low	109 Å²	109	151.8 Å²	151.8	67%	0.669	78%	0.779	S	S	*	*			trans	-153.7	93.4	167.9	54.9	0	0	0	0	110.3	D54	D54-T56 VanDerWaalsContact C-N 3.31Å; D54-T56 PolarHBondContact O-N 3.33Å; D54-T56 VanDerWaalsContact O-N 3.11Å
57	N	36.1	Very low	42.5	Very low	163 Å²	163	144 Å²	144	87%	0.872	75%	0.753	S	S	*	*			trans	-152.7	73.2	149.8	-96	-25.5	0	0	0	107.4	E59	N57-E59 VanDerWaalsContact C-N 3.29Å; N57-E59 PolarHBondContact O-N 3.11Å; N57-E59 VanDerWaalsContact O-N 3.11Å
58	S	43	Very low	44.3	Very low	93 Å²	93	140.3 Å²	140.3	65%	0.65	74%	0.743	S	S	*	*			trans	-51	109.7	137.1	-171.6	0	0	0	0	104.9	V60	S58-V60 PolarHBondContact O-N 3.33Å
59	E	47.3	Very low	46.8	Very low	183 Å²	183	138.5 Å²	138.5	86%	0.855	72%	0.719	S	S	*	*			trans	-58.3	88.3	148.5	-81.9	-178.4	164.7	0	0	104.3	N57 L61	N57-E59 VanDerWaalsContact C-N 3.29Å; N57-E59 PolarHBondContact O-N 3.11Å; N57-E59 VanDerWaalsContact O-N 3.11Å; E59-L61 PolarHBondContact O-N 3.27Å
60	V	37.8	Very low	49.5	Very low	107 Å²	107	143.9 Å²	143.9	65%	0.648	73%	0.727	S	S	*	*			trans	-56.6	93.3	158.4	176	0	0	0	0	102.8	S58 T62	S58-V60 PolarHBondContact O-N 3.33Å; V60-T62 PolarHBondContact O-N 3.45Å
61	L	39.6	Very low	51.5	Low	149 Å²	149	137.7 Å²	137.7	78%	0.78	70%	0.696	S	S	*	*			trans	-50	96.7	150.6	-79	159.3	0	0	0	103.7	E59	E59-L61 PolarHBondContact O-N 3.27Å
62	T	36.4	Very low	54.2	Low	110 Å²	110	136.8 Å²	136.8	68%	0.675	69%	0.69	S	S	*	*			trans	-44.3	131.9	164.8	44.5	0	0	0	0	106	V60 K64	V60-T62 PolarHBondContact O-N 3.45Å; T62-K64 PolarHBondContact O-N 2.93Å
63	P	35.7	Very low	56.8	Low	115 Å²	115	133.5 Å²	133.5	75%	0.747	69%	0.692	S	S	*	*			trans	-55.6	112.2	-171.2	-14.1	22.2	0	0	0	107.1	K65	P63-K65 VanDerWaalsContact C-N 3.34Å; P63-K65 PolarHBondContact O-N 2.76Å
64	K	47.2	Very low	59.8	Low	161 Å²	161	127 Å²	127	70%	0.7	67%	0.671	S	S	*	*			trans	-48.7	112.1	161.6	-84.7	-177.1	174.3	-178.4	0	103.7	T62 E66	T62-K64 PolarHBondContact O-N 2.93Å; K64-E66 WeakPolarHBondContact O-CA 3.45Å; K64-E66 PolarHBondContact O-N 3.4Å
65	K	50.2	Low	62.5	Low	183 Å²	183	127.2 Å²	127.2	80%	0.796	66%	0.662	S	S	*	*			trans	-25.6	105.3	173.6	178.4	178.6	-178.1	177	0	107.9	P63 L67	P63-K65 VanDerWaalsContact C-N 3.34Å; P63-K65 PolarHBondContact O-N 2.76Å; K65-L67 PolarHBondContact O-N 2.94Å
66	E	57.9	Low	65.2	Low	180 Å²	180	124.3 Å²	124.3	84%	0.841	65%	0.647	S	S	*	*			trans	-54.6	110.4	-173	-80.3	-164.9	163.5	0	0	106.3	K64 F68	K64-E66 WeakPolarHBondContact O-CA 3.45Å; K64-E66 PolarHBondContact O-N 3.4Å; E66-F68 PolarHBondContact O-N 2.73Å
67	L	69.6	Low	68	Low	61 Å²	61	120 Å²	120	32%	0.319	62%	0.621	S	S	.	*			trans	-72.7	104.8	-174.4	-178.7	67.8	0	0	0	105.7	K65 C69 C97	K65-L67 PolarHBondContact O-N 2.94Å; L67-C69 PolarHBondContact O-N 2.03Å; L67-C69 PolarHBondContact O-SG 3.07Å; L67-C97 HydrophobicContact CD2-CB 4.21Å; L67-C97 WeakPolarHBondContact CD2-O 3.41Å; L67-C97 WeakPolarHBondContact CD2-SG 3.38Å; L67-C97 VanDerWaalsContact CG-SG 3.53Å
68	F	84.9	Confident	70.9	Confident	163 Å²	163	112.7 Å²	112.7	72%	0.715	58%	0.582	S	S	*	*			trans	-67.8	101.4	178	-174.2	-103.1	0	0	0	109.2	E66 Q70	E66-F68 PolarHBondContact O-N 2.73Å; F68-Q70 HydrophobicContact CD1-CG 4.09Å; F68-Q70 HydrophobicContact CE1-CG 3.55Å; F68-Q70 HydrophobicContact CZ-CG 4.4Å
69	C	87.3	Confident	73.5	Confident	34 Å²	34	108.5 Å²	108.5	23%	0.23	55%	0.553	C	S	.	*			trans	-97.9	113.9	178.9	-57.4	0	0	0	0	109.1	L67 C71 L94 C97	L67-C69 PolarHBondContact O-N 2.03Å; L67-C69 PolarHBondContact O-SG 3.07Å; C69-C71 PolarHBondContact O-N 3.2Å; C69-L94 HydrophobicContact CB-CD2 4.1Å; C69-C97 VanDerWaalsContact CA-SG 3.5Å; C69-C97 HydrophobicContact CB-CB 3.79Å; C69-C97 WeakPolarHBondContact CB-SG 2.92Å; C69-C97 WeakPolarHBondContact SG-CB 3.35Å; C69-C97 CovalentContact SG-SG 2.02Å; C69-C97 PolarHBondContact SG-SG 3.22Å
70	Q	91.7	Very high	75.9	Confident	178 Å²	178	99.8 Å²	99.8	83%	0.832	51%	0.512	S	S	*	.			trans	-76.4	68.3	169.7	-65	177.2	14.1	0	0	109.6	F68	F68-Q70 HydrophobicContact CD1-CG 4.09Å; F68-Q70 HydrophobicContact CE1-CG 3.55Å; F68-Q70 HydrophobicContact CZ-CG 4.4Å
71	C	93.5	Very high	78.6	Confident	32 Å²	32	96.9 Å²	96.9	22%	0.216	50%	0.496	C	S	.	.			trans	-113.5	148.2	179.6	-63.1	0	0	0	0	110.3	C69 C93 L94	C69-C71 PolarHBondContact O-N 3.2Å; C71-C93 VanDerWaalsContact CA-SG 3.5Å; C71-C93 HydrophobicContact CB-CB 3.74Å; C71-C93 WeakPolarHBondContact CB-SG 3.14Å; C71-C93 WeakPolarHBondContact SG-CB 3.34Å; C71-C93 CovalentContact SG-SG 2.04Å; C71-C93 PolarHBondContact SG-SG 2.9Å; C71-L94 HydrophobicContact CB-CD2 3.77Å; C71-L94 HydrophobicContact CB-CG 4.03Å; C71-L94 PolarHBondContact SG-N 2.88Å
72	T	93.7	Very high	81.1	Confident	97 Å²	97	93.4 Å²	93.4	60%	0.595	48%	0.477	S	S	*	.			trans	-68.3	157	170.3	58.6	0	0	0	0	110.5	E74 N91	T72-E74 PolarHBondContact O-N 3.5Å; T72-N91 PolarHBondContact O-ND2 3Å
73	S	91.2	Very high	83.6	Confident	128 Å²	128	92 Å²	92	90%	0.895	48%	0.484	S	S	*	.			trans	-82.3	18.3	174.9	54.5	0	0	0	0	113.4	Y75	S73-Y75 PolarHBondContact O-N 3.05Å
74	E	94.5	Very high	86	Confident	94 Å²	94	95.6 Å²	95.6	44%	0.439	49%	0.488	S	S	.	.			trans	-67.3	130.9	179.4	-176.5	176.8	-143.9	0	0	110.8	T72 K76 N91	T72-E74 PolarHBondContact O-N 3.5Å; E74-K76 HydrophobicContact CG-CD 4.2Å; E74-K76 HydrophobicContact CG-CG 4.09Å; E74-K76 PolarHBondContact O-N 3.46Å; E74-K76 WeakPolarHBondContact OE1-CE 3.49Å; E74-K76 IonicContact OE1-NZ 3.46Å; E74-K76 PolarHBondContact OE1-NZ 3.26Å; E74-K76 WeakPolarHBondContact OE2-CD 3.44Å; E74-K76 WeakPolarHBondContact OE2-CE 3.39Å; E74-K76 IonicContact OE2-NZ 3.45Å; E74-K76 PolarHBondContact OE2-NZ 2.94Å; E74-N91 WeakPolarHBondContact O-CB 3.4Å; E74-N91 PolarHBondContact O-ND2 3.34Å
75	Y	95.9	Very high	88.1	Confident	147 Å²	147	94.5 Å²	94.5	58%	0.576	49%	0.485	S	S	*	.			trans	-92.2	91.7	177.3	-168.9	-105	0	0	0	111.5	S73 P77 D90	S73-Y75 PolarHBondContact O-N 3.05Å; Y75-P77 HydrophobicContact CD1-CG 4.29Å; Y75-P77 HydrophobicContact CE1-CB 4.35Å; Y75-P77 HydrophobicContact CE1-CG 3.67Å; Y75-P77 HydrophobicContact CE2-CB 4.17Å; Y75-P77 HydrophobicContact CE2-CG 4.36Å; Y75-D90 CarbonylContact C-O 3.57Å; Y75-D90 HydrophobicContact CD2-CB 3.91Å; Y75-D90 HydrophobicContact CE2-CB 4.31Å; Y75-D90 WeakPolarHBondContact CE2-OD1 3.47Å
76	K	97	Very high	90.1	Very high	124 Å²	124	88.2 Å²	88.2	54%	0.539	46%	0.464	S	S	.	.			trans	-127.7	74.2	171.5	-77.3	178	178	152.2	0	108.4	E74 D90 N91	E74-K76 HydrophobicContact CG-CD 4.2Å; E74-K76 HydrophobicContact CG-CG 4.09Å; E74-K76 PolarHBondContact O-N 3.46Å; E74-K76 WeakPolarHBondContact OE1-CE 3.49Å; E74-K76 IonicContact OE1-NZ 3.46Å; E74-K76 PolarHBondContact OE1-NZ 3.26Å; E74-K76 WeakPolarHBondContact OE2-CD 3.44Å; E74-K76 WeakPolarHBondContact OE2-CE 3.39Å; E74-K76 IonicContact OE2-NZ 3.45Å; E74-K76 PolarHBondContact OE2-NZ 2.94Å; K76-D90 CarbonylContact C-O 3.01Å; K76-D90 WeakPolarHBondContact CA-O 3.43Å; K76-D90 PolarHBondContact N-O 2.89Å; K76-N91 WeakPolarHBondContact O-CA 3.47Å
77	P	97.7	Very high	91.8	Very high	19 Å²	19	84.4 Å²	84.4	12%	0.123	45%	0.449	C	S	.	.			trans	-64.6	147.3	-161.4	24.3	-35	0	0	0	112	Y75 T88 Y89 D90 G111	Y75-P77 HydrophobicContact CD1-CG 4.29Å; Y75-P77 HydrophobicContact CE1-CB 4.35Å; Y75-P77 HydrophobicContact CE1-CG 3.67Å; Y75-P77 HydrophobicContact CE2-CB 4.17Å; Y75-P77 HydrophobicContact CE2-CG 4.36Å; P77-T88 HydrophobicContact CB-CG2 3.79Å; P77-Y89 CarbonylContact C-O 3.19Å; P77-Y89 WeakPolarHBondContact CA-O 3.18Å; P77-D90 WeakPolarHBondContact CA-O 3.45Å; P77-G111 CarbonylContact O-C 3.52Å; P77-G111 WeakPolarHBondContact O-CA 3.45Å; P77-G111 PolarHBondContact O-N 3.37Å
78	V	97.7	Very high	93.2	Very high	9 Å²	9	83.7 Å²	83.7	6%	0.055	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	140.6	173.3	-64.3	0	0	0	0	109.8	T88 Y89 L95 Y107 G111	V78-T88 WeakPolarHBondContact O-CA 3.32Å; V78-Y89 PolarHBondContact N-O 2.81Å; V78-Y89 PolarHBondContact O-N 3.02Å; V78-L95 HydrophobicContact CG2-CB 3.95Å; V78-L95 HydrophobicContact CG2-CD2 3.72Å; V78-L95 HydrophobicContact CG2-CG 4.49Å; V78-Y107 HydrophobicContact CB-CD2 4.39Å; V78-Y107 HydrophobicContact CB-CE2 3.95Å; V78-Y107 HydrophobicContact CG1-CE2 3.95Å; V78-G111 CarbonylContact C-O 3.39Å
79	C	97.8	Very high	93.7	Very high	4 Å²	4	77.2 Å²	77.2	3%	0.027	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	128.9	173.3	-175.7	0	0	0	0	109.6	G108 Y109 G111 C113	C79-G108 VanDerWaalsContact O-CA 3.23Å; C79-G108 WeakPolarHBondContact O-CA 3.13Å; C79-G108 PolarHBondContact O-N 2.89Å; C79-Y109 HydrophobicContact CB-CD1 4.3Å; C79-Y109 HydrophobicContact CB-CD2 3.73Å; C79-Y109 HydrophobicContact CB-CE1 4.03Å; C79-Y109 HydrophobicContact CB-CE2 3.42Å; C79-Y109 VanDerWaalsContact CB-CE2 3.42Å; C79-Y109 HydrophobicContact CB-CG 4.2Å; C79-Y109 PolarHBondContact N-O 3.35Å; C79-Y109 PolarHBondContact O-N 2.97Å; C79-G111 PolarHBondContact N-O 3.2Å; C79-C113 WeakPolarHBondContact CA-SG 3.32Å; C79-C113 HydrophobicContact CB-CB 3.96Å; C79-C113 WeakPolarHBondContact CB-SG 3.23Å; C79-C113 WeakPolarHBondContact SG-CA 3.03Å; C79-C113 WeakPolarHBondContact SG-CB 2.93Å; C79-C113 CovalentContact SG-SG 2.04Å; C79-C113 PolarHBondContact SG-SG 3.21Å
80	A	96.5	Very high	94.1	Very high	0 Å²	0	79.5 Å²	79.5	0%	0	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	157.9	169.8	0	0	0	0	0	110.5	S86 L87 Y89 L95 L105 L106	A80-S86 CarbonylContact O-C 3.52Å; A80-S86 VanDerWaalsContact O-CA 3.23Å; A80-S86 WeakPolarHBondContact O-CA 2.99Å; A80-L87 PolarHBondContact N-O 3Å; A80-L87 PolarHBondContact O-N 3.12Å; A80-Y89 HydrophobicContact CB-CD2 4.03Å; A80-Y89 HydrophobicContact CB-CE2 3.98Å; A80-L95 HydrophobicContact CB-CD1 3.42Å; A80-L95 VanDerWaalsContact CB-CD1 3.42Å; A80-L95 HydrophobicContact CB-CD2 4Å; A80-L95 HydrophobicContact CB-CG 4.37Å; A80-L105 HydrophobicContact CB-CD1 3.72Å; A80-L105 HydrophobicContact CB-CG 4.18Å; A80-L106 CarbonylContact C-O 3.55Å; A80-L106 WeakPolarHBondContact CA-O 3.39Å; A80-L106 WeakPolarHBondContact CB-O 3.01Å
81	S	94.9	Very high	94.3	Very high	46 Å²	46	71.5 Å²	71.5	32%	0.322	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	144.4	-178.6	57.4	0	0	0	0	112.2	Q85 L106	S81-Q85 VanDerWaalsContact CA-O 3.3Å; S81-Q85 WeakPolarHBondContact CA-O 3.44Å; S81-Q85 WeakPolarHBondContact CB-O 3.41Å; S81-L106 PolarHBondContact N-O 2.87Å; S81-L106 PolarHBondContact O-N 2.9Å
82	M	92.5	Very high	94.5	Very high	77 Å²	77	74.4 Å²	74.4	38%	0.379	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	107.7	174.2	-176.2	-174.8	68.4	0	0	107.3	K84 Q85 I102 D104 L105	M82-K84 PolarHBondContact O-N 3.01Å; M82-K84 VanDerWaalsContact O-N 3.11Å; M82-Q85 PolarHBondContact N-O 2.66Å; M82-Q85 PolarHBondContact O-N 3.42Å; M82-I102 HydrophobicContact SD-CG2 3.65Å; M82-D104 HydrophobicContact CG-CB 4.26Å; M82-L105 HydrophobicContact CB-CD1 4.35Å
83	G	88.4	Confident	94.6	Very high	79 Å²	79	72.5 Å²	72.5	81%	0.814	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.8	-114.2	-173.2	0	0	0	0	0	113
84	K	86.9	Confident	94.8	Very high	192 Å²	192	68.7 Å²	68.7	84%	0.835	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	-4.5	-179.4	-68.8	179.2	-178.1	167.3	0	114.1	M82 K116	M82-K84 PolarHBondContact O-N 3.01Å; M82-K84 VanDerWaalsContact O-N 3.11Å; K84-K116 PolarHBondContact O-NZ 3.46Å
85	Q	89.8	Confident	94.8	Very high	137 Å²	137	64.2 Å²	64.2	64%	0.64	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101	151.3	-178.8	-63.3	-177.8	-3	0	0	110.5	S81 M82	S81-Q85 VanDerWaalsContact CA-O 3.3Å; S81-Q85 WeakPolarHBondContact CA-O 3.44Å; S81-Q85 WeakPolarHBondContact CB-O 3.41Å; M82-Q85 PolarHBondContact N-O 2.66Å; M82-Q85 PolarHBondContact O-N 3.42Å
86	S	93.1	Very high	94.8	Very high	51 Å²	51	59.9 Å²	59.9	36%	0.357	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	132.5	177.1	58.2	0	0	0	0	108.8	A80	A80-S86 CarbonylContact O-C 3.52Å; A80-S86 VanDerWaalsContact O-CA 3.23Å; A80-S86 WeakPolarHBondContact O-CA 2.99Å
87	L	94.5	Very high	94.7	Very high	100 Å²	100	54.2 Å²	54.2	52%	0.524	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	137.2	-178.6	-174.3	64.1	0	0	0	109.5	A80 Y89 C113	A80-L87 PolarHBondContact N-O 3Å; A80-L87 PolarHBondContact O-N 3.12Å; L87-Y89 HydrophobicContact CB-CE2 4.29Å; L87-Y89 HydrophobicContact CD2-CE1 4.45Å; L87-Y89 HydrophobicContact CD2-CE2 3.9Å; L87-Y89 HydrophobicContact CG-CE2 4.17Å; L87-C113 PolarHBondContact O-SG 3.18Å
88	T	97.2	Very high	94.5	Very high	47 Å²	47	54.6 Å²	54.6	29%	0.288	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	128	173.3	-57.5	0	0	0	0	108.7	P77 V78 P112 C113	P77-T88 HydrophobicContact CB-CG2 3.79Å; V78-T88 WeakPolarHBondContact O-CA 3.32Å; T88-P112 HydrophobicContact CG2-CB 3.94Å; T88-C113 WeakPolarHBondContact OG1-CB 3.5Å; T88-C113 PolarHBondContact OG1-N 3.38Å
89	Y	96.3	Very high	94.3	Very high	26 Å²	26	57.2 Å²	57.2	10%	0.102	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	142.3	169.8	-74.1	-89.7	0	0	0	109.1	P77 V78 A80 L87 N91 L94 L95 S98 L105	P77-Y89 CarbonylContact C-O 3.19Å; P77-Y89 WeakPolarHBondContact CA-O 3.18Å; V78-Y89 PolarHBondContact N-O 2.81Å; V78-Y89 PolarHBondContact O-N 3.02Å; A80-Y89 HydrophobicContact CB-CD2 4.03Å; A80-Y89 HydrophobicContact CB-CE2 3.98Å; L87-Y89 HydrophobicContact CB-CE2 4.29Å; L87-Y89 HydrophobicContact CD2-CE1 4.45Å; L87-Y89 HydrophobicContact CD2-CE2 3.9Å; L87-Y89 HydrophobicContact CG-CE2 4.17Å; Y89-N91 PolarHBondContact O-N 3.26Å; Y89-L94 HydrophobicContact CD1-CB 4.03Å; Y89-L95 HydrophobicContact CD1-CB 4.27Å; Y89-L95 HydrophobicContact CD2-CB 3.97Å; Y89-L95 HydrophobicContact CD2-CD1 3.76Å; Y89-L95 HydrophobicContact CD2-CG 4.37Å; Y89-L95 HydrophobicContact CE2-CD1 3.68Å; Y89-L95 HydrophobicContact CG-CB 3.8Å; Y89-L95 HydrophobicContact CG-CD1 4.41Å; Y89-S98 WeakPolarHBondContact CE1-OG 3.03Å; Y89-S98 VanDerWaalsContact OH-CB 3.24Å; Y89-S98 WeakPolarHBondContact OH-CB 3.07Å; Y89-S98 PolarHBondContact OH-OG 3.35Å; Y89-L105 HydrophobicContact CE2-CD1 4.31Å; Y89-L105 HydrophobicContact CE2-CD2 3.88Å; Y89-L105 WeakPolarHBondContact OH-CD2 3.32Å
90	D	96.4	Very high	94	Very high	83 Å²	83	66 Å²	66	44%	0.444	36%	0.357	S	S	.	.	S	Bend	trans	-64.5	-27.6	-177.5	-62.6	-24.7	0	0	0	112.5	Y75 K76 P77 L94	Y75-D90 CarbonylContact C-O 3.57Å; Y75-D90 HydrophobicContact CD2-CB 3.91Å; Y75-D90 HydrophobicContact CE2-CB 4.31Å; Y75-D90 WeakPolarHBondContact CE2-OD1 3.47Å; K76-D90 CarbonylContact C-O 3.01Å; K76-D90 WeakPolarHBondContact CA-O 3.43Å; K76-D90 PolarHBondContact N-O 2.89Å; P77-D90 WeakPolarHBondContact CA-O 3.45Å; D90-L94 HydrophobicContact CB-CD1 3.88Å
91	N	96.1	Very high	93.6	Very high	9 Å²	9	71.2 Å²	71.2	5%	0.048	39%	0.385	C	S	.	.	S	Bend	trans	-155.2	169.8	171.5	57.8	58	0	0	0	112.7	T72 E74 K76 Y89 C93 L94 L95	T72-N91 PolarHBondContact O-ND2 3Å; E74-N91 WeakPolarHBondContact O-CB 3.4Å; E74-N91 PolarHBondContact O-ND2 3.34Å; K76-N91 WeakPolarHBondContact O-CA 3.47Å; Y89-N91 PolarHBondContact O-N 3.26Å; N91-C93 VanDerWaalsContact C-N 3.28Å; N91-C93 PolarHBondContact O-N 3.25Å; N91-C93 WeakPolarHBondContact OD1-CB 3.37Å; N91-C93 PolarHBondContact OD1-N 3.49Å; N91-L94 PolarHBondContact O-N 2.89Å; N91-L94 WeakPolarHBondContact OD1-CG 3.49Å; N91-L94 PolarHBondContact OD1-N 3.37Å; N91-L95 PolarHBondContact O-N 3.02Å
92	L	96.5	Very high	93.4	Very high	94 Å²	94	70.9 Å²	70.9	49%	0.492	38%	0.379	S	S	.	.	H	α-helix	trans	-62.2	-33.3	-178.9	-172.6	62.6	0	0	0	112.8	L95 S96 Y107	L92-L95 HydrophobicContact CD1-CD2 4.2Å; L92-L95 PolarHBondContact O-N 3.22Å; L92-S96 PolarHBondContact O-N 2.04Å; L92-S96 PolarHBondContact O-OG 3.46Å; L92-Y107 HydrophobicContact CD1-CD2 4.17Å; L92-Y107 HydrophobicContact CD1-CE2 4.33Å
93	C	96.1	Very high	93.2	Very high	57 Å²	57	72.1 Å²	72.1	39%	0.385	40%	0.395	S	S	.	.	H	α-helix	trans	-62.3	-46.6	177.8	179.6	0	0	0	0	111.4	C71 N91 L95 S96 C97	C71-C93 VanDerWaalsContact CA-SG 3.5Å; C71-C93 HydrophobicContact CB-CB 3.74Å; C71-C93 WeakPolarHBondContact CB-SG 3.14Å; C71-C93 WeakPolarHBondContact SG-CB 3.34Å; C71-C93 CovalentContact SG-SG 2.04Å; C71-C93 PolarHBondContact SG-SG 2.9Å; N91-C93 VanDerWaalsContact C-N 3.28Å; N91-C93 PolarHBondContact O-N 3.25Å; N91-C93 WeakPolarHBondContact OD1-CB 3.37Å; N91-C93 PolarHBondContact OD1-N 3.49Å; C93-L95 VanDerWaalsContact C-N 3.31Å; C93-L95 PolarHBondContact O-N 2.9Å; C93-S96 PolarHBondContact O-N 3.3Å; C93-C97 VanDerWaalsContact O-CB 3.29Å; C93-C97 WeakPolarHBondContact O-CB 3.35Å; C93-C97 PolarHBondContact O-N 2.04Å
94	L	95.5	Very high	93.4	Very high	47 Å²	47	73.7 Å²	73.7	25%	0.246	39%	0.385	C	S	.	.	H	α-helix	trans	-63.8	-36.8	178.4	-67.9	171	0	0	0	112.3	C69 C71 Y89 D90 N91 S98	C69-L94 HydrophobicContact CB-CD2 4.1Å; C71-L94 HydrophobicContact CB-CD2 3.77Å; C71-L94 HydrophobicContact CB-CG 4.03Å; C71-L94 PolarHBondContact SG-N 2.88Å; Y89-L94 HydrophobicContact CD1-CB 4.03Å; D90-L94 HydrophobicContact CB-CD1 3.88Å; N91-L94 PolarHBondContact O-N 2.89Å; N91-L94 WeakPolarHBondContact OD1-CG 3.49Å; N91-L94 PolarHBondContact OD1-N 3.37Å; L94-S98 PolarHBondContact O-N 2Å; L94-S98 PolarHBondContact O-OG 2.86Å
95	L	95.4	Very high	93.7	Very high	0 Å²	0	64.9 Å²	64.9	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-62.4	-55.5	171.5	170.5	57.1	0	0	0	111	V78 A80 Y89 N91 L92 C93 C97 S98 Q99 L105 Y107	V78-L95 HydrophobicContact CG2-CB 3.95Å; V78-L95 HydrophobicContact CG2-CD2 3.72Å; V78-L95 HydrophobicContact CG2-CG 4.49Å; A80-L95 HydrophobicContact CB-CD1 3.42Å; A80-L95 VanDerWaalsContact CB-CD1 3.42Å; A80-L95 HydrophobicContact CB-CD2 4Å; A80-L95 HydrophobicContact CB-CG 4.37Å; Y89-L95 HydrophobicContact CD1-CB 4.27Å; Y89-L95 HydrophobicContact CD2-CB 3.97Å; Y89-L95 HydrophobicContact CD2-CD1 3.76Å; Y89-L95 HydrophobicContact CD2-CG 4.37Å; Y89-L95 HydrophobicContact CE2-CD1 3.68Å; Y89-L95 HydrophobicContact CG-CB 3.8Å; Y89-L95 HydrophobicContact CG-CD1 4.41Å; N91-L95 PolarHBondContact O-N 3.02Å; L92-L95 HydrophobicContact CD1-CD2 4.2Å; L92-L95 PolarHBondContact O-N 3.22Å; C93-L95 VanDerWaalsContact C-N 3.31Å; C93-L95 PolarHBondContact O-N 2.9Å; L95-C97 PolarHBondContact O-N 3.34Å; L95-S98 WeakPolarHBondContact O-CA 3.06Å; L95-S98 WeakPolarHBondContact O-CB 3.05Å; L95-S98 PolarHBondContact O-N 3.34Å; L95-Q99 HydrophobicContact CD1-CG 3.98Å; L95-Q99 HydrophobicContact CG-CG 4.48Å; L95-Q99 WeakPolarHBondContact O-CG 3.47Å; L95-Q99 PolarHBondContact O-N 3.17Å; L95-L105 HydrophobicContact CD1-CD2 3.61Å; L95-L105 HydrophobicContact CD1-CG 3.86Å; L95-Y107 HydrophobicContact CD2-CD2 3.69Å; L95-Y107 HydrophobicContact CD2-CG 4.39Å
96	S	94.6	Very high	94	Very high	56 Å²	56	63.5 Å²	63.5	39%	0.392	34%	0.344	S	S	.	.	H	α-helix	trans	-59.9	-33.8	-179.2	-64	0	0	0	0	112.6	L92 C93	L92-S96 PolarHBondContact O-N 2.04Å; L92-S96 PolarHBondContact O-OG 3.46Å; C93-S96 PolarHBondContact O-N 3.3Å
97	C	94.5	Very high	94.1	Very high	5 Å²	5	66.1 Å²	66.1	3%	0.034	35%	0.347	C	S	.	.	H	α-helix	trans	-61.3	-54.9	171.1	-166.9	0	0	0	0	110	L67 C69 C93 L95 Q99 R100	L67-C97 HydrophobicContact CD2-CB 4.21Å; L67-C97 WeakPolarHBondContact CD2-O 3.41Å; L67-C97 WeakPolarHBondContact CD2-SG 3.38Å; L67-C97 VanDerWaalsContact CG-SG 3.53Å; C69-C97 VanDerWaalsContact CA-SG 3.5Å; C69-C97 HydrophobicContact CB-CB 3.79Å; C69-C97 WeakPolarHBondContact CB-SG 2.92Å; C69-C97 WeakPolarHBondContact SG-CB 3.35Å; C69-C97 CovalentContact SG-SG 2.02Å; C69-C97 PolarHBondContact SG-SG 3.22Å; C93-C97 VanDerWaalsContact O-CB 3.29Å; C93-C97 WeakPolarHBondContact O-CB 3.35Å; C93-C97 PolarHBondContact O-N 2.04Å; L95-C97 PolarHBondContact O-N 3.34Å; C97-Q99 PolarHBondContact O-N 2.86Å; C97-Q99 VanDerWaalsContact O-N 3.17Å; C97-R100 VanDerWaalsContact O-CB 3.23Å; C97-R100 WeakPolarHBondContact O-CB 3.21Å; C97-R100 VanDerWaalsContact O-CG 3.29Å; C97-R100 WeakPolarHBondContact O-CG 3.41Å; C97-R100 PolarHBondContact O-N 3.37Å
98	S	93.2	Very high	94.2	Very high	27 Å²	27	62.5 Å²	62.5	19%	0.189	33%	0.333	C	S	.	.	H	α-helix	trans	-58.2	-32.9	180	-63.5	0	0	0	0	114	Y89 L94 L95 R100 N101 I102	Y89-S98 WeakPolarHBondContact CE1-OG 3.03Å; Y89-S98 VanDerWaalsContact OH-CB 3.24Å; Y89-S98 WeakPolarHBondContact OH-CB 3.07Å; Y89-S98 PolarHBondContact OH-OG 3.35Å; L94-S98 PolarHBondContact O-N 2Å; L94-S98 PolarHBondContact O-OG 2.86Å; L95-S98 WeakPolarHBondContact O-CA 3.06Å; L95-S98 WeakPolarHBondContact O-CB 3.05Å; L95-S98 PolarHBondContact O-N 3.34Å; S98-R100 PolarHBondContact O-N 3.44Å; S98-N101 PolarHBondContact O-N 3.21Å; S98-I102 PolarHBondContact O-N 3.21Å
99	Q	94	Very high	94.2	Very high	65 Å²	65	60.6 Å²	60.6	30%	0.304	32%	0.321	S	S	.	.	H	α-helix	trans	-64.3	-19.5	176.5	-71.3	177.9	-57.7	0	0	113.6	L95 C97 N101 I102 L105	L95-Q99 HydrophobicContact CD1-CG 3.98Å; L95-Q99 HydrophobicContact CG-CG 4.48Å; L95-Q99 WeakPolarHBondContact O-CG 3.47Å; L95-Q99 PolarHBondContact O-N 3.17Å; C97-Q99 PolarHBondContact O-N 2.86Å; C97-Q99 VanDerWaalsContact O-N 3.17Å; Q99-N101 PolarHBondContact O-N 3.27Å; Q99-I102 PolarHBondContact O-N 2.77Å; Q99-L105 HydrophobicContact CG-CB 4.19Å; Q99-L105 HydrophobicContact CG-CD2 3.99Å; Q99-L105 HydrophobicContact CG-CG 4.16Å; Q99-L105 WeakPolarHBondContact CG-O 3.41Å; Q99-L105 PolarHBondContact NE2-O 3.41Å
100	R	92	Very high	94.2	Very high	189 Å²	189	65.9 Å²	65.9	71%	0.713	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-29.5	174.6	-62.9	174.9	-177	179.1	-0.3	112.8	C97 S98	C97-R100 VanDerWaalsContact O-CB 3.23Å; C97-R100 WeakPolarHBondContact O-CB 3.21Å; C97-R100 VanDerWaalsContact O-CG 3.29Å; C97-R100 WeakPolarHBondContact O-CG 3.41Å; C97-R100 PolarHBondContact O-N 3.37Å; S98-R100 PolarHBondContact O-N 3.44Å
101	N	89	Confident	94.2	Very high	108 Å²	108	62.5 Å²	62.5	58%	0.578	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.1	-10.2	-179	-69.8	-13.3	0	0	0	113.2	S98 Q99	S98-N101 PolarHBondContact O-N 3.21Å; Q99-N101 PolarHBondContact O-N 3.27Å
102	I	90.2	Very high	94.3	Very high	40 Å²	40	64.9 Å²	64.9	21%	0.205	35%	0.347	C	S	.	.			trans	-130.3	87.3	-176.1	-48.7	174.6	0	0	0	108.2	M82 S98 Q99 D104 L105	M82-I102 HydrophobicContact SD-CG2 3.65Å; S98-I102 PolarHBondContact O-N 3.21Å; Q99-I102 PolarHBondContact O-N 2.77Å; I102-D104 PolarHBondContact O-N 3.19Å; I102-L105 HydrophobicContact CB-CB 3.93Å; I102-L105 HydrophobicContact CG2-CB 3.68Å; I102-L105 WeakPolarHBondContact O-CB 3.48Å; I102-L105 PolarHBondContact O-N 3.41Å; I102-L105 VanDerWaalsContact O-N 3.14Å
103	S	87	Confident	94.3	Very high	102 Å²	102	61.5 Å²	61.5	71%	0.713	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-33.3	-178.5	54.7	0	0	0	0	113.2	L105	S103-L105 VanDerWaalsContact C-N 3.27Å; S103-L105 PolarHBondContact O-N 3.21Å
104	D	92.3	Very high	94.4	Very high	112 Å²	112	59 Å²	59	60%	0.599	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	1.2	-175	-62	-0.5	0	0	0	112.8	M82 I102 L106	M82-D104 HydrophobicContact CG-CB 4.26Å; I102-D104 PolarHBondContact O-N 3.19Å; D104-L106 PolarHBondContact O-N 3.15Å
105	L	94.3	Very high	94.2	Very high	7 Å²	7	66.3 Å²	66.3	4%	0.037	34%	0.338	C	S	.	.			trans	-81.7	109.2	176.2	-177.6	65.7	0	0	0	109.5	A80 M82 Y89 L95 Q99 I102 S103	A80-L105 HydrophobicContact CB-CD1 3.72Å; A80-L105 HydrophobicContact CB-CG 4.18Å; M82-L105 HydrophobicContact CB-CD1 4.35Å; Y89-L105 HydrophobicContact CE2-CD1 4.31Å; Y89-L105 HydrophobicContact CE2-CD2 3.88Å; Y89-L105 WeakPolarHBondContact OH-CD2 3.32Å; L95-L105 HydrophobicContact CD1-CD2 3.61Å; L95-L105 HydrophobicContact CD1-CG 3.86Å; Q99-L105 HydrophobicContact CG-CB 4.19Å; Q99-L105 HydrophobicContact CG-CD2 3.99Å; Q99-L105 HydrophobicContact CG-CG 4.16Å; Q99-L105 WeakPolarHBondContact CG-O 3.41Å; Q99-L105 PolarHBondContact NE2-O 3.41Å; I102-L105 HydrophobicContact CB-CB 3.93Å; I102-L105 HydrophobicContact CG2-CB 3.68Å; I102-L105 WeakPolarHBondContact O-CB 3.48Å; I102-L105 PolarHBondContact O-N 3.41Å; I102-L105 VanDerWaalsContact O-N 3.14Å; S103-L105 VanDerWaalsContact C-N 3.27Å; S103-L105 PolarHBondContact O-N 3.21Å
106	L	95.4	Very high	94.1	Very high	108 Å²	108	72.2 Å²	72.2	57%	0.565	36%	0.364	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.1	136.7	-176.1	-59.5	177.1	0	0	0	111.2	A80 S81 D104 G108	A80-L106 CarbonylContact C-O 3.55Å; A80-L106 WeakPolarHBondContact CA-O 3.39Å; A80-L106 WeakPolarHBondContact CB-O 3.01Å; S81-L106 PolarHBondContact N-O 2.87Å; S81-L106 PolarHBondContact O-N 2.9Å; D104-L106 PolarHBondContact O-N 3.15Å; L106-G108 PolarHBondContact O-N 3.31Å
107	Y	96.5	Very high	93.8	Very high	107 Å²	107	72.7 Å²	72.7	42%	0.42	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	134.3	168.6	173.7	-96.5	0	0	0	110.6	V78 L92 L95 E110	V78-Y107 HydrophobicContact CB-CD2 4.39Å; V78-Y107 HydrophobicContact CB-CE2 3.95Å; V78-Y107 HydrophobicContact CG1-CE2 3.95Å; L92-Y107 HydrophobicContact CD1-CD2 4.17Å; L92-Y107 HydrophobicContact CD1-CE2 4.33Å; L95-Y107 HydrophobicContact CD2-CD2 3.69Å; L95-Y107 HydrophobicContact CD2-CG 4.39Å; Y107-E110 WeakPolarHBondContact OH-CG 3.38Å; Y107-E110 PolarHBondContact OH-N 2.81Å
108	G	95.9	Very high	93.5	Very high	23 Å²	23	84.5 Å²	84.5	24%	0.237	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	-63.7	-178.6	0	0	0	0	0	113.3	C79 L106	C79-G108 VanDerWaalsContact O-CA 3.23Å; C79-G108 WeakPolarHBondContact O-CA 3.13Å; C79-G108 PolarHBondContact O-N 2.89Å; L106-G108 PolarHBondContact O-N 3.31Å
109	Y	97	Very high	93.1	Very high	8 Å²	8	84.8 Å²	84.8	3%	0.031	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.8	167.1	-178.7	49.1	-96	0	0	0	112.2	C79 C113 C114 E146 K149 K150	C79-Y109 HydrophobicContact CB-CD1 4.3Å; C79-Y109 HydrophobicContact CB-CD2 3.73Å; C79-Y109 HydrophobicContact CB-CE1 4.03Å; C79-Y109 HydrophobicContact CB-CE2 3.42Å; C79-Y109 VanDerWaalsContact CB-CE2 3.42Å; C79-Y109 HydrophobicContact CB-CG 4.2Å; C79-Y109 PolarHBondContact N-O 3.35Å; C79-Y109 PolarHBondContact O-N 2.97Å; Y109-C113 WeakPolarHBondContact OH-CA 3.49Å; Y109-C114 PolarHBondContact OH-N 3.11Å; Y109-C114 PolarHBondContact OH-SG 3.39Å; Y109-E146 HydrophobicContact CE1-CG 4.35Å; Y109-K149 HydrophobicContact CD1-CB 4.32Å; Y109-K149 HydrophobicContact CD2-CB 3.44Å; Y109-K149 VanDerWaalsContact CD2-CB 3.44Å; Y109-K149 HydrophobicContact CD2-CD 4.35Å; Y109-K149 HydrophobicContact CD2-CG 3.95Å; Y109-K149 HydrophobicContact CE2-CB 3.69Å; Y109-K149 HydrophobicContact CE2-CD 4.41Å; Y109-K149 HydrophobicContact CE2-CG 3.79Å; Y109-K149 HydrophobicContact CG-CB 3.77Å; Y109-K150 HydrophobicContact CD1-CD 4.13Å; Y109-K150 HydrophobicContact CD1-CG 3.57Å; Y109-K150 HydrophobicContact CE1-CG 4.42Å; Y109-K150 HydrophobicContact CG-CG 4.1Å
110	E	96.9	Very high	92.7	Very high	137 Å²	137	85.9 Å²	85.9	64%	0.64	42%	0.422	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72	139	172.8	-60.5	177.6	177.7	0	0	112.6	Y107	Y107-E110 WeakPolarHBondContact OH-CG 3.38Å; Y107-E110 PolarHBondContact OH-N 2.81Å
111	G	96.6	Very high	92.1	Very high	12 Å²	12	89 Å²	89	12%	0.124	43%	0.434	C	S	.	.	S	Bend	trans	96.2	173.5	-175.5	0	0	0	0	0	113.2	P77 V78 C79	P77-G111 CarbonylContact O-C 3.52Å; P77-G111 WeakPolarHBondContact O-CA 3.45Å; P77-G111 PolarHBondContact O-N 3.37Å; V78-G111 CarbonylContact C-O 3.39Å; C79-G111 PolarHBondContact N-O 3.2Å
112	P	97	Very high	91.3	Very high	59 Å²	59	87.8 Å²	87.8	38%	0.383	45%	0.447	S	S	.	.	S	Bend	trans	-66.2	151.2	177.9	29.5	-36.1	0	0	0	111.6	T88	T88-P112 HydrophobicContact CG2-CB 3.94Å
113	C	97.4	Very high	90.7	Very high	22 Å²	22	88.7 Å²	88.7	15%	0.149	45%	0.451	C	S	.	.	P	Polyproline II helix	trans	-60.8	140.1	176.2	-67.6	0	0	0	0	112.1	C79 L87 T88 Y109 R115	C79-C113 WeakPolarHBondContact CA-SG 3.32Å; C79-C113 HydrophobicContact CB-CB 3.96Å; C79-C113 WeakPolarHBondContact CB-SG 3.23Å; C79-C113 WeakPolarHBondContact SG-CA 3.03Å; C79-C113 WeakPolarHBondContact SG-CB 2.93Å; C79-C113 CovalentContact SG-SG 2.04Å; C79-C113 PolarHBondContact SG-SG 3.21Å; L87-C113 PolarHBondContact O-SG 3.18Å; T88-C113 WeakPolarHBondContact OG1-CB 3.5Å; T88-C113 PolarHBondContact OG1-N 3.38Å; Y109-C113 WeakPolarHBondContact OH-CA 3.49Å; C113-R115 PolarHBondContact O-N 3.43Å
114	C	96.7	Very high	90.2	Very high	6 Å²	6	92.6 Å²	92.6	4%	0.041	46%	0.455	C	S	.	.	P	Polyproline II helix	trans	-59	133.4	172.1	-63.1	0	0	0	0	111	Y109 F142 C145 E146	Y109-C114 PolarHBondContact OH-N 3.11Å; Y109-C114 PolarHBondContact OH-SG 3.39Å; C114-F142 HydrophobicContact CB-CD2 3.95Å; C114-F142 HydrophobicContact CB-CE2 3.84Å; C114-F142 VanDerWaalsContact O-CE2 3.32Å; C114-F142 WeakPolarHBondContact O-CE2 3.42Å; C114-C145 HydrophobicContact CB-CB 3.73Å; C114-C145 WeakPolarHBondContact CB-SG 3.41Å; C114-C145 WeakPolarHBondContact SG-CB 3.18Å; C114-C145 CovalentContact SG-SG 2.03Å; C114-C145 PolarHBondContact SG-SG 3.43Å; C114-E146 HydrophobicContact CB-CG 4.28Å; C114-E146 PolarHBondContact SG-N 2.94Å
115	R	93.2	Very high	89.8	Confident	199 Å²	199	89.1 Å²	89.1	75%	0.751	44%	0.438	S	S	*	.	P	Polyproline II helix	trans	-81.4	126.5	-179.3	-170.4	173.5	69.2	165.4	1.3	110.8	C113 L117	C113-R115 PolarHBondContact O-N 3.43Å; R115-L117 PolarHBondContact O-N 3.44Å
116	K	91.3	Very high	89.5	Confident	124 Å²	124	91.6 Å²	91.6	54%	0.539	45%	0.449	S	S	.	.			trans	-73.7	106.7	168.3	-67.2	179.6	-175	171.2	0	109	K84 F142	K84-K116 PolarHBondContact O-NZ 3.46Å; K116-F142 HydrophobicContact CB-CD2 4.42Å; K116-F142 HydrophobicContact CD-CE2 4.35Å; K116-F142 HydrophobicContact CG-CD2 3.56Å; K116-F142 HydrophobicContact CG-CE2 3.47Å; K116-F142 VanDerWaalsContact CG-CE2 3.47Å; K116-F142 HydrophobicContact CG-CG 4.3Å; K116-F142 HydrophobicContact CG-CZ 4.16Å
117	L	89.5	Confident	89.4	Confident	67 Å²	67	86.5 Å²	86.5	35%	0.351	42%	0.422	S	S	.	.			trans	-72.4	145.6	178	-60.3	176.2	0	0	0	111	R115 C119 C138 Q141	R115-L117 PolarHBondContact O-N 3.44Å; L117-C119 PolarHBondContact O-N 3.31Å; L117-C138 HydrophobicContact CB-CB 3.96Å; L117-C138 VanDerWaalsContact CB-SG 3.57Å; L117-Q141 VanDerWaalsContact CD1-OE1 3.29Å
118	R	87.6	Confident	89.3	Confident	252 Å²	252	81.5 Å²	81.5	95%	0.951	40%	0.402	S	S	*	.			trans	-84	102.1	170.5	-66.5	-177.3	178.2	171.3	-0.1	108.3
119	C	85.7	Confident	89.2	Confident	33 Å²	33	83.9 Å²	83.9	22%	0.223	42%	0.416	C	S	.	.	P	Polyproline II helix	trans	-85.2	158	171.1	-98.3	0	0	0	0	111.4	L117 E123 C138	L117-C119 PolarHBondContact O-N 3.31Å; C119-E123 PolarHBondContact SG-OE1 3.33Å; C119-E123 VanDerWaalsContact SG-OE1 3.37Å; C119-E123 PolarHBondContact SG-OE2 3.05Å; C119-C138 WeakPolarHBondContact CA-SG 3.26Å; C119-C138 HydrophobicContact CB-CB 3.71Å; C119-C138 WeakPolarHBondContact CB-SG 3.03Å; C119-C138 WeakPolarHBondContact SG-CB 3.44Å; C119-C138 PolarHBondContact SG-N 2.72Å; C119-C138 CovalentContact SG-SG 2Å; C119-C138 PolarHBondContact SG-SG 2.95Å
120	S	85.7	Confident	89.1	Confident	88 Å²	88	89.6 Å²	89.6	62%	0.615	44%	0.441	S	S	*	.	P	Polyproline II helix	trans	-58.4	142.6	170.9	-64.5	0	0	0	0	110.6
121	R	78.5	Confident	88.9	Confident	255 Å²	255	84 Å²	84	96%	0.962	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	138.5	174.9	-68	-177.2	-179.8	172	0.5	109.3
122	G	71.8	Confident	88.7	Confident	83 Å²	83	87.2 Å²	87.2	86%	0.856	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.5	8.8	175.3	0	0	0	0	0	115.8	K124	G122-K124 PolarHBondContact O-N 2.82Å
123	E	78.4	Confident	88.5	Confident	59 Å²	59	85.2 Å²	85.2	28%	0.276	42%	0.42	S	S	.	.	P	Polyproline II helix	trans	-58.1	138.7	166.3	-77.7	-173.1	-156.8	0	0	110.9	C119 N136 R137	C119-E123 PolarHBondContact SG-OE1 3.33Å; C119-E123 VanDerWaalsContact SG-OE1 3.37Å; C119-E123 PolarHBondContact SG-OE2 3.05Å; E123-N136 HydrophobicContact CB-CB 3.69Å; E123-R137 PolarHBondContact OE2-N 3Å
124	K	76.4	Confident	88.3	Confident	184 Å²	184	85.2 Å²	85.2	80%	0.8	42%	0.417	S	S	*	.	P	Polyproline II helix	trans	-66.8	149.8	178.7	-67.7	179.6	179.9	174.6	0	110.9	G122	G122-K124 PolarHBondContact O-N 2.82Å
125	P	84	Confident	88	Confident	38 Å²	38	91 Å²	91	25%	0.247	44%	0.438	C	S	.	.	P	Polyproline II helix	trans	-54.8	148.4	171.3	-24.1	33.6	0	0	0	112.2	I133 Y134 Y194	P125-I133 HydrophobicContact CB-CG2 3.68Å; P125-Y134 CarbonylContact C-O 3.55Å; P125-Y134 VanDerWaalsContact CA-O 3.25Å; P125-Y134 WeakPolarHBondContact CA-O 3.43Å; P125-Y134 WeakPolarHBondContact CB-O 3.49Å; P125-Y194 HydrophobicContact CB-CD1 4.12Å; P125-Y194 HydrophobicContact CG-CD1 4.28Å; P125-Y194 HydrophobicContact CG-CG 4.23Å
126	F	88.2	Confident	87.8	Confident	60 Å²	60	83.2 Å²	83.2	26%	0.263	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	149.4	-176.6	-157.8	-102	0	0	0	109.5	I133 Y134 F140 I157	F126-I133 CarbonylContact O-C 3.59Å; F126-I133 WeakPolarHBondContact O-CA 3.4Å; F126-Y134 PolarHBondContact N-O 2.68Å; F126-Y134 PolarHBondContact O-N 2.03Å; F126-F140 HydrophobicContact CD1-CB 3.93Å; F126-F140 HydrophobicContact CD1-CD1 4.25Å; F126-F140 AromaticContact CD1-CD2 3.85Å; F126-F140 HydrophobicContact CD1-CD2 3.85Å; F126-F140 HydrophobicContact CD1-CE2 4.45Å; F126-F140 AromaticContact CD1-CG 3.74Å; F126-F140 HydrophobicContact CD1-CG 3.74Å; F126-F140 HydrophobicContact CE1-CD1 4.16Å; F126-F140 HydrophobicContact CE1-CD2 4.24Å; F126-F140 HydrophobicContact CE1-CE1 4.39Å; F126-F140 HydrophobicContact CE1-CE2 4.45Å; F126-F140 HydrophobicContact CE1-CG 4.09Å; F126-I157 HydrophobicContact CE1-CB 4.32Å; F126-I157 HydrophobicContact CE1-CD1 4.27Å; F126-I157 HydrophobicContact CE1-CG1 3.92Å; F126-I157 HydrophobicContact CE1-CG2 3.72Å; F126-I157 HydrophobicContact CZ-CB 4.4Å; F126-I157 HydrophobicContact CZ-CD1 4.03Å; F126-I157 HydrophobicContact CZ-CG1 4.11Å; F126-I157 HydrophobicContact CZ-CG2 3.5Å
127	C	93.4	Very high	87.8	Confident	1 Å²	1	84.2 Å²	84.2	1%	0.007	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	156.6	179.1	74.9	0	0	0	0	114.1	N132 I133 G158 C161	C127-N132 CarbonylContact C-O 3.45Å; C127-N132 WeakPolarHBondContact CA-O 3.38Å; C127-N132 VanDerWaalsContact CB-O 3.27Å; C127-N132 WeakPolarHBondContact CB-O 3.43Å; C127-I133 HydrophobicContact CB-CG1 4.32Å; C127-G158 PolarHBondContact O-N 3.22Å; C127-C161 HydrophobicContact CB-CB 3.75Å; C127-C161 WeakPolarHBondContact CB-SG 2.99Å; C127-C161 WeakPolarHBondContact SG-CA 3.04Å; C127-C161 WeakPolarHBondContact SG-CB 3.5Å; C127-C161 CovalentContact SG-SG 2.03Å; C127-C161 PolarHBondContact SG-SG 2.72Å
128	D	94.5	Very high	88	Confident	1 Å²	1	81.6 Å²	81.6	1%	0.005	40%	0.399	C	S	.	.	B	Isolated β-bridge	trans	-92.8	173.5	169.1	74	9.6	0	0	0	112.2	K130 G131 N132 Y134 F140 K156 G158	D128-K130 PolarHBondContact O-N 3.02Å; D128-K130 VanDerWaalsContact O-N 3.11Å; D128-K130 VanDerWaalsContact OD1-CA 3.31Å; D128-K130 WeakPolarHBondContact OD1-CA 3.01Å; D128-K130 WeakPolarHBondContact OD1-CB 3.22Å; D128-K130 PolarHBondContact OD1-N 3.02Å; D128-G131 PolarHBondContact O-N 2.85Å; D128-G131 PolarHBondContact OD1-N 2.88Å; D128-N132 PolarHBondContact N-O 3.11Å; D128-N132 WeakPolarHBondContact OD1-CB 3.27Å; D128-N132 PolarHBondContact OD1-N 3.03Å; D128-N132 PolarHBondContact OD1-ND2 3.39Å; D128-N132 WeakPolarHBondContact OD2-CB 3.09Å; D128-N132 PolarHBondContact OD2-ND2 2.8Å; D128-Y134 HydrophobicContact CB-CE2 4.03Å; D128-Y134 PolarHBondContact OD2-OH 3.35Å; D128-F140 HydrophobicContact CB-CE2 4.01Å; D128-K156 CarbonylContact C-O 3.48Å; D128-K156 WeakPolarHBondContact CA-O 3.48Å; D128-K156 WeakPolarHBondContact CB-O 3.44Å; D128-G158 VanDerWaalsContact C-CA 3.47Å; D128-G158 WeakPolarHBondContact O-CA 3.24Å
129	S	94.1	Very high	88.3	Confident	74 Å²	74	70.9 Å²	70.9	52%	0.517	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-6.9	178.2	71.8	0	0	0	0	114.1	K156	S129-K156 PolarHBondContact N-O 3.14Å
130	K	93.3	Very high	88.7	Confident	127 Å²	127	70.1 Å²	70.1	55%	0.552	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.4	0.3	174.9	-58.9	-173.8	175.6	-160.8	0	111.8	D128 N132	D128-K130 PolarHBondContact O-N 3.02Å; D128-K130 VanDerWaalsContact O-N 3.11Å; D128-K130 VanDerWaalsContact OD1-CA 3.31Å; D128-K130 WeakPolarHBondContact OD1-CA 3.01Å; D128-K130 WeakPolarHBondContact OD1-CB 3.22Å; D128-K130 PolarHBondContact OD1-N 3.02Å; K130-N132 VanDerWaalsContact C-N 3.34Å
131	G	92.3	Very high	89.1	Confident	19 Å²	19	70 Å²	70	20%	0.196	35%	0.345	C	S	.	.			trans	79.4	12.9	-178.5	0	0	0	0	0	114.2	D128 P162	D128-G131 PolarHBondContact O-N 2.85Å; D128-G131 PolarHBondContact OD1-N 2.88Å; G131-P162 WeakPolarHBondContact O-CG 3.33Å
132	N	93.6	Very high	89.9	Confident	80 Å²	80	59.3 Å²	59.3	43%	0.428	31%	0.306	S	S	.	.			trans	-71.2	134.6	170.4	-59.5	-54.9	0	0	0	109	C127 D128 K130 Y134	C127-N132 CarbonylContact C-O 3.45Å; C127-N132 WeakPolarHBondContact CA-O 3.38Å; C127-N132 VanDerWaalsContact CB-O 3.27Å; C127-N132 WeakPolarHBondContact CB-O 3.43Å; D128-N132 PolarHBondContact N-O 3.11Å; D128-N132 WeakPolarHBondContact OD1-CB 3.27Å; D128-N132 PolarHBondContact OD1-N 3.03Å; D128-N132 PolarHBondContact OD1-ND2 3.39Å; D128-N132 WeakPolarHBondContact OD2-CB 3.09Å; D128-N132 PolarHBondContact OD2-ND2 2.8Å; K130-N132 VanDerWaalsContact C-N 3.34Å; N132-Y134 HydrophobicContact CB-CE2 4.04Å
133	I	93.6	Very high	91	Very high	17 Å²	17	58.7 Å²	58.7	9%	0.087	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	131.8	-179.5	-54.3	-171.5	0	0	0	109.6	P125 F126 C127 P162 Y194 K197 A198	P125-I133 HydrophobicContact CB-CG2 3.68Å; F126-I133 CarbonylContact O-C 3.59Å; F126-I133 WeakPolarHBondContact O-CA 3.4Å; C127-I133 HydrophobicContact CB-CG1 4.32Å; I133-P162 HydrophobicContact CD1-CB 4.3Å; I133-Y194 HydrophobicContact CD1-CD1 3.68Å; I133-Y194 HydrophobicContact CD1-CE1 3.84Å; I133-Y194 HydrophobicContact CG2-CD1 4.17Å; I133-K197 HydrophobicContact CB-CB 4Å; I133-K197 HydrophobicContact CD1-CB 3.94Å; I133-K197 HydrophobicContact CD1-CD 3.54Å; I133-K197 HydrophobicContact CD1-CG 4.33Å; I133-K197 HydrophobicContact CG1-CB 4.16Å; I133-K197 HydrophobicContact CG1-CD 4.02Å; I133-A198 HydrophobicContact CG2-CB 4.16Å
134	Y	92.7	Very high	91.8	Very high	23 Å²	23	57.7 Å²	57.7	9%	0.09	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	151.6	179.2	-57.1	-85.8	0	0	0	109.8	P125 F126 D128 N132 N136 F140 H143	P125-Y134 CarbonylContact C-O 3.55Å; P125-Y134 VanDerWaalsContact CA-O 3.25Å; P125-Y134 WeakPolarHBondContact CA-O 3.43Å; P125-Y134 WeakPolarHBondContact CB-O 3.49Å; F126-Y134 PolarHBondContact N-O 2.68Å; F126-Y134 PolarHBondContact O-N 2.03Å; D128-Y134 HydrophobicContact CB-CE2 4.03Å; D128-Y134 PolarHBondContact OD2-OH 3.35Å; N132-Y134 HydrophobicContact CB-CE2 4.04Å; Y134-N136 VanDerWaalsContact C-N 3.26Å; Y134-N136 PolarHBondContact O-N 2.95Å; Y134-F140 HydrophobicContact CD2-CB 4.24Å; Y134-F140 AromaticContact CD2-CD2 3.64Å; Y134-F140 HydrophobicContact CD2-CD2 3.64Å; Y134-F140 HydrophobicContact CD2-CG 4.44Å; Y134-F140 AromaticContact CE2-CD2 3.63Å; Y134-F140 HydrophobicContact CE2-CD2 3.63Å; Y134-F140 HydrophobicContact CE2-CE2 4.21Å; Y134-F140 HydrophobicContact CG-CB 4.12Å; Y134-F140 HydrophobicContact CG-CD2 4.3Å; Y134-H143 HydrophobicContact CD1-CB 4.21Å; Y134-H143 AromaticContact CD1-CD2 3.41Å; Y134-H143 VanDerWaalsContact CD1-CD2 3.41Å; Y134-H143 WeakPolarHBondContact CD1-CD2 3.18Å; Y134-H143 AromaticContact CD1-CG 3.95Å; Y134-H143 HydrophobicContact CE1-CB 3.57Å; Y134-H143 AromaticContact CE1-CD2 3.42Å; Y134-H143 VanDerWaalsContact CE1-CD2 3.42Å; Y134-H143 WeakPolarHBondContact CE1-CD2 3.4Å; Y134-H143 AromaticContact CE1-CG 3.48Å; Y134-H143 VanDerWaalsContact CE1-CG 3.48Å
135	R	90.2	Very high	92.8	Very high	126 Å²	126	51 Å²	51	48%	0.475	25%	0.252	S	S	.	.	S	Bend	trans	-59.4	-36.9	-174.5	-63.3	177.3	-179	173	3.6	113.5	A198 Y199	R135-A198 HydrophobicContact CG-CB 4.33Å; R135-Y199 HydrophobicContact CB-CE1 4.29Å; R135-Y199 VanDerWaalsContact CD-CE1 3.45Å; R135-Y199 HydrophobicContact CG-CD1 4.09Å; R135-Y199 HydrophobicContact CG-CE1 3.6Å; R135-Y199 HydrophobicContact CG-CE2 4.41Å
136	N	89.8	Confident	93.3	Very high	36 Å²	36	51 Å²	51	19%	0.193	25%	0.249	C	C	.	.	S	Bend	trans	-166.2	-177.7	179.4	56	36.4	0	0	0	109.5	E123 Y134 C138 S139 F140	E123-N136 HydrophobicContact CB-CB 3.69Å; Y134-N136 VanDerWaalsContact C-N 3.26Å; Y134-N136 PolarHBondContact O-N 2.95Å; N136-C138 PolarHBondContact O-N 2.91Å; N136-C138 WeakPolarHBondContact OD1-CB 3.37Å; N136-C138 PolarHBondContact OD1-N 2.82Å; N136-S139 WeakPolarHBondContact O-CB 3.31Å; N136-S139 PolarHBondContact O-N 3.02Å; N136-S139 PolarHBondContact OD1-N 3.04Å; N136-F140 PolarHBondContact O-N 3.33Å; N136-F140 VanDerWaalsContact O-N 3.15Å
137	R	91.3	Very high	93.7	Very high	145 Å²	145	49.5 Å²	49.5	55%	0.547	24%	0.242	S	C	.	.	H	α-helix	trans	-61	-40.3	-179.8	-174.8	174.6	62.4	163.1	0.5	112.9	E123 S139 F140 Q141	E123-R137 PolarHBondContact OE2-N 3Å; R137-S139 VanDerWaalsContact C-N 3.32Å; R137-S139 PolarHBondContact O-N 2.02Å; R137-F140 WeakPolarHBondContact O-CB 3.09Å; R137-F140 PolarHBondContact O-N 3.39Å; R137-Q141 WeakPolarHBondContact O-CG 2.96Å; R137-Q141 PolarHBondContact O-N 3.49Å
138	C	93.6	Very high	93.9	Very high	13 Å²	13	55.4 Å²	55.4	9%	0.088	26%	0.264	C	S	.	.	H	α-helix	trans	-63	-38.9	177	-70	0	0	0	0	112.4	L117 C119 N136 F140 Q141 F142	L117-C138 HydrophobicContact CB-CB 3.96Å; L117-C138 VanDerWaalsContact CB-SG 3.57Å; C119-C138 WeakPolarHBondContact CA-SG 3.26Å; C119-C138 HydrophobicContact CB-CB 3.71Å; C119-C138 WeakPolarHBondContact CB-SG 3.03Å; C119-C138 WeakPolarHBondContact SG-CB 3.44Å; C119-C138 PolarHBondContact SG-N 2.72Å; C119-C138 CovalentContact SG-SG 2Å; C119-C138 PolarHBondContact SG-SG 2.95Å; N136-C138 PolarHBondContact O-N 2.91Å; N136-C138 WeakPolarHBondContact OD1-CB 3.37Å; N136-C138 PolarHBondContact OD1-N 2.82Å; C138-F140 VanDerWaalsContact C-N 3.32Å; C138-Q141 PolarHBondContact O-N 2.87Å; C138-F142 PolarHBondContact O-N 3.29Å
139	S	93.1	Very high	94	Very high	27 Å²	27	58.4 Å²	58.4	19%	0.189	28%	0.278	C	S	.	.	H	α-helix	trans	-62.1	-43.2	175.8	-169.9	0	0	0	0	110.5	N136 R137 F142 H143	N136-S139 WeakPolarHBondContact O-CB 3.31Å; N136-S139 PolarHBondContact O-N 3.02Å; N136-S139 PolarHBondContact OD1-N 3.04Å; R137-S139 VanDerWaalsContact C-N 3.32Å; R137-S139 PolarHBondContact O-N 2.02Å; S139-F142 PolarHBondContact O-N 3.25Å; S139-H143 PolarHBondContact O-CD2 2.84Å; S139-H143 PolarHBondContact O-N 3.42Å; S139-H143 VanDerWaalsContact O-N 3.11Å
140	F	94	Very high	94.1	Very high	17 Å²	17	59.7 Å²	59.7	8%	0.075	27%	0.274	C	S	.	.	H	α-helix	trans	-60.1	-47	174.3	176.5	-92.3	0	0	0	111.6	F126 D128 Y134 N136 R137 C138 F142 H143 Q144 L155 I157	F126-F140 HydrophobicContact CD1-CB 3.93Å; F126-F140 HydrophobicContact CD1-CD1 4.25Å; F126-F140 AromaticContact CD1-CD2 3.85Å; F126-F140 HydrophobicContact CD1-CD2 3.85Å; F126-F140 HydrophobicContact CD1-CE2 4.45Å; F126-F140 AromaticContact CD1-CG 3.74Å; F126-F140 HydrophobicContact CD1-CG 3.74Å; F126-F140 HydrophobicContact CE1-CD1 4.16Å; F126-F140 HydrophobicContact CE1-CD2 4.24Å; F126-F140 HydrophobicContact CE1-CE1 4.39Å; F126-F140 HydrophobicContact CE1-CE2 4.45Å; F126-F140 HydrophobicContact CE1-CG 4.09Å; D128-F140 HydrophobicContact CB-CE2 4.01Å; Y134-F140 HydrophobicContact CD2-CB 4.24Å; Y134-F140 AromaticContact CD2-CD2 3.64Å; Y134-F140 HydrophobicContact CD2-CD2 3.64Å; Y134-F140 HydrophobicContact CD2-CG 4.44Å; Y134-F140 AromaticContact CE2-CD2 3.63Å; Y134-F140 HydrophobicContact CE2-CD2 3.63Å; Y134-F140 HydrophobicContact CE2-CE2 4.21Å; Y134-F140 HydrophobicContact CG-CB 4.12Å; Y134-F140 HydrophobicContact CG-CD2 4.3Å; N136-F140 PolarHBondContact O-N 3.33Å; N136-F140 VanDerWaalsContact O-N 3.15Å; R137-F140 WeakPolarHBondContact O-CB 3.09Å; R137-F140 PolarHBondContact O-N 3.39Å; C138-F140 VanDerWaalsContact C-N 3.32Å; F140-F142 VanDerWaalsContact C-N 3.33Å; F140-F142 PolarHBondContact O-N 2.85Å; F140-H143 PolarHBondContact O-N 3.5Å; F140-Q144 WeakPolarHBondContact O-CB 3.46Å; F140-Q144 PolarHBondContact O-N 2.8Å; F140-L155 HydrophobicContact CE2-CB 4.01Å; F140-L155 HydrophobicContact CE2-CD1 4.44Å; F140-L155 HydrophobicContact CZ-CB 3.93Å; F140-I157 HydrophobicContact CE1-CG1 4.3Å; F140-I157 HydrophobicContact CZ-CG1 4.13Å
141	Q	94.1	Very high	94.2	Very high	85 Å²	85	61.5 Å²	61.5	40%	0.397	28%	0.277	S	S	.	.	H	α-helix	trans	-61.1	-39.3	178.6	-72.1	174.3	-33.3	0	0	112.9	L117 R137 C138 Q144 C145	L117-Q141 VanDerWaalsContact CD1-OE1 3.29Å; R137-Q141 WeakPolarHBondContact O-CG 2.96Å; R137-Q141 PolarHBondContact O-N 3.49Å; C138-Q141 PolarHBondContact O-N 2.87Å; Q141-Q144 PolarHBondContact O-N 2.97Å; Q141-C145 PolarHBondContact O-N 3.34Å
142	F	94.7	Very high	94.4	Very high	30 Å²	30	66.9 Å²	66.9	13%	0.132	30%	0.295	C	S	.	.	H	α-helix	trans	-60.9	-49.2	174.1	177.2	-93	0	0	0	111.3	C114 K116 C138 S139 F140 Q144 C145 E146	C114-F142 HydrophobicContact CB-CD2 3.95Å; C114-F142 HydrophobicContact CB-CE2 3.84Å; C114-F142 VanDerWaalsContact O-CE2 3.32Å; C114-F142 WeakPolarHBondContact O-CE2 3.42Å; K116-F142 HydrophobicContact CB-CD2 4.42Å; K116-F142 HydrophobicContact CD-CE2 4.35Å; K116-F142 HydrophobicContact CG-CD2 3.56Å; K116-F142 HydrophobicContact CG-CE2 3.47Å; K116-F142 VanDerWaalsContact CG-CE2 3.47Å; K116-F142 HydrophobicContact CG-CG 4.3Å; K116-F142 HydrophobicContact CG-CZ 4.16Å; C138-F142 PolarHBondContact O-N 3.29Å; S139-F142 PolarHBondContact O-N 3.25Å; F140-F142 VanDerWaalsContact C-N 3.33Å; F140-F142 PolarHBondContact O-N 2.85Å; F142-Q144 VanDerWaalsContact C-N 3.35Å; F142-Q144 PolarHBondContact O-N 3.23Å; F142-C145 WeakPolarHBondContact O-CB 3.42Å; F142-C145 PolarHBondContact O-N 3.06Å; F142-E146 HydrophobicContact CD1-CG 4.48Å; F142-E146 HydrophobicContact CE1-CG 4Å; F142-E146 WeakPolarHBondContact CE1-OE2 3.31Å; F142-E146 HydrophobicContact CZ-CG 4.14Å; F142-E146 PolarHBondContact O-N 3.25Å
143	H	95	Very high	94.5	Very high	70 Å²	70	67.5 Å²	67.5	32%	0.324	29%	0.291	S	S	.	.	H	α-helix	trans	-66	-35.8	178.1	-80.4	-76.6	0	0	0	113	Y134 S139 F140 C145 E146 E147 L155	Y134-H143 HydrophobicContact CD1-CB 4.21Å; Y134-H143 AromaticContact CD1-CD2 3.41Å; Y134-H143 VanDerWaalsContact CD1-CD2 3.41Å; Y134-H143 WeakPolarHBondContact CD1-CD2 3.18Å; Y134-H143 AromaticContact CD1-CG 3.95Å; Y134-H143 HydrophobicContact CE1-CB 3.57Å; Y134-H143 AromaticContact CE1-CD2 3.42Å; Y134-H143 VanDerWaalsContact CE1-CD2 3.42Å; Y134-H143 WeakPolarHBondContact CE1-CD2 3.4Å; Y134-H143 AromaticContact CE1-CG 3.48Å; Y134-H143 VanDerWaalsContact CE1-CG 3.48Å; S139-H143 PolarHBondContact O-CD2 2.84Å; S139-H143 PolarHBondContact O-N 3.42Å; S139-H143 VanDerWaalsContact O-N 3.11Å; F140-H143 PolarHBondContact O-N 3.5Å; H143-C145 VanDerWaalsContact C-N 3.33Å; H143-E146 PolarHBondContact O-N 2.78Å; H143-E147 WeakPolarHBondContact O-CB 3.29Å; H143-E147 WeakPolarHBondContact O-CG 3.23Å; H143-E147 PolarHBondContact O-N 2.93Å; H143-L155 HydrophobicContact CB-CD1 4.13Å
144	Q	95.8	Very high	94.6	Very high	39 Å²	39	71 Å²	71	18%	0.182	31%	0.313	C	S	.	.	H	α-helix	trans	-59.1	-45.9	172.2	172.5	57.5	82.5	0	0	110.8	F140 Q141 F142 E147 W148 R153 L155	F140-Q144 WeakPolarHBondContact O-CB 3.46Å; F140-Q144 PolarHBondContact O-N 2.8Å; Q141-Q144 PolarHBondContact O-N 2.97Å; F142-Q144 VanDerWaalsContact C-N 3.35Å; F142-Q144 PolarHBondContact O-N 3.23Å; Q144-E147 PolarHBondContact O-N 2.6Å; Q144-W148 WeakPolarHBondContact O-CB 3.35Å; Q144-W148 PolarHBondContact O-N 3.36Å; Q144-R153 PolarHBondContact NE2-O 3.24Å; Q144-L155 HydrophobicContact CB-CD1 4.42Å; Q144-L155 PolarHBondContact OE1-O 3.43Å
145	C	97	Very high	94.8	Very high	44 Å²	44	70.5 Å²	70.5	30%	0.297	31%	0.312	S	S	.	.	H	α-helix	trans	-60.4	-46.7	176.2	173.7	0	0	0	0	111.5	C114 Q141 F142 H143 W148 K149	C114-C145 HydrophobicContact CB-CB 3.73Å; C114-C145 WeakPolarHBondContact CB-SG 3.41Å; C114-C145 WeakPolarHBondContact SG-CB 3.18Å; C114-C145 CovalentContact SG-SG 2.03Å; C114-C145 PolarHBondContact SG-SG 3.43Å; Q141-C145 PolarHBondContact O-N 3.34Å; F142-C145 WeakPolarHBondContact O-CB 3.42Å; F142-C145 PolarHBondContact O-N 3.06Å; H143-C145 VanDerWaalsContact C-N 3.33Å; C145-W148 PolarHBondContact O-N 3.22Å; C145-K149 VanDerWaalsContact O-CG 3.32Å; C145-K149 WeakPolarHBondContact O-CG 3.07Å; C145-K149 PolarHBondContact O-N 3.03Å
146	E	95.9	Very high	95	Very high	38 Å²	38	71.7 Å²	71.7	18%	0.178	32%	0.321	C	S	.	.	H	α-helix	trans	-63.8	-43.4	179.8	-71.6	-158.4	99.3	0	0	112.9	Y109 C114 F142 H143 W148 K149 K150	Y109-E146 HydrophobicContact CE1-CG 4.35Å; C114-E146 HydrophobicContact CB-CG 4.28Å; C114-E146 PolarHBondContact SG-N 2.94Å; F142-E146 HydrophobicContact CD1-CG 4.48Å; F142-E146 HydrophobicContact CE1-CG 4Å; F142-E146 WeakPolarHBondContact CE1-OE2 3.31Å; F142-E146 HydrophobicContact CZ-CG 4.14Å; F142-E146 PolarHBondContact O-N 3.25Å; H143-E146 PolarHBondContact O-N 2.78Å; E146-W148 VanDerWaalsContact C-N 3.32Å; E146-W148 PolarHBondContact O-N 3.24Å; E146-K149 PolarHBondContact O-N 2.95Å; E146-K150 WeakPolarHBondContact O-CB 3.18Å; E146-K150 WeakPolarHBondContact O-CG 3.47Å; E146-K150 PolarHBondContact O-N 3.24Å; E146-K150 IonicContact OE1-NZ 2.81Å; E146-K150 PolarHBondContact OE1-NZ 2.83Å
147	E	96.2	Very high	95.1	Very high	28 Å²	28	75 Å²	75	13%	0.131	34%	0.337	C	S	.	.	H	α-helix	trans	-64.5	-37.1	178.9	-79	-79.7	120.6	0	0	112.1	H143 Q144 R151 K152 R153 L155	H143-E147 WeakPolarHBondContact O-CB 3.29Å; H143-E147 WeakPolarHBondContact O-CG 3.23Å; H143-E147 PolarHBondContact O-N 2.93Å; Q144-E147 PolarHBondContact O-N 2.6Å; E147-R151 CarbonylContact O-C 3.49Å; E147-R151 WeakPolarHBondContact O-CA 3.25Å; E147-R151 PolarHBondContact O-N 3.47Å; E147-R151 IonicContact OE1-CZ 3.77Å; E147-R151 IonicContact OE1-NH1 3.58Å; E147-R151 PolarHBondContact OE1-NH1 3.29Å; E147-R151 IonicContact OE2-NH1 3.92Å; E147-K152 PolarHBondContact O-N 3.11Å; E147-R153 CarbonylContact C-O 3.5Å; E147-R153 PolarHBondContact O-N 2.9Å; E147-R153 IonicContact OE2-CZ 2.62Å; E147-R153 IonicContact OE2-NE 2.99Å; E147-R153 PolarHBondContact OE2-NE 3.17Å; E147-R153 VanDerWaalsContact OE2-NE 3.12Å; E147-R153 IonicContact OE2-NH2 3.44Å; E147-R153 PolarHBondContact OE2-NH2 3.19Å; E147-L155 HydrophobicContact CB-CD1 4.5Å; E147-L155 HydrophobicContact CB-CD2 4.41Å; E147-L155 HydrophobicContact CB-CG 4.2Å; E147-L155 HydrophobicContact CG-CD1 4.13Å; E147-L155 HydrophobicContact CG-CD2 4.01Å; E147-L155 HydrophobicContact CG-CG 4.13Å
148	W	97	Very high	95.1	Very high	124 Å²	124	68.8 Å²	68.8	47%	0.47	32%	0.318	S	S	.	.	H	α-helix	trans	-66	-47	172.3	178.3	-108.5	0	0	0	111.4	Q144 C145 E146 K152 R153 V154	Q144-W148 WeakPolarHBondContact O-CB 3.35Å; Q144-W148 PolarHBondContact O-N 3.36Å; C145-W148 PolarHBondContact O-N 3.22Å; E146-W148 VanDerWaalsContact C-N 3.32Å; E146-W148 PolarHBondContact O-N 3.24Å; W148-K152 VanDerWaalsContact CE3-C 3.5Å; W148-K152 HydrophobicContact CZ3-CB 4.38Å; W148-K152 WeakPolarHBondContact CZ3-O 3.34Å; W148-K152 WeakPolarHBondContact O-CA 3.4Å; W148-K152 WeakPolarHBondContact O-CD 3.38Å; W148-K152 PolarHBondContact O-N 2.92Å; W148-R153 PolarHBondContact N-O 2.96Å; W148-V154 HydrophobicContact CE3-CG2 3.98Å; W148-V154 HydrophobicContact CZ3-CG2 4.11Å
149	K	96.7	Very high	94.8	Very high	65 Å²	65	75.5 Å²	75.5	28%	0.283	36%	0.359	S	S	.	.	H	α-helix	trans	-66.4	-42.6	-178	-70.7	-68.6	-169.4	174.7	0	113.1	Y109 C145 E146	Y109-K149 HydrophobicContact CD1-CB 4.32Å; Y109-K149 HydrophobicContact CD2-CB 3.44Å; Y109-K149 VanDerWaalsContact CD2-CB 3.44Å; Y109-K149 HydrophobicContact CD2-CD 4.35Å; Y109-K149 HydrophobicContact CD2-CG 3.95Å; Y109-K149 HydrophobicContact CE2-CB 3.69Å; Y109-K149 HydrophobicContact CE2-CD 4.41Å; Y109-K149 HydrophobicContact CE2-CG 3.79Å; Y109-K149 HydrophobicContact CG-CB 3.77Å; C145-K149 VanDerWaalsContact O-CG 3.32Å; C145-K149 WeakPolarHBondContact O-CG 3.07Å; C145-K149 PolarHBondContact O-N 3.03Å; E146-K149 PolarHBondContact O-N 2.95Å
150	K	96.5	Very high	94.5	Very high	101 Å²	101	78.1 Å²	78.1	44%	0.439	38%	0.382	S	S	.	.	H	α-helix	trans	-79.5	-37.9	-177.1	-68.4	173.4	-175.8	168.6	0	113.6	Y109 E146	Y109-K150 HydrophobicContact CD1-CD 4.13Å; Y109-K150 HydrophobicContact CD1-CG 3.57Å; Y109-K150 HydrophobicContact CE1-CG 4.42Å; Y109-K150 HydrophobicContact CG-CG 4.1Å; E146-K150 WeakPolarHBondContact O-CB 3.18Å; E146-K150 WeakPolarHBondContact O-CG 3.47Å; E146-K150 PolarHBondContact O-N 3.24Å; E146-K150 IonicContact OE1-NZ 2.81Å; E146-K150 PolarHBondContact OE1-NZ 2.83Å
151	R	96.1	Very high	94.2	Very high	165 Å²	165	79 Å²	79	62%	0.623	39%	0.39	S	S	*	.	H	α-helix	trans	-132.7	3.3	-166.4	-62.6	175.9	176.5	153.5	-7.7	114.1	E147 R153	E147-R151 CarbonylContact O-C 3.49Å; E147-R151 WeakPolarHBondContact O-CA 3.25Å; E147-R151 PolarHBondContact O-N 3.47Å; E147-R151 IonicContact OE1-CZ 3.77Å; E147-R151 IonicContact OE1-NH1 3.58Å; E147-R151 PolarHBondContact OE1-NH1 3.29Å; E147-R151 IonicContact OE2-NH1 3.92Å; R151-R153 HydrophobicContact CB-CB 4.35Å; R151-R153 PolarHBondContact O-N 3.4Å; R151-R153 VanDerWaalsContact O-N 3.11Å
152	K	96.1	Very high	94	Very high	131 Å²	131	76.6 Å²	76.6	57%	0.57	38%	0.382	S	S	*	.			trans	52.1	31.8	-174.3	-51.1	-61.7	-179.1	-169.9	0	112.9	E147 W148	E147-K152 PolarHBondContact O-N 3.11Å; W148-K152 VanDerWaalsContact CE3-C 3.5Å; W148-K152 HydrophobicContact CZ3-CB 4.38Å; W148-K152 WeakPolarHBondContact CZ3-O 3.34Å; W148-K152 WeakPolarHBondContact O-CA 3.4Å; W148-K152 WeakPolarHBondContact O-CD 3.38Å; W148-K152 PolarHBondContact O-N 2.92Å
153	R	96.3	Very high	93.8	Very high	93 Å²	93	75.8 Å²	75.8	35%	0.351	38%	0.38	S	S	.	.			trans	-108.5	136.1	-176.6	-162.1	177	71.7	177.4	3.4	111.6	Q144 E147 W148 R151	Q144-R153 PolarHBondContact NE2-O 3.24Å; E147-R153 CarbonylContact C-O 3.5Å; E147-R153 PolarHBondContact O-N 2.9Å; E147-R153 IonicContact OE2-CZ 2.62Å; E147-R153 IonicContact OE2-NE 2.99Å; E147-R153 PolarHBondContact OE2-NE 3.17Å; E147-R153 VanDerWaalsContact OE2-NE 3.12Å; E147-R153 IonicContact OE2-NH2 3.44Å; E147-R153 PolarHBondContact OE2-NH2 3.19Å; W148-R153 PolarHBondContact N-O 2.96Å; R151-R153 HydrophobicContact CB-CB 4.35Å; R151-R153 PolarHBondContact O-N 3.4Å; R151-R153 VanDerWaalsContact O-N 3.11Å
154	V	95.7	Very high	93.5	Very high	91 Å²	91	75 Å²	75	55%	0.552	38%	0.382	S	S	*	.	P	Polyproline II helix	trans	-94.1	125.2	173.8	-175	0	0	0	0	109.7	W148	W148-V154 HydrophobicContact CE3-CG2 3.98Å; W148-V154 HydrophobicContact CZ3-CG2 4.11Å
155	L	95.2	Very high	92.9	Very high	12 Å²	12	79.1 Å²	79.1	6%	0.063	41%	0.406	C	S	.	.	P	Polyproline II helix	trans	-76.5	123.8	170.2	-61.2	179.4	0	0	0	108.5	F140 H143 Q144 E147	F140-L155 HydrophobicContact CE2-CB 4.01Å; F140-L155 HydrophobicContact CE2-CD1 4.44Å; F140-L155 HydrophobicContact CZ-CB 3.93Å; H143-L155 HydrophobicContact CB-CD1 4.13Å; Q144-L155 HydrophobicContact CB-CD1 4.42Å; Q144-L155 PolarHBondContact OE1-O 3.43Å; E147-L155 HydrophobicContact CB-CD1 4.5Å; E147-L155 HydrophobicContact CB-CD2 4.41Å; E147-L155 HydrophobicContact CB-CG 4.2Å; E147-L155 HydrophobicContact CG-CD1 4.13Å; E147-L155 HydrophobicContact CG-CD2 4.01Å; E147-L155 HydrophobicContact CG-CG 4.13Å
156	K	95.1	Very high	92.7	Very high	152 Å²	152	84.5 Å²	84.5	66%	0.661	43%	0.432	S	S	*	.	P	Polyproline II helix	trans	-89.5	141.3	175.7	-62	-175.4	-179.4	-176.7	0	109.4	D128 S129	D128-K156 CarbonylContact C-O 3.48Å; D128-K156 WeakPolarHBondContact CA-O 3.48Å; D128-K156 WeakPolarHBondContact CB-O 3.44Å; S129-K156 PolarHBondContact N-O 3.14Å
157	I	92.8	Very high	92.7	Very high	105 Å²	105	83.5 Å²	83.5	54%	0.538	43%	0.429	S	S	.	.	B	Isolated β-bridge	trans	-64.7	135.5	175.4	-58.6	175.7	0	0	0	108.8	F126 F140	F126-I157 HydrophobicContact CE1-CB 4.32Å; F126-I157 HydrophobicContact CE1-CD1 4.27Å; F126-I157 HydrophobicContact CE1-CG1 3.92Å; F126-I157 HydrophobicContact CE1-CG2 3.72Å; F126-I157 HydrophobicContact CZ-CB 4.4Å; F126-I157 HydrophobicContact CZ-CD1 4.03Å; F126-I157 HydrophobicContact CZ-CG1 4.11Å; F126-I157 HydrophobicContact CZ-CG2 3.5Å; F140-I157 HydrophobicContact CE1-CG1 4.3Å; F140-I157 HydrophobicContact CZ-CG1 4.13Å
158	G	91.2	Very high	92.8	Very high	14 Å²	14	86 Å²	86	14%	0.144	45%	0.447	C	S	.	.	P	Polyproline II helix	trans	-77.1	134.5	176.7	0	0	0	0	0	111.8	C127 D128	C127-G158 PolarHBondContact O-N 3.22Å; D128-G158 VanDerWaalsContact C-CA 3.47Å; D128-G158 WeakPolarHBondContact O-CA 3.24Å
159	T	86.7	Confident	92.7	Very high	155 Å²	155	86.1 Å²	86.1	95%	0.951	46%	0.457	S	S	*	.	S	Bend	trans	-80.5	-26.6	172.3	51.2	0	0	0	0	112.3
160	A	86.3	Confident	92.7	Very high	81 Å²	81	87.2 Å²	87.2	67%	0.669	47%	0.469	S	S	*	.	S	Bend	trans	-130	108.3	176.1	0	0	0	0	0	109.7
161	C	87.7	Confident	92.7	Very high	36 Å²	36	88 Å²	88	24%	0.243	47%	0.472	C	S	.	.			trans	-81.5	139.4	176.2	-62.4	0	0	0	0	110.8	C127 S164	C127-C161 HydrophobicContact CB-CB 3.75Å; C127-C161 WeakPolarHBondContact CB-SG 2.99Å; C127-C161 WeakPolarHBondContact SG-CA 3.04Å; C127-C161 WeakPolarHBondContact SG-CB 3.5Å; C127-C161 CovalentContact SG-SG 2.03Å; C127-C161 PolarHBondContact SG-SG 2.72Å; C161-S164 VanDerWaalsContact O-CB 3.26Å; C161-S164 WeakPolarHBondContact O-CB 3.3Å; C161-S164 PolarHBondContact O-N 3.01Å; C161-S164 PolarHBondContact O-OG 3.43Å
162	P	89.5	Confident	92.8	Very high	35 Å²	35	83.2 Å²	83.2	23%	0.227	46%	0.464	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	155.2	167	-22.3	34	0	0	0	110.7	G131 I133 S164 Y194 K197	G131-P162 WeakPolarHBondContact O-CG 3.33Å; I133-P162 HydrophobicContact CD1-CB 4.3Å; P162-S164 PolarHBondContact O-N 3.44Å; P162-Y194 WeakPolarHBondContact O-CE1 2.99Å; P162-K197 HydrophobicContact CB-CD 4.38Å
163	C	92.1	Very high	92.9	Very high	13 Å²	13	77.8 Å²	77.8	9%	0.088	44%	0.443	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.3	-0.7	-174.4	-37.9	0	0	0	0	115.1	N165 R190 C193 Y194	C163-N165 PolarHBondContact O-N 3.27Å; C163-R190 WeakPolarHBondContact O-CG 3.23Å; C163-C193 HydrophobicContact CB-CB 3.57Å; C163-C193 WeakPolarHBondContact CB-SG 3.29Å; C163-C193 WeakPolarHBondContact SG-CB 3.3Å; C163-C193 CovalentContact SG-SG 2.03Å; C163-C193 PolarHBondContact SG-SG 3.38Å; C163-Y194 HydrophobicContact CB-CD1 4.02Å; C163-Y194 HydrophobicContact CB-CD2 4.32Å; C163-Y194 HydrophobicContact CB-CE1 3.76Å; C163-Y194 HydrophobicContact CB-CE2 4.09Å; C163-Y194 HydrophobicContact CB-CG 4.28Å
164	S	86.9	Confident	92.9	Very high	53 Å²	53	73.5 Å²	73.5	37%	0.371	43%	0.427	S	S	.	.			trans	-78.4	17.2	-175.1	-53.9	0	0	0	0	115.8	C161 P162 D166 Y194	C161-S164 VanDerWaalsContact O-CB 3.26Å; C161-S164 WeakPolarHBondContact O-CB 3.3Å; C161-S164 PolarHBondContact O-N 3.01Å; C161-S164 PolarHBondContact O-OG 3.43Å; P162-S164 PolarHBondContact O-N 3.44Å; S164-D166 PolarHBondContact O-N 2.99Å; S164-Y194 PolarHBondContact OG-OH 3.33Å
165	N	85	Confident	93	Very high	126 Å²	126	69.4 Å²	69.4	67%	0.674	40%	0.402	S	S	*	.			trans	-54.6	131.2	-178.7	-61.2	-2	0	0	0	111.1	C163 R190	C163-N165 PolarHBondContact O-N 3.27Å; N165-R190 PolarHBondContact O-NE 2.96Å; N165-R190 PolarHBondContact O-NH2 3.32Å
166	D	92.4	Very high	93.1	Very high	157 Å²	157	68.9 Å²	68.9	84%	0.84	40%	0.399	S	S	*	.			trans	-57.7	142.2	177.7	-69.3	-46.4	0	0	0	112.2	S164	S164-D166 PolarHBondContact O-N 2.99Å
167	C	95.9	Very high	93.1	Very high	17 Å²	17	65.1 Å²	65.1	12%	0.115	39%	0.389	C	S	.	.			trans	-122.3	136.3	-179.9	-72.6	0	0	0	0	109.3	C186 Y187 R190	C167-C186 WeakPolarHBondContact CA-SG 3.47Å; C167-C186 HydrophobicContact CB-CB 3.7Å; C167-C186 WeakPolarHBondContact CB-SG 3.33Å; C167-C186 WeakPolarHBondContact SG-CB 3.23Å; C167-C186 CovalentContact SG-SG 2.05Å; C167-C186 PolarHBondContact SG-SG 3.24Å; C167-Y187 HydrophobicContact CB-CD1 4.19Å; C167-Y187 HydrophobicContact CB-CD2 3.95Å; C167-Y187 HydrophobicContact CB-CE1 3.94Å; C167-Y187 HydrophobicContact CB-CE2 3.67Å; C167-Y187 HydrophobicContact CB-CG 4.2Å; C167-Y187 PolarHBondContact SG-N 2.88Å; C167-R190 VanDerWaalsContact N-NH2 3.18Å; C167-R190 PolarHBondContact SG-NH2 3.05Å; C167-R190 VanDerWaalsContact SG-NH2 3.36Å
168	P	96.8	Very high	93.1	Very high	80 Å²	80	65 Å²	65	52%	0.519	39%	0.389	S	S	.	.			trans	-62.1	143.6	177.2	27.3	-34.8	0	0	0	109.9	V170 N184	P168-V170 HydrophobicContact CB-CG2 4.2Å; P168-V170 PolarHBondContact O-N 3.09Å; P168-N184 PolarHBondContact O-ND2 2.64Å
169	N	95.1	Very high	93.2	Very high	126 Å²	126	66.6 Å²	66.6	67%	0.674	41%	0.405	S	S	*	.			trans	-80.9	45.6	178.3	-166.6	28.6	0	0	0	112.3	K183	N169-K183 PolarHBondContact OD1-NZ 2.03Å
170	V	96.8	Very high	93.6	Very high	88 Å²	88	63 Å²	63	53%	0.533	38%	0.38	S	S	.	.			trans	-95.1	130.5	178	175.8	0	0	0	0	109.4	P168 S172 N184	P168-V170 HydrophobicContact CB-CG2 4.2Å; P168-V170 PolarHBondContact O-N 3.09Å; V170-S172 PolarHBondContact O-N 3.44Å; V170-N184 PolarHBondContact O-ND2 2.94Å
171	F	97.5	Very high	94	Very high	117 Å²	117	62.2 Å²	62.2	51%	0.513	37%	0.367	S	S	.	.			trans	-86.9	94.6	177.2	-166	-100	0	0	0	111	P173 K183 R210	F171-P173 HydrophobicContact CD1-CG 4.37Å; F171-P173 HydrophobicContact CE1-CB 4.48Å; F171-P173 HydrophobicContact CE1-CG 3.64Å; F171-P173 HydrophobicContact CZ-CB 4.06Å; F171-P173 HydrophobicContact CZ-CG 3.69Å; F171-K183 HydrophobicContact CD2-CG 4.01Å; F171-R210 HydrophobicContact CZ-CG 4.49Å; F171-R210 VanDerWaalsContact CZ-NH2 3.25Å
172	S	97.7	Very high	94.5	Very high	65 Å²	65	61.9 Å²	61.9	46%	0.455	36%	0.36	S	S	.	.			trans	-138.8	71.8	176.2	174	0	0	0	0	109	V170 K183 N184	V170-S172 PolarHBondContact O-N 3.44Å; S172-K183 CarbonylContact C-O 3.56Å; S172-K183 PolarHBondContact N-O 2.05Å; S172-N184 VanDerWaalsContact O-CA 3.29Å; S172-N184 WeakPolarHBondContact O-CA 3.28Å
173	P	97.7	Very high	94.9	Very high	18 Å²	18	64 Å²	64	12%	0.117	37%	0.366	C	S	.	.			trans	-65.9	155.6	-160.5	24.4	-33.6	0	0	0	113.6	F171 T181 Y182 K183 G209 R210	F171-P173 HydrophobicContact CD1-CG 4.37Å; F171-P173 HydrophobicContact CE1-CB 4.48Å; F171-P173 HydrophobicContact CE1-CG 3.64Å; F171-P173 HydrophobicContact CZ-CB 4.06Å; F171-P173 HydrophobicContact CZ-CG 3.69Å; P173-T181 HydrophobicContact CB-CG2 4Å; P173-Y182 WeakPolarHBondContact CA-O 3.48Å; P173-Y182 WeakPolarHBondContact CB-O 3.08Å; P173-K183 WeakPolarHBondContact CA-O 3.02Å; P173-G209 CarbonylContact O-C 3.54Å; P173-G209 WeakPolarHBondContact O-CA 3.45Å; P173-G209 PolarHBondContact O-N 2.81Å; P173-R210 HydrophobicContact CB-CG 3.99Å; P173-R210 HydrophobicContact CG-CG 3.78Å
174	V	97.6	Very high	95.1	Very high	2 Å²	2	63.9 Å²	63.9	1%	0.012	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	150.9	173.8	-63.7	0	0	0	0	109.9	T181 Y182 F188 F205 G209	V174-T181 WeakPolarHBondContact O-CA 3.04Å; V174-Y182 HydrophobicContact CG2-CD2 4.38Å; V174-Y182 PolarHBondContact N-O 3.34Å; V174-Y182 VanDerWaalsContact N-O 3.07Å; V174-Y182 PolarHBondContact O-N 3.18Å; V174-F188 HydrophobicContact CG2-CB 3.54Å; V174-F188 HydrophobicContact CG2-CD1 4.4Å; V174-F188 HydrophobicContact CG2-CG 3.98Å; V174-F205 HydrophobicContact CB-CD2 4.34Å; V174-F205 HydrophobicContact CB-CE2 3.96Å; V174-F205 HydrophobicContact CG1-CE2 3.94Å; V174-G209 CarbonylContact C-O 3.48Å; V174-G209 WeakPolarHBondContact CA-O 3.31Å
175	C	97.2	Very high	95.6	Very high	5 Å²	5	70 Å²	70	3%	0.034	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	137.2	177.8	-173.8	0	0	0	0	110.5	H206 H207 G209 C211	C175-H206 WeakPolarHBondContact O-CB 3.24Å; C175-H206 PolarHBondContact O-N 2.97Å; C175-H207 WeakPolarHBondContact CB-CE1 3.35Å; C175-H207 PolarHBondContact N-O 3.38Å; C175-H207 PolarHBondContact O-N 3Å; C175-G209 PolarHBondContact N-O 3.01Å; C175-C211 WeakPolarHBondContact CA-SG 3.39Å; C175-C211 HydrophobicContact CB-CB 4Å; C175-C211 WeakPolarHBondContact CB-SG 3.02Å; C175-C211 WeakPolarHBondContact SG-CA 3.31Å; C175-C211 WeakPolarHBondContact SG-CB 3.22Å; C175-C211 CovalentContact SG-SG 2.03Å; C175-C211 PolarHBondContact SG-SG 3.29Å
176	D	96.6	Very high	96.2	Very high	1 Å²	1	66 Å²	66	1%	0.005	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	173.9	168.5	69.5	23.7	0	0	0	112.7	I178 G179 N180 Y182 F188 L203 H204 H206	D176-I178 PolarHBondContact O-N 2.85Å; D176-I178 VanDerWaalsContact OD1-C 3.3Å; D176-I178 WeakPolarHBondContact OD1-CA 3.48Å; D176-I178 PolarHBondContact OD1-N 3.23Å; D176-G179 PolarHBondContact O-N 3.06Å; D176-G179 PolarHBondContact OD1-N 2.93Å; D176-N180 PolarHBondContact N-O 3.49Å; D176-N180 VanDerWaalsContact N-O 3.1Å; D176-N180 PolarHBondContact OD1-N 2.85Å; D176-N180 VanDerWaalsContact OD2-CB 3.28Å; D176-N180 WeakPolarHBondContact OD2-CB 3.49Å; D176-N180 PolarHBondContact OD2-ND2 3.25Å; D176-Y182 HydrophobicContact CB-CE2 3.78Å; D176-Y182 VanDerWaalsContact OD2-CE2 3.22Å; D176-Y182 WeakPolarHBondContact OD2-CE2 3.26Å; D176-Y182 PolarHBondContact OD2-OH 2.94Å; D176-F188 HydrophobicContact CB-CD2 4.42Å; D176-F188 HydrophobicContact CB-CE2 3.84Å; D176-L203 HydrophobicContact CB-CD1 3.9Å; D176-L203 HydrophobicContact CB-CD2 4.02Å; D176-L203 HydrophobicContact CB-CG 3.87Å; D176-L203 WeakPolarHBondContact OD2-CD1 3.4Å; D176-L203 WeakPolarHBondContact OD2-CD2 3.37Å; D176-H204 CarbonylContact C-O 3.56Å; D176-H204 VanDerWaalsContact CA-O 3.24Å; D176-H204 WeakPolarHBondContact CA-O 3.46Å; D176-H204 WeakPolarHBondContact CB-O 3.2Å; D176-H206 VanDerWaalsContact C-CB 3.49Å; D176-H206 WeakPolarHBondContact O-CB 3.22Å
177	T	95.1	Very high	96.4	Very high	74 Å²	74	61.2 Å²	61.2	45%	0.454	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-6.9	178.2	53.3	0	0	0	0	114.6	H204 H206	T177-H204 HydrophobicContact CG2-CB 3.63Å; T177-H204 PolarHBondContact N-O 3.27Å; T177-H206 HydrophobicContact CG2-CB 4.16Å
178	I	92.8	Very high	96.4	Very high	103 Å²	103	60.7 Å²	60.7	53%	0.528	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.7	-4.9	179.1	-51.6	-179.9	0	0	0	110.6	D176 F195 L203	D176-I178 PolarHBondContact O-N 2.85Å; D176-I178 VanDerWaalsContact OD1-C 3.3Å; D176-I178 WeakPolarHBondContact OD1-CA 3.48Å; D176-I178 PolarHBondContact OD1-N 3.23Å; I178-F195 HydrophobicContact CD1-CE1 4.31Å; I178-F195 HydrophobicContact CD1-CZ 3.9Å; I178-L203 HydrophobicContact CD1-CD1 3.49Å; I178-L203 VanDerWaalsContact CD1-CD1 3.49Å; I178-L203 HydrophobicContact CG1-CD1 3.89Å
179	G	93.5	Very high	96.4	Very high	46 Å²	46	60.5 Å²	60.5	47%	0.474	33%	0.325	S	S	.	.	S	Bend	trans	90.8	14.4	178.1	0	0	0	0	0	114.6	D176 C211	D176-G179 PolarHBondContact O-N 3.06Å; D176-G179 PolarHBondContact OD1-N 2.93Å; G179-C211 PolarHBondContact O-SG 2.87Å
180	N	94.6	Very high	96.3	Very high	80 Å²	80	57.1 Å²	57.1	43%	0.428	30%	0.303	S	S	.	.	P	Polyproline II helix	trans	-86.3	135.5	172.8	-48.6	-66.3	0	0	0	111.3	D176 Y182 C211	D176-N180 PolarHBondContact N-O 3.49Å; D176-N180 VanDerWaalsContact N-O 3.1Å; D176-N180 PolarHBondContact OD1-N 2.85Å; D176-N180 VanDerWaalsContact OD2-CB 3.28Å; D176-N180 WeakPolarHBondContact OD2-CB 3.49Å; D176-N180 PolarHBondContact OD2-ND2 3.25Å; N180-Y182 HydrophobicContact CB-CE2 3.9Å; N180-Y182 WeakPolarHBondContact O-CE2 3.28Å; N180-C211 PolarHBondContact O-SG 3.28Å
181	T	96.5	Very high	96.2	Very high	65 Å²	65	56.3 Å²	56.3	40%	0.399	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	124.8	175.5	-63.6	0	0	0	0	110.6	P173 V174 R210 C211	P173-T181 HydrophobicContact CB-CG2 4Å; V174-T181 WeakPolarHBondContact O-CA 3.04Å; T181-R210 HydrophobicContact CG2-CB 3.87Å; T181-R210 HydrophobicContact CG2-CG 3.89Å; T181-C211 WeakPolarHBondContact OG1-CB 3.38Å; T181-C211 PolarHBondContact OG1-N 3.44Å; T181-C211 PolarHBondContact OG1-SG 3.23Å; T181-C211 VanDerWaalsContact OG1-SG 3.38Å
182	Y	96.7	Very high	96.1	Very high	28 Å²	28	53.5 Å²	53.5	11%	0.11	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	145.4	174.8	-55.5	-88	0	0	0	110.1	P173 V174 D176 N180 N184 F188 E191 L203	P173-Y182 WeakPolarHBondContact CA-O 3.48Å; P173-Y182 WeakPolarHBondContact CB-O 3.08Å; V174-Y182 HydrophobicContact CG2-CD2 4.38Å; V174-Y182 PolarHBondContact N-O 3.34Å; V174-Y182 VanDerWaalsContact N-O 3.07Å; V174-Y182 PolarHBondContact O-N 3.18Å; D176-Y182 HydrophobicContact CB-CE2 3.78Å; D176-Y182 VanDerWaalsContact OD2-CE2 3.22Å; D176-Y182 WeakPolarHBondContact OD2-CE2 3.26Å; D176-Y182 PolarHBondContact OD2-OH 2.94Å; N180-Y182 HydrophobicContact CB-CE2 3.9Å; N180-Y182 WeakPolarHBondContact O-CE2 3.28Å; Y182-N184 VanDerWaalsContact C-N 3.26Å; Y182-N184 PolarHBondContact O-N 2.8Å; Y182-F188 HydrophobicContact CD1-CB 4.46Å; Y182-F188 HydrophobicContact CD2-CB 3.97Å; Y182-F188 AromaticContact CD2-CD2 3.61Å; Y182-F188 HydrophobicContact CD2-CD2 3.61Å; Y182-F188 HydrophobicContact CD2-CG 4.2Å; Y182-F188 AromaticContact CE2-CD2 3.62Å; Y182-F188 HydrophobicContact CE2-CD2 3.62Å; Y182-F188 HydrophobicContact CE2-CE2 4.29Å; Y182-F188 HydrophobicContact CG-CB 3.83Å; Y182-F188 HydrophobicContact CG-CD2 4.22Å; Y182-E191 HydrophobicContact CD1-CB 4.04Å; Y182-E191 HydrophobicContact CD1-CG 3.81Å; Y182-E191 HydrophobicContact CE1-CB 3.43Å; Y182-E191 VanDerWaalsContact CE1-CB 3.43Å; Y182-E191 HydrophobicContact CE1-CG 3.46Å; Y182-E191 VanDerWaalsContact CE1-CG 3.46Å; Y182-L203 HydrophobicContact CE2-CD2 4.2Å; Y182-L203 WeakPolarHBondContact OH-CD2 3.27Å
183	K	97.5	Very high	95.9	Very high	81 Å²	81	52.5 Å²	52.5	35%	0.352	27%	0.274	S	S	.	.	S	Bend	trans	-56.3	-39.5	-178.4	179.4	-179.5	-69.8	178.7	0	112.6	N169 F171 S172 P173 Y187	N169-K183 PolarHBondContact OD1-NZ 2.03Å; F171-K183 HydrophobicContact CD2-CG 4.01Å; S172-K183 CarbonylContact C-O 3.56Å; S172-K183 PolarHBondContact N-O 2.05Å; P173-K183 WeakPolarHBondContact CA-O 3.02Å; K183-Y187 HydrophobicContact CB-CD2 3.76Å; K183-Y187 HydrophobicContact CB-CE2 4.08Å; K183-Y187 HydrophobicContact CB-CG 4.41Å; K183-Y187 HydrophobicContact CD-CD2 4.3Å; K183-Y187 HydrophobicContact CD-CE2 3.72Å; K183-Y187 HydrophobicContact CG-CD2 4.28Å; K183-Y187 HydrophobicContact CG-CE2 4.18Å
184	N	97.4	Very high	95.7	Very high	9 Å²	9	53.1 Å²	53.1	5%	0.048	27%	0.274	C	S	.	.	S	Bend	trans	-158.6	178.1	172.2	61.2	51.5	0	0	0	111.7	P168 V170 S172 Y182 C186 Y187 F188	P168-N184 PolarHBondContact O-ND2 2.64Å; V170-N184 PolarHBondContact O-ND2 2.94Å; S172-N184 VanDerWaalsContact O-CA 3.29Å; S172-N184 WeakPolarHBondContact O-CA 3.28Å; Y182-N184 VanDerWaalsContact C-N 3.26Å; Y182-N184 PolarHBondContact O-N 2.8Å; N184-C186 VanDerWaalsContact C-N 3.27Å; N184-C186 PolarHBondContact O-N 2.84Å; N184-C186 VanDerWaalsContact OD1-CB 3.27Å; N184-C186 WeakPolarHBondContact OD1-CB 3.38Å; N184-C186 PolarHBondContact OD1-N 3.37Å; N184-Y187 WeakPolarHBondContact ND2-CD2 3.36Å; N184-Y187 PolarHBondContact O-N 3.35Å; N184-Y187 VanDerWaalsContact OD1-CD2 3.28Å; N184-Y187 WeakPolarHBondContact OD1-CD2 3.15Å; N184-Y187 PolarHBondContact OD1-N 2.85Å; N184-F188 PolarHBondContact O-N 2.86Å; N184-F188 VanDerWaalsContact O-N 3.12Å
185	R	97.3	Very high	95.4	Very high	182 Å²	182	55.4 Å²	55.4	69%	0.687	28%	0.284	S	S	*	.	H	α-helix	trans	-58.8	-33.7	-179.1	-171.4	174.5	-179.9	173.2	0.1	113.3	F188 V189	R185-F188 PolarHBondContact O-N 3.18Å; R185-V189 WeakPolarHBondContact O-CG2 3.13Å; R185-V189 PolarHBondContact O-N 3.31Å
186	C	97.1	Very high	95.3	Very high	43 Å²	43	61.8 Å²	61.8	29%	0.291	31%	0.311	S	S	.	.	H	α-helix	trans	-63.8	-48.8	177.2	-179.4	0	0	0	0	111	C167 N184 F188 V189 R190	C167-C186 WeakPolarHBondContact CA-SG 3.47Å; C167-C186 HydrophobicContact CB-CB 3.7Å; C167-C186 WeakPolarHBondContact CB-SG 3.33Å; C167-C186 WeakPolarHBondContact SG-CB 3.23Å; C167-C186 CovalentContact SG-SG 2.05Å; C167-C186 PolarHBondContact SG-SG 3.24Å; N184-C186 VanDerWaalsContact C-N 3.27Å; N184-C186 PolarHBondContact O-N 2.84Å; N184-C186 VanDerWaalsContact OD1-CB 3.27Å; N184-C186 WeakPolarHBondContact OD1-CB 3.38Å; N184-C186 PolarHBondContact OD1-N 3.37Å; C186-F188 VanDerWaalsContact C-N 3.27Å; C186-F188 PolarHBondContact O-N 3.27Å; C186-V189 PolarHBondContact O-N 2.95Å; C186-R190 WeakPolarHBondContact O-CB 3.36Å; C186-R190 PolarHBondContact O-N 3.07Å
187	Y	96.4	Very high	95.1	Very high	56 Å²	56	66.8 Å²	66.8	22%	0.22	33%	0.333	C	S	.	.	H	α-helix	trans	-60.2	-38.1	175.7	-71.3	-78.8	0	0	0	111.9	C167 K183 N184 R190 E191	C167-Y187 HydrophobicContact CB-CD1 4.19Å; C167-Y187 HydrophobicContact CB-CD2 3.95Å; C167-Y187 HydrophobicContact CB-CE1 3.94Å; C167-Y187 HydrophobicContact CB-CE2 3.67Å; C167-Y187 HydrophobicContact CB-CG 4.2Å; C167-Y187 PolarHBondContact SG-N 2.88Å; K183-Y187 HydrophobicContact CB-CD2 3.76Å; K183-Y187 HydrophobicContact CB-CE2 4.08Å; K183-Y187 HydrophobicContact CB-CG 4.41Å; K183-Y187 HydrophobicContact CD-CD2 4.3Å; K183-Y187 HydrophobicContact CD-CE2 3.72Å; K183-Y187 HydrophobicContact CG-CD2 4.28Å; K183-Y187 HydrophobicContact CG-CE2 4.18Å; N184-Y187 WeakPolarHBondContact ND2-CD2 3.36Å; N184-Y187 PolarHBondContact O-N 3.35Å; N184-Y187 VanDerWaalsContact OD1-CD2 3.28Å; N184-Y187 WeakPolarHBondContact OD1-CD2 3.15Å; N184-Y187 PolarHBondContact OD1-N 2.85Å; Y187-R190 WeakPolarHBondContact O-CB 3.12Å; Y187-R190 PolarHBondContact O-N 3.38Å; Y187-E191 WeakPolarHBondContact O-CB 3.38Å; Y187-E191 VanDerWaalsContact O-CG 3.22Å; Y187-E191 WeakPolarHBondContact O-CG 3.32Å; Y187-E191 PolarHBondContact O-N 2.99Å
188	F	97	Very high	94.8	Very high	6 Å²	6	64 Å²	64	3%	0.026	32%	0.317	C	S	.	.	H	α-helix	trans	-63.8	-42.6	175	171.5	-116.7	0	0	0	113.1	V174 D176 Y182 N184 R185 C186 E191 Q192 L203 F205	V174-F188 HydrophobicContact CG2-CB 3.54Å; V174-F188 HydrophobicContact CG2-CD1 4.4Å; V174-F188 HydrophobicContact CG2-CG 3.98Å; D176-F188 HydrophobicContact CB-CD2 4.42Å; D176-F188 HydrophobicContact CB-CE2 3.84Å; Y182-F188 HydrophobicContact CD1-CB 4.46Å; Y182-F188 HydrophobicContact CD2-CB 3.97Å; Y182-F188 AromaticContact CD2-CD2 3.61Å; Y182-F188 HydrophobicContact CD2-CD2 3.61Å; Y182-F188 HydrophobicContact CD2-CG 4.2Å; Y182-F188 AromaticContact CE2-CD2 3.62Å; Y182-F188 HydrophobicContact CE2-CD2 3.62Å; Y182-F188 HydrophobicContact CE2-CE2 4.29Å; Y182-F188 HydrophobicContact CG-CB 3.83Å; Y182-F188 HydrophobicContact CG-CD2 4.22Å; N184-F188 PolarHBondContact O-N 2.86Å; N184-F188 VanDerWaalsContact O-N 3.12Å; R185-F188 PolarHBondContact O-N 3.18Å; C186-F188 VanDerWaalsContact C-N 3.27Å; C186-F188 PolarHBondContact O-N 3.27Å; F188-E191 PolarHBondContact O-N 3.11Å; F188-Q192 VanDerWaalsContact CD1-NE2 3.29Å; F188-Q192 HydrophobicContact CD2-CG 4.36Å; F188-Q192 HydrophobicContact CE1-CG 4.19Å; F188-Q192 HydrophobicContact CE2-CG 3.85Å; F188-Q192 VanDerWaalsContact CZ-CD 3.49Å; F188-Q192 HydrophobicContact CZ-CG 3.73Å; F188-Q192 VanDerWaalsContact CZ-NE2 3.31Å; F188-Q192 WeakPolarHBondContact O-CG 3.46Å; F188-Q192 PolarHBondContact O-N 2.78Å; F188-L203 HydrophobicContact CD2-CD2 4.09Å; F188-L203 HydrophobicContact CE2-CD2 3.68Å; F188-L203 HydrophobicContact CE2-CG 3.93Å; F188-F205 HydrophobicContact CE1-CB 3.73Å; F188-F205 HydrophobicContact CE1-CD2 4.28Å; F188-F205 HydrophobicContact CZ-CB 3.88Å
189	V	95.8	Very high	94.7	Very high	76 Å²	76	63.9 Å²	63.9	46%	0.461	31%	0.311	S	S	.	.	H	α-helix	trans	-66.4	-39.9	176.8	171.4	0	0	0	0	111.6	R185 C186 E191 Q192 C193	R185-V189 WeakPolarHBondContact O-CG2 3.13Å; R185-V189 PolarHBondContact O-N 3.31Å; C186-V189 PolarHBondContact O-N 2.95Å; V189-E191 VanDerWaalsContact C-N 3.29Å; V189-E191 PolarHBondContact O-N 2.79Å; V189-Q192 WeakPolarHBondContact O-CB 3.39Å; V189-Q192 PolarHBondContact O-N 3.24Å; V189-C193 PolarHBondContact O-N 2.99Å
190	R	94.3	Very high	94.6	Very high	55 Å²	55	64.8 Å²	64.8	21%	0.208	32%	0.32	C	S	.	.	H	α-helix	trans	-54.9	-47.6	171.3	171.5	-176.5	-54.2	-174.8	7.5	110.8	C163 N165 C167 C186 Y187 C193 Y194	C163-R190 WeakPolarHBondContact O-CG 3.23Å; N165-R190 PolarHBondContact O-NE 2.96Å; N165-R190 PolarHBondContact O-NH2 3.32Å; C167-R190 VanDerWaalsContact N-NH2 3.18Å; C167-R190 PolarHBondContact SG-NH2 3.05Å; C167-R190 VanDerWaalsContact SG-NH2 3.36Å; C186-R190 WeakPolarHBondContact O-CB 3.36Å; C186-R190 PolarHBondContact O-N 3.07Å; Y187-R190 WeakPolarHBondContact O-CB 3.12Å; Y187-R190 PolarHBondContact O-N 3.38Å; R190-C193 WeakPolarHBondContact O-CB 3.18Å; R190-C193 PolarHBondContact O-N 3.12Å; R190-Y194 HydrophobicContact CG-CD2 3.92Å; R190-Y194 HydrophobicContact CG-CE2 3.48Å; R190-Y194 VanDerWaalsContact CG-CE2 3.48Å; R190-Y194 VanDerWaalsContact O-CD2 3.26Å; R190-Y194 WeakPolarHBondContact O-CD2 3.48Å; R190-Y194 PolarHBondContact O-N 3.3Å; R190-Y194 VanDerWaalsContact O-N 3.09Å
191	E	93.8	Very high	94.6	Very high	71 Å²	71	67.4 Å²	67.4	33%	0.332	33%	0.328	S	S	.	.	H	α-helix	trans	-70.9	-35.6	-179.2	-69.7	-71.2	162.2	0	0	112.8	Y182 Y187 F188 V189 C193 Y194 F195	Y182-E191 HydrophobicContact CD1-CB 4.04Å; Y182-E191 HydrophobicContact CD1-CG 3.81Å; Y182-E191 HydrophobicContact CE1-CB 3.43Å; Y182-E191 VanDerWaalsContact CE1-CB 3.43Å; Y182-E191 HydrophobicContact CE1-CG 3.46Å; Y182-E191 VanDerWaalsContact CE1-CG 3.46Å; Y187-E191 WeakPolarHBondContact O-CB 3.38Å; Y187-E191 VanDerWaalsContact O-CG 3.22Å; Y187-E191 WeakPolarHBondContact O-CG 3.32Å; Y187-E191 PolarHBondContact O-N 2.99Å; F188-E191 PolarHBondContact O-N 3.11Å; V189-E191 VanDerWaalsContact C-N 3.29Å; V189-E191 PolarHBondContact O-N 2.79Å; E191-C193 VanDerWaalsContact C-N 3.29Å; E191-C193 PolarHBondContact O-N 2.7Å; E191-Y194 PolarHBondContact O-N 3.2Å; E191-F195 VanDerWaalsContact O-CB 3.32Å; E191-F195 WeakPolarHBondContact O-CB 3.29Å; E191-F195 PolarHBondContact O-N 2.8Å
192	Q	95.2	Very high	94.5	Very high	57 Å²	57	68 Å²	68	27%	0.266	33%	0.332	S	S	.	.	H	α-helix	trans	-56.1	-43.9	168.3	-78.7	-179.4	80.1	0	0	112.1	F188 V189 F195 K196 L203	F188-Q192 VanDerWaalsContact CD1-NE2 3.29Å; F188-Q192 HydrophobicContact CD2-CG 4.36Å; F188-Q192 HydrophobicContact CE1-CG 4.19Å; F188-Q192 HydrophobicContact CE2-CG 3.85Å; F188-Q192 VanDerWaalsContact CZ-CD 3.49Å; F188-Q192 HydrophobicContact CZ-CG 3.73Å; F188-Q192 VanDerWaalsContact CZ-NE2 3.31Å; F188-Q192 WeakPolarHBondContact O-CG 3.46Å; F188-Q192 PolarHBondContact O-N 2.78Å; V189-Q192 WeakPolarHBondContact O-CB 3.39Å; V189-Q192 PolarHBondContact O-N 3.24Å; Q192-F195 PolarHBondContact O-N 2.9Å; Q192-K196 WeakPolarHBondContact O-CB 3.42Å; Q192-K196 PolarHBondContact O-N 2.87Å; Q192-L203 HydrophobicContact CG-CB 3.95Å; Q192-L203 HydrophobicContact CG-CD2 4.45Å; Q192-L203 VanDerWaalsContact CG-O 3.31Å; Q192-L203 WeakPolarHBondContact CG-O 3.22Å; Q192-L203 PolarHBondContact OE1-O 3.11Å
193	C	94.8	Very high	94.4	Very high	45 Å²	45	66.8 Å²	66.8	30%	0.304	33%	0.327	S	S	.	.	H	α-helix	trans	-63.5	-44.9	178.5	-178.1	0	0	0	0	111.2	C163 V189 R190 E191 K197	C163-C193 HydrophobicContact CB-CB 3.57Å; C163-C193 WeakPolarHBondContact CB-SG 3.29Å; C163-C193 WeakPolarHBondContact SG-CB 3.3Å; C163-C193 CovalentContact SG-SG 2.03Å; C163-C193 PolarHBondContact SG-SG 3.38Å; V189-C193 PolarHBondContact O-N 2.99Å; R190-C193 WeakPolarHBondContact O-CB 3.18Å; R190-C193 PolarHBondContact O-N 3.12Å; E191-C193 VanDerWaalsContact C-N 3.29Å; E191-C193 PolarHBondContact O-N 2.7Å; C193-K197 WeakPolarHBondContact O-CG 3.42Å; C193-K197 PolarHBondContact O-N 2.91Å
194	Y	92.2	Very high	94.4	Very high	30 Å²	30	68 Å²	68	12%	0.118	33%	0.334	C	S	.	.	H	α-helix	trans	-62.5	-47.1	174.4	-73.8	-54.2	0	0	0	112.7	P125 I133 P162 C163 S164 R190 E191 K196 K197 A198	P125-Y194 HydrophobicContact CB-CD1 4.12Å; P125-Y194 HydrophobicContact CG-CD1 4.28Å; P125-Y194 HydrophobicContact CG-CG 4.23Å; I133-Y194 HydrophobicContact CD1-CD1 3.68Å; I133-Y194 HydrophobicContact CD1-CE1 3.84Å; I133-Y194 HydrophobicContact CG2-CD1 4.17Å; P162-Y194 WeakPolarHBondContact O-CE1 2.99Å; C163-Y194 HydrophobicContact CB-CD1 4.02Å; C163-Y194 HydrophobicContact CB-CD2 4.32Å; C163-Y194 HydrophobicContact CB-CE1 3.76Å; C163-Y194 HydrophobicContact CB-CE2 4.09Å; C163-Y194 HydrophobicContact CB-CG 4.28Å; S164-Y194 PolarHBondContact OG-OH 3.33Å; R190-Y194 HydrophobicContact CG-CD2 3.92Å; R190-Y194 HydrophobicContact CG-CE2 3.48Å; R190-Y194 VanDerWaalsContact CG-CE2 3.48Å; R190-Y194 VanDerWaalsContact O-CD2 3.26Å; R190-Y194 WeakPolarHBondContact O-CD2 3.48Å; R190-Y194 PolarHBondContact O-N 3.3Å; R190-Y194 VanDerWaalsContact O-N 3.09Å; E191-Y194 PolarHBondContact O-N 3.2Å; Y194-K196 VanDerWaalsContact C-N 3.31Å; Y194-K196 PolarHBondContact O-N 2.03Å; Y194-K197 PolarHBondContact O-N 3.1Å; Y194-A198 WeakPolarHBondContact O-CB 3.37Å; Y194-A198 PolarHBondContact O-N 2.8Å
195	F	92.5	Very high	94.4	Very high	51 Å²	51	71.9 Å²	71.9	22%	0.224	35%	0.35	C	S	.	.	H	α-helix	trans	-61.3	-41.4	-178.1	-161.3	-109.6	0	0	0	111.5	I178 E191 Q192 Y199 K201 L203	I178-F195 HydrophobicContact CD1-CE1 4.31Å; I178-F195 HydrophobicContact CD1-CZ 3.9Å; E191-F195 VanDerWaalsContact O-CB 3.32Å; E191-F195 WeakPolarHBondContact O-CB 3.29Å; E191-F195 PolarHBondContact O-N 2.8Å; Q192-F195 PolarHBondContact O-N 2.9Å; F195-Y199 AromaticContact CD2-CD2 3.71Å; F195-Y199 HydrophobicContact CD2-CD2 3.71Å; F195-Y199 HydrophobicContact CD2-CE2 4.13Å; F195-Y199 HydrophobicContact CD2-CG 4.43Å; F195-Y199 HydrophobicContact CE2-CD2 4.04Å; F195-Y199 HydrophobicContact CE2-CE2 4.44Å; F195-Y199 HydrophobicContact CE2-CG 4.4Å; F195-Y199 HydrophobicContact CG-CD2 4.34Å; F195-Y199 WeakPolarHBondContact O-CB 3.36Å; F195-Y199 PolarHBondContact O-N 2.75Å; F195-K201 CarbonylContact C-O 3.52Å; F195-K201 HydrophobicContact CD1-CB 3.8Å; F195-K201 VanDerWaalsContact CD1-O 3.23Å; F195-K201 WeakPolarHBondContact CD1-O 3.48Å; F195-K201 HydrophobicContact CE1-CB 3.38Å; F195-K201 HydrophobicContact CE1-CD 4.31Å; F195-K201 HydrophobicContact CE1-CG 4.46Å; F195-K201 HydrophobicContact CZ-CB 4.23Å; F195-K201 HydrophobicContact CZ-CD 4.45Å; F195-L203 HydrophobicContact CB-CB 4.24Å; F195-L203 HydrophobicContact CD1-CB 3.86Å; F195-L203 HydrophobicContact CG-CB 4.22Å
196	K	93.7	Very high	94.3	Very high	138 Å²	138	67.1 Å²	67.1	60%	0.6	34%	0.336	S	S	*	.	H	α-helix	trans	-63.5	-48.2	174.7	-172.8	175.1	-178.9	177.7	0	112	Q192 Y194 G200 K201	Q192-K196 WeakPolarHBondContact O-CB 3.42Å; Q192-K196 PolarHBondContact O-N 2.87Å; Y194-K196 VanDerWaalsContact C-N 3.31Å; Y194-K196 PolarHBondContact O-N 2.03Å; K196-G200 WeakPolarHBondContact O-CA 3.35Å; K196-G200 PolarHBondContact O-N 3.25Å; K196-K201 WeakPolarHBondContact CA-O 3.42Å; K196-K201 PolarHBondContact N-O 3.3Å
197	K	92.2	Very high	94.2	Very high	107 Å²	107	65.4 Å²	65.4	47%	0.465	32%	0.323	S	S	.	.	H	α-helix	trans	-71.3	-39.1	-177.3	-72.8	-168.6	169.2	-161.5	0	113.6	I133 P162 C193 Y194	I133-K197 HydrophobicContact CB-CB 4Å; I133-K197 HydrophobicContact CD1-CB 3.94Å; I133-K197 HydrophobicContact CD1-CD 3.54Å; I133-K197 HydrophobicContact CD1-CG 4.33Å; I133-K197 HydrophobicContact CG1-CB 4.16Å; I133-K197 HydrophobicContact CG1-CD 4.02Å; P162-K197 HydrophobicContact CB-CD 4.38Å; C193-K197 WeakPolarHBondContact O-CG 3.42Å; C193-K197 PolarHBondContact O-N 2.91Å; Y194-K197 PolarHBondContact O-N 3.1Å
198	A	90.1	Very high	94.2	Very high	14 Å²	14	68.5 Å²	68.5	12%	0.116	34%	0.34	C	S	.	.	H	α-helix	trans	-87	-28	-175.3	0	0	0	0	0	114.2	I133 R135 Y194	I133-A198 HydrophobicContact CG2-CB 4.16Å; R135-A198 HydrophobicContact CG-CB 4.33Å; Y194-A198 WeakPolarHBondContact O-CB 3.37Å; Y194-A198 PolarHBondContact O-N 2.8Å
199	Y	89.7	Confident	94.1	Very high	101 Å²	101	69.1 Å²	69.1	40%	0.396	35%	0.347	S	S	.	.	H	α-helix	trans	-121.7	-9.3	-175	-57.3	-88.1	0	0	0	114.2	R135 F195 K201	R135-Y199 HydrophobicContact CB-CE1 4.29Å; R135-Y199 VanDerWaalsContact CD-CE1 3.45Å; R135-Y199 HydrophobicContact CG-CD1 4.09Å; R135-Y199 HydrophobicContact CG-CE1 3.6Å; R135-Y199 HydrophobicContact CG-CE2 4.41Å; F195-Y199 AromaticContact CD2-CD2 3.71Å; F195-Y199 HydrophobicContact CD2-CD2 3.71Å; F195-Y199 HydrophobicContact CD2-CE2 4.13Å; F195-Y199 HydrophobicContact CD2-CG 4.43Å; F195-Y199 HydrophobicContact CE2-CD2 4.04Å; F195-Y199 HydrophobicContact CE2-CE2 4.44Å; F195-Y199 HydrophobicContact CE2-CG 4.4Å; F195-Y199 HydrophobicContact CG-CD2 4.34Å; F195-Y199 WeakPolarHBondContact O-CB 3.36Å; F195-Y199 PolarHBondContact O-N 2.75Å; Y199-K201 PolarHBondContact O-N 2.95Å
200	G	92.1	Very high	94.1	Very high	66 Å²	66	72.6 Å²	72.6	68%	0.68	35%	0.352	S	S	*	.	S	Bend	trans	68.9	18.3	-175.8	0	0	0	0	0	113.5	K196	K196-G200 WeakPolarHBondContact O-CA 3.35Å; K196-G200 PolarHBondContact O-N 3.25Å
201	K	93.5	Very high	94.2	Very high	135 Å²	135	71.1 Å²	71.1	59%	0.587	35%	0.35	S	S	*	.			trans	-118.2	148.4	-177.3	-67.7	-173.3	178.2	-171.1	0	110.9	F195 K196 Y199	F195-K201 CarbonylContact C-O 3.52Å; F195-K201 HydrophobicContact CD1-CB 3.8Å; F195-K201 VanDerWaalsContact CD1-O 3.23Å; F195-K201 WeakPolarHBondContact CD1-O 3.48Å; F195-K201 HydrophobicContact CE1-CB 3.38Å; F195-K201 HydrophobicContact CE1-CD 4.31Å; F195-K201 HydrophobicContact CE1-CG 4.46Å; F195-K201 HydrophobicContact CZ-CB 4.23Å; F195-K201 HydrophobicContact CZ-CD 4.45Å; K196-K201 WeakPolarHBondContact CA-O 3.42Å; K196-K201 PolarHBondContact N-O 3.3Å; Y199-K201 PolarHBondContact O-N 2.95Å
202	T	95.4	Very high	94.2	Very high	77 Å²	77	68.8 Å²	68.8	47%	0.472	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-91.4	132.1	173.7	-56	0	0	0	0	109.5	H204	T202-H204 PolarHBondContact O-CD2 3.47Å
203	L	95.5	Very high	93.8	Very high	3 Å²	3	69.3 Å²	69.3	2%	0.016	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-92	126.3	172.5	-175.5	72.2	0	0	0	108.9	D176 I178 Y182 F188 Q192 F195	D176-L203 HydrophobicContact CB-CD1 3.9Å; D176-L203 HydrophobicContact CB-CD2 4.02Å; D176-L203 HydrophobicContact CB-CG 3.87Å; D176-L203 WeakPolarHBondContact OD2-CD1 3.4Å; D176-L203 WeakPolarHBondContact OD2-CD2 3.37Å; I178-L203 HydrophobicContact CD1-CD1 3.49Å; I178-L203 VanDerWaalsContact CD1-CD1 3.49Å; I178-L203 HydrophobicContact CG1-CD1 3.89Å; Y182-L203 HydrophobicContact CE2-CD2 4.2Å; Y182-L203 WeakPolarHBondContact OH-CD2 3.27Å; F188-L203 HydrophobicContact CD2-CD2 4.09Å; F188-L203 HydrophobicContact CE2-CD2 3.68Å; F188-L203 HydrophobicContact CE2-CG 3.93Å; Q192-L203 HydrophobicContact CG-CB 3.95Å; Q192-L203 HydrophobicContact CG-CD2 4.45Å; Q192-L203 VanDerWaalsContact CG-O 3.31Å; Q192-L203 WeakPolarHBondContact CG-O 3.22Å; Q192-L203 PolarHBondContact OE1-O 3.11Å; F195-L203 HydrophobicContact CB-CB 4.24Å; F195-L203 HydrophobicContact CD1-CB 3.86Å; F195-L203 HydrophobicContact CG-CB 4.22Å
204	H	97.3	Very high	93.1	Very high	107 Å²	107	72.3 Å²	72.3	50%	0.495	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-102.3	143.8	-173.7	-68.5	-82.5	0	0	0	111.6	D176 T177 T202	D176-H204 CarbonylContact C-O 3.56Å; D176-H204 VanDerWaalsContact CA-O 3.24Å; D176-H204 WeakPolarHBondContact CA-O 3.46Å; D176-H204 WeakPolarHBondContact CB-O 3.2Å; T177-H204 HydrophobicContact CG2-CB 3.63Å; T177-H204 PolarHBondContact N-O 3.27Å; T202-H204 PolarHBondContact O-CD2 3.47Å
205	F	97	Very high	92.8	Very high	89 Å²	89	79 Å²	79	39%	0.39	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	139	171.6	173.3	-95.8	0	0	0	109.2	V174 F188 H208	V174-F205 HydrophobicContact CB-CD2 4.34Å; V174-F205 HydrophobicContact CB-CE2 3.96Å; V174-F205 HydrophobicContact CG1-CE2 3.94Å; F188-F205 HydrophobicContact CE1-CB 3.73Å; F188-F205 HydrophobicContact CE1-CD2 4.28Å; F188-F205 HydrophobicContact CZ-CB 3.88Å; F205-H208 AromaticContact CZ-CD2 3.75Å; F205-H208 AromaticContact CZ-NE2 3.83Å
206	H	94.7	Very high	92.4	Very high	83 Å²	83	77.7 Å²	77.7	38%	0.384	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	-63	175.1	-172.1	-70.2	0	0	0	111.6	C175 D176 T177	C175-H206 WeakPolarHBondContact O-CB 3.24Å; C175-H206 PolarHBondContact O-N 2.97Å; D176-H206 VanDerWaalsContact C-CB 3.49Å; D176-H206 WeakPolarHBondContact O-CB 3.22Å; T177-H206 HydrophobicContact CG2-CB 4.16Å
207	H	95.1	Very high	92	Very high	6 Å²	6	79.3 Å²	79.3	3%	0.028	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	165.6	178.6	64.4	57.3	0	0	0	112.6	C175 R210 K249	C175-H207 WeakPolarHBondContact CB-CE1 3.35Å; C175-H207 PolarHBondContact N-O 3.38Å; C175-H207 PolarHBondContact O-N 3Å; H207-R210 PolarHBondContact CE1-O 2.99Å; H207-R210 VanDerWaalsContact CE1-O 3.29Å; H207-K249 HydrophobicContact CB-CB 4.09Å
208	H	95.5	Very high	91.6	Very high	122 Å²	122	84.7 Å²	84.7	57%	0.565	41%	0.413	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.7	153.3	170.4	-73.3	-78.2	0	0	0	111.9	F205	F205-H208 AromaticContact CZ-CD2 3.75Å; F205-H208 AromaticContact CZ-NE2 3.83Å
209	G	95.4	Very high	91.1	Very high	18 Å²	18	88 Å²	88	19%	0.186	43%	0.426	C	S	.	.	S	Bend	trans	83.6	175.5	-174.4	0	0	0	0	0	113.5	P173 V174 C175	P173-G209 CarbonylContact O-C 3.54Å; P173-G209 WeakPolarHBondContact O-CA 3.45Å; P173-G209 PolarHBondContact O-N 2.81Å; V174-G209 CarbonylContact C-O 3.48Å; V174-G209 WeakPolarHBondContact CA-O 3.31Å; C175-G209 PolarHBondContact N-O 3.01Å
210	R	96.3	Very high	90.6	Very high	150 Å²	150	83.5 Å²	83.5	57%	0.566	41%	0.408	S	S	*	.	S	Bend	trans	-62.6	149	173.2	-52.3	-174.6	179.2	-171.2	-7.3	111.1	F171 P173 T181 H207 K249	F171-R210 HydrophobicContact CZ-CG 4.49Å; F171-R210 VanDerWaalsContact CZ-NH2 3.25Å; P173-R210 HydrophobicContact CB-CG 3.99Å; P173-R210 HydrophobicContact CG-CG 3.78Å; T181-R210 HydrophobicContact CG2-CB 3.87Å; T181-R210 HydrophobicContact CG2-CG 3.89Å; H207-R210 PolarHBondContact CE1-O 2.99Å; H207-R210 VanDerWaalsContact CE1-O 3.29Å; R210-K249 WeakPolarHBondContact O-CE 3.35Å
211	C	96.5	Very high	89.7	Confident	24 Å²	24	86 Å²	86	16%	0.162	40%	0.398	C	S	.	.	P	Polyproline II helix	trans	-57.7	146.4	173.6	-63.1	0	0	0	0	111.9	C175 G179 N180 T181 S213	C175-C211 WeakPolarHBondContact CA-SG 3.39Å; C175-C211 HydrophobicContact CB-CB 4Å; C175-C211 WeakPolarHBondContact CB-SG 3.02Å; C175-C211 WeakPolarHBondContact SG-CA 3.31Å; C175-C211 WeakPolarHBondContact SG-CB 3.22Å; C175-C211 CovalentContact SG-SG 2.03Å; C175-C211 PolarHBondContact SG-SG 3.29Å; G179-C211 PolarHBondContact O-SG 2.87Å; N180-C211 PolarHBondContact O-SG 3.28Å; T181-C211 WeakPolarHBondContact OG1-CB 3.38Å; T181-C211 PolarHBondContact OG1-N 3.44Å; T181-C211 PolarHBondContact OG1-SG 3.23Å; T181-C211 VanDerWaalsContact OG1-SG 3.38Å; C211-S213 PolarHBondContact O-N 2.93Å
212	C	94.3	Very high	88.8	Confident	21 Å²	21	86.3 Å²	86.3	14%	0.142	41%	0.406	C	S	.	.	P	Polyproline II helix	trans	-70.5	124.5	170.8	-62.6	0	0	0	0	109.4	L242 C245 L246	C212-L242 HydrophobicContact CB-CD1 3.54Å; C212-C245 VanDerWaalsContact CA-SG 3.54Å; C212-C245 HydrophobicContact CB-CB 3.72Å; C212-C245 WeakPolarHBondContact CB-SG 3.38Å; C212-C245 WeakPolarHBondContact SG-CB 3.3Å; C212-C245 CovalentContact SG-SG 2.04Å; C212-C245 PolarHBondContact SG-SG 2.97Å; C212-L246 HydrophobicContact CB-CD2 4.18Å; C212-L246 HydrophobicContact CB-CG 4.3Å; C212-L246 PolarHBondContact SG-N 3.49Å
213	S	86.1	Confident	87.8	Confident	68 Å²	68	86 Å²	86	48%	0.476	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-75.7	137.1	-178.2	-173.3	0	0	0	0	111	C211 Q215	C211-S213 PolarHBondContact O-N 2.93Å; S213-Q215 VanDerWaalsContact OG-CB 3.3Å; S213-Q215 WeakPolarHBondContact OG-CB 3.41Å; S213-Q215 PolarHBondContact OG-N 3.42Å
214	N	81	Confident	87.4	Confident	109 Å²	109	87.9 Å²	87.9	58%	0.583	42%	0.419	S	S	*	.			trans	-94.8	3.4	164	66.6	-16.3	0	0	0	112.3	C216 Y221	N214-C216 VanDerWaalsContact C-N 3.29Å; N214-C216 PolarHBondContact O-N 2.87Å; N214-Y221 PolarHBondContact O-OH 3.43Å
215	Q	84.6	Confident	87.2	Confident	170 Å²	170	85.2 Å²	85.2	79%	0.794	41%	0.411	S	S	*	.			trans	-78.3	84.5	173.2	-57.7	178.4	9.2	0	0	108.5	S213	S213-Q215 VanDerWaalsContact OG-CB 3.3Å; S213-Q215 WeakPolarHBondContact OG-CB 3.41Å; S213-Q215 PolarHBondContact OG-N 3.42Å
216	C	84.6	Confident	87.1	Confident	23 Å²	23	81 Å²	81	16%	0.155	39%	0.393	C	S	.	.			trans	-88.5	154	177.7	-59.4	0	0	0	0	110.3	N214 E220 Y221 C238	N214-C216 VanDerWaalsContact C-N 3.29Å; N214-C216 PolarHBondContact O-N 2.87Å; C216-E220 HydrophobicContact CB-CB 4.1Å; C216-E220 WeakPolarHBondContact CB-OE2 3.36Å; C216-Y221 HydrophobicContact CB-CD2 4.37Å; C216-Y221 HydrophobicContact CB-CE1 4.45Å; C216-Y221 HydrophobicContact CB-CE2 3.67Å; C216-C238 HydrophobicContact CB-CB 3.43Å; C216-C238 VanDerWaalsContact CB-CB 3.43Å; C216-C238 WeakPolarHBondContact CB-SG 3.33Å; C216-C238 WeakPolarHBondContact SG-CA 3.44Å; C216-C238 WeakPolarHBondContact SG-CB 3.44Å; C216-C238 CovalentContact SG-SG 2.01Å; C216-C238 PolarHBondContact SG-SG 3.22Å
217	R	85.7	Confident	87.1	Confident	173 Å²	173	77.1 Å²	77.1	65%	0.653	37%	0.374	S	S	*	.			trans	-67.9	151.3	171.8	-60	178.8	175.2	-179.3	-4.8	109.2	H219 E220	R217-H219 WeakPolarHBondContact CB-CE1 3.46Å; R217-H219 WeakPolarHBondContact CD-CE1 2.98Å; R217-H219 PolarHBondContact O-N 3.35Å; R217-H219 VanDerWaalsContact O-N 3.15Å; R217-E220 HydrophobicContact CB-CG 4.24Å; R217-E220 WeakPolarHBondContact CB-OE1 3.33Å; R217-E220 VanDerWaalsContact CG-OE1 3.31Å; R217-E220 WeakPolarHBondContact CG-OE1 3.33Å; R217-E220 PolarHBondContact N-OE1 3.48Å; R217-E220 WeakPolarHBondContact O-CB 2.97Å; R217-E220 PolarHBondContact O-N 2.94Å
218	R	82.3	Confident	87.1	Confident	219 Å²	219	76.8 Å²	76.8	83%	0.826	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.3	-41	-175.9	-162.5	-178.9	-153.5	165.2	5.3	113.2	E220 Y221	R218-E220 VanDerWaalsContact C-N 3.27Å; R218-E220 PolarHBondContact O-N 3.15Å; R218-Y221 PolarHBondContact O-N 3.25Å
219	H	80.8	Confident	87	Confident	84 Å²	84	74.3 Å²	74.3	39%	0.389	37%	0.37	S	S	.	.	H	α-helix	trans	-62.5	-32.5	179.2	58.5	-98.8	0	0	0	113	R217 Y221 L222 E223	R217-H219 WeakPolarHBondContact CB-CE1 3.46Å; R217-H219 WeakPolarHBondContact CD-CE1 2.98Å; R217-H219 PolarHBondContact O-N 3.35Å; R217-H219 VanDerWaalsContact O-N 3.15Å; H219-Y221 PolarHBondContact O-N 3.45Å; H219-Y221 VanDerWaalsContact O-N 3.14Å; H219-L222 PolarHBondContact O-N 3.02Å; H219-E223 IonicContact CD2-OE1 2.9Å; H219-E223 PolarHBondContact CD2-OE1 2.62Å; H219-E223 WeakPolarHBondContact O-CG 3.47Å; H219-E223 PolarHBondContact O-N 2.9Å
220	E	79.3	Confident	86.9	Confident	6 Å²	6	76.2 Å²	76.2	3%	0.028	38%	0.384	C	S	.	.	H	α-helix	trans	-68.3	-16.7	-178.7	-59.3	169.8	-139.7	0	0	113.2	C216 R217 R218 N236 L237 C238 R241	C216-E220 HydrophobicContact CB-CB 4.1Å; C216-E220 WeakPolarHBondContact CB-OE2 3.36Å; R217-E220 HydrophobicContact CB-CG 4.24Å; R217-E220 WeakPolarHBondContact CB-OE1 3.33Å; R217-E220 VanDerWaalsContact CG-OE1 3.31Å; R217-E220 WeakPolarHBondContact CG-OE1 3.33Å; R217-E220 PolarHBondContact N-OE1 3.48Å; R217-E220 WeakPolarHBondContact O-CB 2.97Å; R217-E220 PolarHBondContact O-N 2.94Å; R218-E220 VanDerWaalsContact C-N 3.27Å; R218-E220 PolarHBondContact O-N 3.15Å; E220-N236 VanDerWaalsContact O-CB 3.29Å; E220-N236 WeakPolarHBondContact O-CB 3.37Å; E220-L237 HydrophobicContact CB-CB 4.39Å; E220-L237 HydrophobicContact CG-CD2 4.38Å; E220-L237 PolarHBondContact O-N 2.93Å; E220-C238 HydrophobicContact CB-CB 3.92Å; E220-C238 PolarHBondContact O-N 2.99Å; E220-R241 IonicContact OE1-CZ 3.77Å; E220-R241 IonicContact OE1-NH1 3.63Å; E220-R241 PolarHBondContact OE1-NH1 2.01Å; E220-R241 IonicContact OE1-NH2 2.82Å; E220-R241 WeakPolarHBondContact OE2-CD 3.43Å; E220-R241 IonicContact OE2-CZ 2.66Å; E220-R241 IonicContact OE2-NE 3.16Å; E220-R241 IonicContact OE2-NH1 3.9Å; E220-R241 PolarHBondContact OE2-NH1 3.4Å
221	Y	73.7	Confident	86.8	Confident	119 Å²	119	70.5 Å²	70.5	47%	0.467	37%	0.371	S	S	.	.	H	α-helix	trans	-85.9	-24.4	171.8	-66.7	-74.6	0	0	0	112.8	N214 C216 R218 H219 C238	N214-Y221 PolarHBondContact O-OH 3.43Å; C216-Y221 HydrophobicContact CB-CD2 4.37Å; C216-Y221 HydrophobicContact CB-CE1 4.45Å; C216-Y221 HydrophobicContact CB-CE2 3.67Å; R218-Y221 PolarHBondContact O-N 3.25Å; H219-Y221 PolarHBondContact O-N 3.45Å; H219-Y221 VanDerWaalsContact O-N 3.14Å; Y221-C238 HydrophobicContact CD1-CB 4.35Å; Y221-C238 HydrophobicContact CE1-CB 4.2Å
222	L	74.2	Confident	86.7	Confident	141 Å²	141	74 Å²	74	74%	0.738	38%	0.381	S	S	*	.	H	α-helix	trans	-89.7	-24.1	-176.4	-62	174.2	0	0	0	112.2	H219 G224	H219-L222 PolarHBondContact O-N 3.02Å; L222-G224 PolarHBondContact O-N 3.23Å
223	E	74.2	Confident	86.8	Confident	72 Å²	72	76.1 Å²	76.1	34%	0.336	39%	0.394	S	S	.	.	S	Bend	trans	-63.2	118.3	167.5	-69.5	171.6	-151.3	0	0	108.1	H219 N236 L237	H219-E223 IonicContact CD2-OE1 2.9Å; H219-E223 PolarHBondContact CD2-OE1 2.62Å; H219-E223 WeakPolarHBondContact O-CG 3.47Å; H219-E223 PolarHBondContact O-N 2.9Å; E223-N236 WeakPolarHBondContact O-CA 3.19Å; E223-N236 WeakPolarHBondContact O-CB 3.29Å; E223-L237 HydrophobicContact CB-CB 4.34Å; E223-L237 WeakPolarHBondContact OE2-CB 3.29Å; E223-L237 WeakPolarHBondContact OE2-CD2 3.46Å
224	G	85.9	Confident	87.2	Confident	42 Å²	42	73.7 Å²	73.7	43%	0.433	38%	0.375	S	S	.	.			trans	-61.6	-169.4	-176.9	0	0	0	0	0	113.8	L222 K235 N236	L222-G224 PolarHBondContact O-N 3.23Å; G224-K235 CarbonylContact C-O 3.21Å; G224-N236 WeakPolarHBondContact O-CA 2.98Å
225	P	94.8	Very high	87.8	Confident	51 Å²	51	76.6 Å²	76.6	33%	0.331	38%	0.382	S	S	.	.			trans	-58.2	154.9	-179.9	26.1	-34.2	0	0	0	111.3	T233 H234 K235 G261	P225-T233 HydrophobicContact CB-CG2 3.8Å; P225-H234 CarbonylContact C-O 3.36Å; P225-H234 WeakPolarHBondContact CA-O 3.02Å; P225-K235 WeakPolarHBondContact CA-O 3.09Å; P225-G261 CarbonylContact O-C 3.59Å; P225-G261 VanDerWaalsContact O-CA 3.29Å; P225-G261 WeakPolarHBondContact O-CA 3.5Å; P225-G261 PolarHBondContact O-N 3.41Å
226	L	94	Very high	88.1	Confident	1 Å²	1	69 Å²	69	1%	0.005	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	147.4	173.5	66	87.9	0	0	0	110.7	T233 H234 L237 Y240 I257 L260 G261	L226-T233 CarbonylContact O-C 3.42Å; L226-T233 WeakPolarHBondContact O-CA 3.49Å; L226-H234 HydrophobicContact CD1-CB 3.94Å; L226-H234 HydrophobicContact CG-CB 3.99Å; L226-H234 PolarHBondContact N-O 3.04Å; L226-H234 PolarHBondContact O-N 3.12Å; L226-L237 HydrophobicContact CD2-CB 4.33Å; L226-L237 HydrophobicContact CD2-CD1 4.08Å; L226-Y240 HydrophobicContact CD1-CD2 3.76Å; L226-Y240 HydrophobicContact CD1-CE2 4.49Å; L226-Y240 HydrophobicContact CD1-CG 3.88Å; L226-Y240 HydrophobicContact CD2-CG 4.29Å; L226-I257 HydrophobicContact CB-CG2 4.42Å; L226-I257 HydrophobicContact CD1-CD1 4.34Å; L226-I257 HydrophobicContact CD1-CG1 4.03Å; L226-I257 HydrophobicContact CD1-CG2 4.19Å; L226-I257 HydrophobicContact CD2-CD1 4.13Å; L226-L260 HydrophobicContact CB-CD2 4.12Å; L226-G261 CarbonylContact C-O 3.32Å; L226-G261 WeakPolarHBondContact CA-O 3.34Å; L226-G261 PolarHBondContact N-O 3.42Å
227	C	95.4	Very high	88.5	Confident	0 Å²	0	69.1 Å²	69.1	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	130.8	178.1	-173.7	0	0	0	0	110.2	V258 Y259 G261 C263	C227-V258 PolarHBondContact O-N 2.76Å; C227-Y259 HydrophobicContact CB-CD2 3.94Å; C227-Y259 HydrophobicContact CB-CE1 4.28Å; C227-Y259 HydrophobicContact CB-CE2 3.54Å; C227-Y259 HydrophobicContact CB-CG 4.46Å; C227-Y259 PolarHBondContact N-O 2.91Å; C227-G261 PolarHBondContact N-O 3.5Å; C227-C263 WeakPolarHBondContact CA-SG 3.38Å; C227-C263 HydrophobicContact CB-CB 3.96Å; C227-C263 WeakPolarHBondContact CB-SG 3.02Å; C227-C263 WeakPolarHBondContact SG-CA 3.04Å; C227-C263 WeakPolarHBondContact SG-CB 3.39Å; C227-C263 CovalentContact SG-SG 2.03Å; C227-C263 PolarHBondContact SG-SG 3.24Å
228	D	94.5	Very high	88.8	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	169	172.5	79.7	16.5	0	0	0	113.3	A230 G231 R232 H234 Y240 R256	D228-A230 PolarHBondContact O-N 3.4Å; D228-A230 VanDerWaalsContact O-N 3.08Å; D228-A230 WeakPolarHBondContact OD1-CA 3.03Å; D228-A230 WeakPolarHBondContact OD1-CB 3.37Å; D228-A230 PolarHBondContact OD1-N 3.48Å; D228-G231 PolarHBondContact O-N 3.29Å; D228-G231 PolarHBondContact OD1-N 3.21Å; D228-R232 PolarHBondContact N-O 3.01Å; D228-R232 WeakPolarHBondContact OD1-CB 3.48Å; D228-R232 PolarHBondContact OD1-N 3.41Å; D228-R232 IonicContact OD1-NE 2.78Å; D228-R232 IonicContact OD1-NH2 3.84Å; D228-R232 IonicContact OD2-CZ 3.22Å; D228-R232 VanDerWaalsContact OD2-CZ 3.22Å; D228-R232 IonicContact OD2-NE 3.8Å; D228-R232 PolarHBondContact OD2-NE 3.18Å; D228-R232 IonicContact OD2-NH2 2.74Å; D228-R232 PolarHBondContact OD2-NH2 2.04Å; D228-H234 IonicContact OD2-CD2 2.66Å; D228-H234 IonicContact OD2-CE1 2.82Å; D228-H234 IonicContact OD2-NE2 3.12Å; D228-H234 PolarHBondContact OD2-NE2 3.21Å; D228-Y240 HydrophobicContact CB-CE2 4.3Å; D228-R256 CarbonylContact C-O 3.53Å; D228-R256 VanDerWaalsContact CA-O 3.26Å; D228-R256 WeakPolarHBondContact CA-O 3.38Å
229	S	93.6	Very high	89.4	Confident	70 Å²	70	52.4 Å²	52.4	49%	0.49	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-2.2	-176.3	73.2	0	0	0	0	114.2	S255 R256	S229-S255 WeakPolarHBondContact OG-CB 3.45Å; S229-R256 PolarHBondContact N-O 2.88Å; S229-R256 PolarHBondContact OG-N 3.36Å; S229-R256 VanDerWaalsContact OG-N 3.15Å
230	A	93.5	Very high	90	Very high	58 Å²	58	49.8 Å²	49.8	48%	0.479	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.1	8.8	169.8	0	0	0	0	0	111.8	D228 R232 S255	D228-A230 PolarHBondContact O-N 3.4Å; D228-A230 VanDerWaalsContact O-N 3.08Å; D228-A230 WeakPolarHBondContact OD1-CA 3.03Å; D228-A230 WeakPolarHBondContact OD1-CB 3.37Å; D228-A230 PolarHBondContact OD1-N 3.48Å; A230-R232 VanDerWaalsContact C-N 3.32Å; A230-R232 PolarHBondContact O-N 2.98Å; A230-S255 WeakPolarHBondContact CB-OG 3.41Å
231	G	93.4	Very high	90.6	Very high	30 Å²	30	54.7 Å²	54.7	31%	0.309	30%	0.296	S	S	.	.	S	Bend	trans	72.8	22	-178.9	0	0	0	0	0	114.2	D228 C263	D228-G231 PolarHBondContact O-N 3.29Å; D228-G231 PolarHBondContact OD1-N 3.21Å; G231-C263 PolarHBondContact O-SG 3.43Å; G231-C263 VanDerWaalsContact O-SG 3.36Å
232	R	94.5	Very high	91.5	Very high	96 Å²	96	51.8 Å²	51.8	36%	0.362	29%	0.288	S	S	.	.	P	Polyproline II helix	trans	-94.8	127.5	175.4	-58.4	173.9	-63.7	-133.6	-8.6	110.2	D228 A230 H234 F243 S255 C263	D228-R232 PolarHBondContact N-O 3.01Å; D228-R232 WeakPolarHBondContact OD1-CB 3.48Å; D228-R232 PolarHBondContact OD1-N 3.41Å; D228-R232 IonicContact OD1-NE 2.78Å; D228-R232 IonicContact OD1-NH2 3.84Å; D228-R232 IonicContact OD2-CZ 3.22Å; D228-R232 VanDerWaalsContact OD2-CZ 3.22Å; D228-R232 IonicContact OD2-NE 3.8Å; D228-R232 PolarHBondContact OD2-NE 3.18Å; D228-R232 IonicContact OD2-NH2 2.74Å; D228-R232 PolarHBondContact OD2-NH2 2.04Å; A230-R232 VanDerWaalsContact C-N 3.32Å; A230-R232 PolarHBondContact O-N 2.98Å; R232-H234 PolarHBondContact O-CD2 3.39Å; R232-F243 VanDerWaalsContact NH1-CZ 3.3Å; R232-S255 PolarHBondContact NH2-OG 3.14Å; R232-C263 PolarHBondContact O-SG 3.13Å
233	T	96	Very high	92.5	Very high	67 Å²	67	47.9 Å²	47.9	41%	0.411	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	118.1	168.8	-57.3	0	0	0	0	109.6	P225 L226 C263	P225-T233 HydrophobicContact CB-CG2 3.8Å; L226-T233 CarbonylContact O-C 3.42Å; L226-T233 WeakPolarHBondContact O-CA 3.49Å; T233-C263 PolarHBondContact OG1-N 3.35Å
234	H	94.5	Very high	93.4	Very high	16 Å²	16	45 Å²	45	7%	0.074	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	141.3	169.3	-61.8	-93.1	0	0	0	109	P225 L226 D228 R232 N236 A239 Y240 F243	P225-H234 CarbonylContact C-O 3.36Å; P225-H234 WeakPolarHBondContact CA-O 3.02Å; L226-H234 HydrophobicContact CD1-CB 3.94Å; L226-H234 HydrophobicContact CG-CB 3.99Å; L226-H234 PolarHBondContact N-O 3.04Å; L226-H234 PolarHBondContact O-N 3.12Å; D228-H234 IonicContact OD2-CD2 2.66Å; D228-H234 IonicContact OD2-CE1 2.82Å; D228-H234 IonicContact OD2-NE2 3.12Å; D228-H234 PolarHBondContact OD2-NE2 3.21Å; R232-H234 PolarHBondContact O-CD2 3.39Å; H234-N236 PolarHBondContact O-N 3.45Å; H234-A239 HydrophobicContact CB-CB 4.47Å; H234-Y240 AromaticContact CD2-CD2 3.75Å; H234-Y240 AromaticContact NE2-CD2 3.76Å; H234-F243 AromaticContact CE1-CD1 3.48Å; H234-F243 VanDerWaalsContact CE1-CD1 3.48Å; H234-F243 WeakPolarHBondContact CE1-CD1 3.2Å; H234-F243 AromaticContact CE1-CG 3.44Å; H234-F243 VanDerWaalsContact CE1-CG 3.44Å; H234-F243 WeakPolarHBondContact CE1-CG 3.45Å
235	K	93.8	Very high	93.9	Very high	171 Å²	171	44.8 Å²	44.8	74%	0.743	25%	0.245	S	C	*	.	S	Bend	trans	-56.8	-37.4	-177.1	-179.4	176.3	178.3	176.9	0	113.2	G224 P225 A239	G224-K235 CarbonylContact C-O 3.21Å; P225-K235 WeakPolarHBondContact CA-O 3.09Å; K235-A239 HydrophobicContact CB-CB 4.24Å
236	N	92.1	Very high	93.8	Very high	11 Å²	11	44.9 Å²	44.9	6%	0.059	24%	0.242	C	C	.	.	S	Bend	trans	-167.1	177.8	-178.3	55.3	27.6	0	0	0	109.8	E220 E223 G224 H234 C238 A239 Y240	E220-N236 VanDerWaalsContact O-CB 3.29Å; E220-N236 WeakPolarHBondContact O-CB 3.37Å; E223-N236 WeakPolarHBondContact O-CA 3.19Å; E223-N236 WeakPolarHBondContact O-CB 3.29Å; G224-N236 WeakPolarHBondContact O-CA 2.98Å; H234-N236 PolarHBondContact O-N 3.45Å; N236-C238 PolarHBondContact O-N 3.46Å; N236-C238 WeakPolarHBondContact OD1-CB 3.39Å; N236-C238 PolarHBondContact OD1-N 3.02Å; N236-A239 PolarHBondContact O-N 2.89Å; N236-A239 WeakPolarHBondContact OD1-CB 3.42Å; N236-A239 PolarHBondContact OD1-N 3.23Å; N236-Y240 PolarHBondContact O-N 3.34Å; N236-Y240 VanDerWaalsContact O-N 3.13Å
237	L	91.6	Very high	93.9	Very high	24 Å²	24	45.3 Å²	45.3	13%	0.126	25%	0.246	C	C	.	.	H	α-helix	trans	-61.7	-33.6	179.7	-174.9	62.2	0	0	0	112.6	E220 E223 L226 Y240 R241 I257	E220-L237 HydrophobicContact CB-CB 4.39Å; E220-L237 HydrophobicContact CG-CD2 4.38Å; E220-L237 PolarHBondContact O-N 2.93Å; E223-L237 HydrophobicContact CB-CB 4.34Å; E223-L237 WeakPolarHBondContact OE2-CB 3.29Å; E223-L237 WeakPolarHBondContact OE2-CD2 3.46Å; L226-L237 HydrophobicContact CD2-CB 4.33Å; L226-L237 HydrophobicContact CD2-CD1 4.08Å; L237-Y240 HydrophobicContact CD1-CD1 4.05Å; L237-Y240 PolarHBondContact O-N 3.14Å; L237-R241 HydrophobicContact CD1-CG 4.45Å; L237-R241 HydrophobicContact CG-CG 4.38Å; L237-R241 WeakPolarHBondContact O-CB 3.22Å; L237-R241 VanDerWaalsContact O-CG 3.29Å; L237-R241 WeakPolarHBondContact O-CG 3.35Å; L237-R241 PolarHBondContact O-N 3.4Å; L237-I257 HydrophobicContact CD1-CD1 3.95Å
238	C	93.7	Very high	93.8	Very high	10 Å²	10	53.7 Å²	53.7	7%	0.068	28%	0.277	C	S	.	.	H	α-helix	trans	-59.6	-48.9	175.3	173.7	0	0	0	0	111.8	C216 E220 Y221 N236 Y240 R241 L242	C216-C238 HydrophobicContact CB-CB 3.43Å; C216-C238 VanDerWaalsContact CB-CB 3.43Å; C216-C238 WeakPolarHBondContact CB-SG 3.33Å; C216-C238 WeakPolarHBondContact SG-CA 3.44Å; C216-C238 WeakPolarHBondContact SG-CB 3.44Å; C216-C238 CovalentContact SG-SG 2.01Å; C216-C238 PolarHBondContact SG-SG 3.22Å; E220-C238 HydrophobicContact CB-CB 3.92Å; E220-C238 PolarHBondContact O-N 2.99Å; Y221-C238 HydrophobicContact CD1-CB 4.35Å; Y221-C238 HydrophobicContact CE1-CB 4.2Å; N236-C238 PolarHBondContact O-N 3.46Å; N236-C238 WeakPolarHBondContact OD1-CB 3.39Å; N236-C238 PolarHBondContact OD1-N 3.02Å; C238-Y240 VanDerWaalsContact C-N 3.33Å; C238-Y240 PolarHBondContact O-N 3.3Å; C238-R241 PolarHBondContact O-N 2.87Å; C238-L242 PolarHBondContact O-N 3.32Å
239	A	93.2	Very high	93.8	Very high	31 Å²	31	57.5 Å²	57.5	26%	0.256	29%	0.294	S	S	.	.	H	α-helix	trans	-60.7	-42.9	177.7	0	0	0	0	0	111.5	H234 K235 N236 R241 L242 F243	H234-A239 HydrophobicContact CB-CB 4.47Å; K235-A239 HydrophobicContact CB-CB 4.24Å; N236-A239 PolarHBondContact O-N 2.89Å; N236-A239 WeakPolarHBondContact OD1-CB 3.42Å; N236-A239 PolarHBondContact OD1-N 3.23Å; A239-R241 PolarHBondContact O-N 3.21Å; A239-L242 PolarHBondContact O-N 3.5Å; A239-F243 WeakPolarHBondContact O-CB 3.5Å; A239-F243 PolarHBondContact O-N 3.3Å
240	Y	93.6	Very high	93.7	Very high	30 Å²	30	58.2 Å²	58.2	12%	0.118	29%	0.292	C	S	.	.	H	α-helix	trans	-64.1	-39.4	176.1	173.2	-98.4	0	0	0	113	L226 D228 H234 N236 L237 C238 F243 S244 S255 I257	L226-Y240 HydrophobicContact CD1-CD2 3.76Å; L226-Y240 HydrophobicContact CD1-CE2 4.49Å; L226-Y240 HydrophobicContact CD1-CG 3.88Å; L226-Y240 HydrophobicContact CD2-CG 4.29Å; D228-Y240 HydrophobicContact CB-CE2 4.3Å; H234-Y240 AromaticContact CD2-CD2 3.75Å; H234-Y240 AromaticContact NE2-CD2 3.76Å; N236-Y240 PolarHBondContact O-N 3.34Å; N236-Y240 VanDerWaalsContact O-N 3.13Å; L237-Y240 HydrophobicContact CD1-CD1 4.05Å; L237-Y240 PolarHBondContact O-N 3.14Å; C238-Y240 VanDerWaalsContact C-N 3.33Å; C238-Y240 PolarHBondContact O-N 3.3Å; Y240-F243 PolarHBondContact O-N 3.13Å; Y240-S244 WeakPolarHBondContact CE1-OG 3.41Å; Y240-S244 WeakPolarHBondContact CE2-OG 3.17Å; Y240-S244 VanDerWaalsContact CZ-OG 3.25Å; Y240-S244 WeakPolarHBondContact O-CB 3.29Å; Y240-S244 PolarHBondContact O-N 2.95Å; Y240-S244 PolarHBondContact O-OG 2.88Å; Y240-S255 VanDerWaalsContact CE2-O 3.3Å; Y240-S255 WeakPolarHBondContact CE2-O 3.38Å; Y240-S255 PolarHBondContact OH-O 2.03Å; Y240-I257 HydrophobicContact CD1-CD1 3.78Å; Y240-I257 HydrophobicContact CD1-CG1 3.97Å; Y240-I257 HydrophobicContact CD2-CG1 4.23Å; Y240-I257 HydrophobicContact CE1-CD1 3.59Å; Y240-I257 HydrophobicContact CE1-CG1 3.5Å; Y240-I257 HydrophobicContact CE2-CG1 3.79Å; Y240-I257 HydrophobicContact CG-CD1 4.37Å; Y240-I257 HydrophobicContact CG-CG1 4.3Å
241	R	92.8	Very high	93.6	Very high	108 Å²	108	59 Å²	59	41%	0.408	31%	0.307	S	S	.	.	H	α-helix	trans	-64.9	-42.7	177.1	-76.8	173.8	178.9	-166.3	11.5	111.8	E220 L237 C238 A239 S244 C245	E220-R241 IonicContact OE1-CZ 3.77Å; E220-R241 IonicContact OE1-NH1 3.63Å; E220-R241 PolarHBondContact OE1-NH1 2.01Å; E220-R241 IonicContact OE1-NH2 2.82Å; E220-R241 WeakPolarHBondContact OE2-CD 3.43Å; E220-R241 IonicContact OE2-CZ 2.66Å; E220-R241 IonicContact OE2-NE 3.16Å; E220-R241 IonicContact OE2-NH1 3.9Å; E220-R241 PolarHBondContact OE2-NH1 3.4Å; L237-R241 HydrophobicContact CD1-CG 4.45Å; L237-R241 HydrophobicContact CG-CG 4.38Å; L237-R241 WeakPolarHBondContact O-CB 3.22Å; L237-R241 VanDerWaalsContact O-CG 3.29Å; L237-R241 WeakPolarHBondContact O-CG 3.35Å; L237-R241 PolarHBondContact O-N 3.4Å; C238-R241 PolarHBondContact O-N 2.87Å; A239-R241 PolarHBondContact O-N 3.21Å; R241-S244 PolarHBondContact O-N 2.85Å; R241-C245 WeakPolarHBondContact O-CB 3.44Å; R241-C245 PolarHBondContact O-N 2.79Å
242	L	92.9	Very high	93.6	Very high	58 Å²	58	66 Å²	66	30%	0.304	32%	0.324	S	S	.	.	H	α-helix	trans	-60.8	-49.9	174.3	178.7	58.2	0	0	0	110.7	C212 C238 A239 S244 C245 L246	C212-L242 HydrophobicContact CB-CD1 3.54Å; C238-L242 PolarHBondContact O-N 3.32Å; A239-L242 PolarHBondContact O-N 3.5Å; L242-S244 VanDerWaalsContact C-N 3.34Å; L242-S244 PolarHBondContact O-N 3.19Å; L242-C245 PolarHBondContact O-N 2.88Å; L242-L246 HydrophobicContact CD1-CD1 4.17Å; L242-L246 HydrophobicContact CD1-CG 4.36Å; L242-L246 HydrophobicContact CG-CD1 4.2Å; L242-L246 WeakPolarHBondContact O-CG 3.46Å; L242-L246 PolarHBondContact O-N 3.36Å
243	F	93.9	Very high	93.5	Very high	60 Å²	60	69.5 Å²	69.5	26%	0.263	35%	0.349	S	S	.	.	H	α-helix	trans	-55.7	-49.2	175.9	170.1	-95.4	0	0	0	111.8	R232 H234 A239 Y240 C245 L246 A247	R232-F243 VanDerWaalsContact NH1-CZ 3.3Å; H234-F243 AromaticContact CE1-CD1 3.48Å; H234-F243 VanDerWaalsContact CE1-CD1 3.48Å; H234-F243 WeakPolarHBondContact CE1-CD1 3.2Å; H234-F243 AromaticContact CE1-CG 3.44Å; H234-F243 VanDerWaalsContact CE1-CG 3.44Å; H234-F243 WeakPolarHBondContact CE1-CG 3.45Å; A239-F243 WeakPolarHBondContact O-CB 3.5Å; A239-F243 PolarHBondContact O-N 3.3Å; Y240-F243 PolarHBondContact O-N 3.13Å; F243-C245 VanDerWaalsContact C-N 3.32Å; F243-C245 PolarHBondContact O-N 3.45Å; F243-L246 PolarHBondContact O-N 3.43Å; F243-A247 PolarHBondContact O-N 3.15Å
244	S	94.3	Very high	93.4	Very high	10 Å²	10	67.5 Å²	67.5	7%	0.07	34%	0.336	C	S	.	.	H	α-helix	trans	-63.6	-38.7	-178	-66.9	0	0	0	0	112.1	Y240 R241 L242 R248	Y240-S244 WeakPolarHBondContact CE1-OG 3.41Å; Y240-S244 WeakPolarHBondContact CE2-OG 3.17Å; Y240-S244 VanDerWaalsContact CZ-OG 3.25Å; Y240-S244 WeakPolarHBondContact O-CB 3.29Å; Y240-S244 PolarHBondContact O-N 2.95Å; Y240-S244 PolarHBondContact O-OG 2.88Å; R241-S244 PolarHBondContact O-N 2.85Å; L242-S244 VanDerWaalsContact C-N 3.34Å; L242-S244 PolarHBondContact O-N 3.19Å; S244-R248 WeakPolarHBondContact O-CG 3.38Å; S244-R248 PolarHBondContact O-N 3.33Å
245	C	95.3	Very high	93.3	Very high	39 Å²	39	67.8 Å²	67.8	26%	0.264	34%	0.341	S	S	.	.	H	α-helix	trans	-61.8	-50.4	173.7	177.1	0	0	0	0	110.9	C212 R241 L242 F243 A247 R248 K249	C212-C245 VanDerWaalsContact CA-SG 3.54Å; C212-C245 HydrophobicContact CB-CB 3.72Å; C212-C245 WeakPolarHBondContact CB-SG 3.38Å; C212-C245 WeakPolarHBondContact SG-CB 3.3Å; C212-C245 CovalentContact SG-SG 2.04Å; C212-C245 PolarHBondContact SG-SG 2.97Å; R241-C245 WeakPolarHBondContact O-CB 3.44Å; R241-C245 PolarHBondContact O-N 2.79Å; L242-C245 PolarHBondContact O-N 2.88Å; F243-C245 VanDerWaalsContact C-N 3.32Å; F243-C245 PolarHBondContact O-N 3.45Å; C245-A247 VanDerWaalsContact C-N 3.33Å; C245-A247 PolarHBondContact O-N 3.37Å; C245-R248 WeakPolarHBondContact O-CB 3.48Å; C245-R248 PolarHBondContact O-N 3.48Å; C245-K249 WeakPolarHBondContact O-CG 2.99Å; C245-K249 PolarHBondContact O-N 2.7Å
246	L	94.2	Very high	93.3	Very high	52 Å²	52	69.3 Å²	69.3	27%	0.272	34%	0.342	S	S	.	.	H	α-helix	trans	-62.6	-39.5	-179.6	-68.9	171	0	0	0	112.2	C212 L242 F243 R248 K249 N250	C212-L246 HydrophobicContact CB-CD2 4.18Å; C212-L246 HydrophobicContact CB-CG 4.3Å; C212-L246 PolarHBondContact SG-N 3.49Å; L242-L246 HydrophobicContact CD1-CD1 4.17Å; L242-L246 HydrophobicContact CD1-CG 4.36Å; L242-L246 HydrophobicContact CG-CD1 4.2Å; L242-L246 WeakPolarHBondContact O-CG 3.46Å; L242-L246 PolarHBondContact O-N 3.36Å; F243-L246 PolarHBondContact O-N 3.43Å; L246-R248 VanDerWaalsContact C-N 3.34Å; L246-R248 PolarHBondContact O-N 2.8Å; L246-K249 PolarHBondContact O-N 2.74Å; L246-N250 PolarHBondContact O-N 3Å; L246-N250 PolarHBondContact O-ND2 2.81Å
247	A	94.5	Very high	93.4	Very high	10 Å²	10	72 Å²	72	8%	0.083	36%	0.355	C	S	.	.	H	α-helix	trans	-55.9	-50	173.9	0	0	0	0	0	111	F243 C245 K249 N250 G251 R252 P254	F243-A247 PolarHBondContact O-N 3.15Å; C245-A247 VanDerWaalsContact C-N 3.33Å; C245-A247 PolarHBondContact O-N 3.37Å; A247-K249 VanDerWaalsContact C-N 3.33Å; A247-K249 PolarHBondContact O-N 2.73Å; A247-N250 CarbonylContact O-C 3.1Å; A247-N250 PolarHBondContact O-N 3.43Å; A247-N250 VanDerWaalsContact O-N 3.12Å; A247-G251 PolarHBondContact O-N 2.87Å; A247-R252 CarbonylContact C-O 3.49Å; A247-R252 HydrophobicContact CB-CB 4.33Å; A247-R252 WeakPolarHBondContact O-CA 3.26Å; A247-R252 WeakPolarHBondContact O-CB 3.37Å; A247-R252 PolarHBondContact O-N 2.97Å; A247-R252 VanDerWaalsContact O-O 3.08Å; A247-P254 HydrophobicContact CB-CB 4.24Å
248	R	95.1	Very high	93.4	Very high	176 Å²	176	73 Å²	73	66%	0.664	36%	0.362	S	S	*	.	H	α-helix	trans	-60.8	-40.4	177.3	-68.8	173.1	179.3	178.9	1.6	112.3	S244 C245 L246 N250 G251 R252 P254	S244-R248 WeakPolarHBondContact O-CG 3.38Å; S244-R248 PolarHBondContact O-N 3.33Å; C245-R248 WeakPolarHBondContact O-CB 3.48Å; C245-R248 PolarHBondContact O-N 3.48Å; L246-R248 VanDerWaalsContact C-N 3.34Å; L246-R248 PolarHBondContact O-N 2.8Å; R248-N250 PolarHBondContact O-N 2.81Å; R248-G251 PolarHBondContact O-N 2.82Å; R248-G251 VanDerWaalsContact O-N 3.14Å; R248-R252 WeakPolarHBondContact CA-O 3.48Å; R248-R252 PolarHBondContact N-O 3.45Å; R248-P254 HydrophobicContact CG-CG 4.18Å
249	K	93.1	Very high	93.4	Very high	80 Å²	80	74.8 Å²	74.8	35%	0.348	37%	0.368	S	S	.	.	H	α-helix	trans	-64.2	-28.8	177.5	-66.1	-52.4	-169.9	-175.5	0	113.2	H207 R210 C245 L246 A247 G251	H207-K249 HydrophobicContact CB-CB 4.09Å; R210-K249 WeakPolarHBondContact O-CE 3.35Å; C245-K249 WeakPolarHBondContact O-CG 2.99Å; C245-K249 PolarHBondContact O-N 2.7Å; L246-K249 PolarHBondContact O-N 2.74Å; A247-K249 VanDerWaalsContact C-N 3.33Å; A247-K249 PolarHBondContact O-N 2.73Å; K249-G251 VanDerWaalsContact C-N 3.31Å
250	N	90.9	Very high	93.3	Very high	85 Å²	85	79.7 Å²	79.7	46%	0.455	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	15.1	177	-64.9	-17.8	0	0	0	113	L246 A247 R248 R252	L246-N250 PolarHBondContact O-N 3Å; L246-N250 PolarHBondContact O-ND2 2.81Å; A247-N250 CarbonylContact O-C 3.1Å; A247-N250 PolarHBondContact O-N 3.43Å; A247-N250 VanDerWaalsContact O-N 3.12Å; R248-N250 PolarHBondContact O-N 2.81Å; N250-R252 VanDerWaalsContact C-N 3.25Å; N250-R252 PolarHBondContact O-N 3Å
251	G	91.8	Very high	93.2	Very high	76 Å²	76	79.4 Å²	79.4	78%	0.784	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.9	15	179.1	0	0	0	0	0	114.5	A247 R248 K249	A247-G251 PolarHBondContact O-N 2.87Å; R248-G251 PolarHBondContact O-N 2.82Å; R248-G251 VanDerWaalsContact O-N 3.14Å; K249-G251 VanDerWaalsContact C-N 3.31Å
252	R	93.7	Very high	93.2	Very high	177 Å²	177	77.3 Å²	77.3	67%	0.668	40%	0.397	S	S	*	.	P	Polyproline II helix	trans	-101.2	144.5	178.7	-60.5	178.8	-178.7	163.3	-0.8	110.4	A247 R248 N250	A247-R252 CarbonylContact C-O 3.49Å; A247-R252 HydrophobicContact CB-CB 4.33Å; A247-R252 WeakPolarHBondContact O-CA 3.26Å; A247-R252 WeakPolarHBondContact O-CB 3.37Å; A247-R252 PolarHBondContact O-N 2.97Å; A247-R252 VanDerWaalsContact O-O 3.08Å; R248-R252 WeakPolarHBondContact CA-O 3.48Å; R248-R252 PolarHBondContact N-O 3.45Å; N250-R252 VanDerWaalsContact C-N 3.25Å; N250-R252 PolarHBondContact O-N 3Å
253	L	92.5	Very high	93.3	Very high	169 Å²	169	76 Å²	76	89%	0.885	39%	0.392	S	S	*	.	P	Polyproline II helix	trans	-73.8	129.2	167.7	-67.5	174.5	0	0	0	109.1
254	P	93	Very high	93.1	Very high	24 Å²	24	82.7 Å²	82.7	16%	0.156	42%	0.416	C	S	.	.	P	Polyproline II helix	trans	-68.4	138	175.8	29.7	-34.1	0	0	0	109.9	A247 R248	A247-P254 HydrophobicContact CB-CB 4.24Å; R248-P254 HydrophobicContact CG-CG 4.18Å
255	S	93.3	Very high	92.5	Very high	23 Å²	23	89.8 Å²	89.8	16%	0.161	45%	0.452	C	S	.	.	P	Polyproline II helix	trans	-59.7	141	171.3	-62.2	0	0	0	0	109.8	S229 A230 R232 Y240	S229-S255 WeakPolarHBondContact OG-CB 3.45Å; A230-S255 WeakPolarHBondContact CB-OG 3.41Å; R232-S255 PolarHBondContact NH2-OG 3.14Å; Y240-S255 VanDerWaalsContact CE2-O 3.3Å; Y240-S255 WeakPolarHBondContact CE2-O 3.38Å; Y240-S255 PolarHBondContact OH-O 2.03Å
256	R	94.4	Very high	91.8	Very high	203 Å²	203	92.7 Å²	92.7	77%	0.766	47%	0.471	S	S	*	.	P	Polyproline II helix	trans	-78.5	150	-178	-64.4	177.6	-179.5	164.5	-0.6	109.6	D228 S229 V258	D228-R256 CarbonylContact C-O 3.53Å; D228-R256 VanDerWaalsContact CA-O 3.26Å; D228-R256 WeakPolarHBondContact CA-O 3.38Å; S229-R256 PolarHBondContact N-O 2.88Å; S229-R256 PolarHBondContact OG-N 3.36Å; S229-R256 VanDerWaalsContact OG-N 3.15Å; R256-V258 PolarHBondContact O-N 3.08Å
257	I	92.9	Very high	91	Very high	66 Å²	66	92.5 Å²	92.5	34%	0.338	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	130.1	167.6	-53.2	-179.3	0	0	0	107.6	L226 L237 Y240	L226-I257 HydrophobicContact CB-CG2 4.42Å; L226-I257 HydrophobicContact CD1-CD1 4.34Å; L226-I257 HydrophobicContact CD1-CG1 4.03Å; L226-I257 HydrophobicContact CD1-CG2 4.19Å; L226-I257 HydrophobicContact CD2-CD1 4.13Å; L237-I257 HydrophobicContact CD1-CD1 3.95Å; Y240-I257 HydrophobicContact CD1-CD1 3.78Å; Y240-I257 HydrophobicContact CD1-CG1 3.97Å; Y240-I257 HydrophobicContact CD2-CG1 4.23Å; Y240-I257 HydrophobicContact CE1-CD1 3.59Å; Y240-I257 HydrophobicContact CE1-CG1 3.5Å; Y240-I257 HydrophobicContact CE2-CG1 3.79Å; Y240-I257 HydrophobicContact CG-CD1 4.37Å; Y240-I257 HydrophobicContact CG-CG1 4.3Å
258	V	93.2	Very high	89.9	Confident	45 Å²	45	95.7 Å²	95.7	27%	0.273	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	-54.5	174.9	-175.4	0	0	0	0	109.4	C227 R256 V267	C227-V258 PolarHBondContact O-N 2.76Å; R256-V258 PolarHBondContact O-N 3.08Å; V258-V267 HydrophobicContact CG2-CG1 4.3Å
259	Y	91.8	Very high	88.4	Confident	48 Å²	48	91.3 Å²	91.3	19%	0.188	49%	0.486	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	164.2	176.6	55	-104.6	0	0	0	111.6	C227 C263 R264	C227-Y259 HydrophobicContact CB-CD2 3.94Å; C227-Y259 HydrophobicContact CB-CE1 4.28Å; C227-Y259 HydrophobicContact CB-CE2 3.54Å; C227-Y259 HydrophobicContact CB-CG 4.46Å; C227-Y259 PolarHBondContact N-O 2.91Å; Y259-C263 WeakPolarHBondContact OH-CA 3.47Å; Y259-R264 PolarHBondContact OH-N 2.91Å
260	L	91	Very high	86.8	Confident	134 Å²	134	93.9 Å²	93.9	70%	0.702	50%	0.504	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.7	129.7	170	-59.8	177.9	0	0	0	109.2	L226	L226-L260 HydrophobicContact CB-CD2 4.12Å
261	G	91.7	Very high	84.4	Confident	25 Å²	25	104.8 Å²	104.8	26%	0.258	54%	0.539	S	S	.	.	S	Bend	trans	127.2	166	-171.9	0	0	0	0	0	112.4	P225 L226 C227	P225-G261 CarbonylContact O-C 3.59Å; P225-G261 VanDerWaalsContact O-CA 3.29Å; P225-G261 WeakPolarHBondContact O-CA 3.5Å; P225-G261 PolarHBondContact O-N 3.41Å; L226-G261 CarbonylContact C-O 3.32Å; L226-G261 WeakPolarHBondContact CA-O 3.34Å; L226-G261 PolarHBondContact N-O 3.42Å; C227-G261 PolarHBondContact N-O 3.5Å
262	S	94.2	Very high	84.1	Confident	64 Å²	64	106.2 Å²	106.2	45%	0.448	53%	0.526	S	S	.	.	S	Bend	trans	-68	143.4	171.2	-59.2	0	0	0	0	111	R264	S262-R264 PolarHBondContact O-N 2.92Å
263	C	94.6	Very high	83.6	Confident	29 Å²	29	102.5 Å²	102.5	20%	0.196	52%	0.519	C	S	.	.			trans	-57.7	134.9	176.5	-66.1	0	0	0	0	112.1	C227 G231 R232 T233 Y259	C227-C263 WeakPolarHBondContact CA-SG 3.38Å; C227-C263 HydrophobicContact CB-CB 3.96Å; C227-C263 WeakPolarHBondContact CB-SG 3.02Å; C227-C263 WeakPolarHBondContact SG-CA 3.04Å; C227-C263 WeakPolarHBondContact SG-CB 3.39Å; C227-C263 CovalentContact SG-SG 2.03Å; C227-C263 PolarHBondContact SG-SG 3.24Å; G231-C263 PolarHBondContact O-SG 3.43Å; G231-C263 VanDerWaalsContact O-SG 3.36Å; R232-C263 PolarHBondContact O-SG 3.13Å; T233-C263 PolarHBondContact OG1-N 3.35Å; Y259-C263 WeakPolarHBondContact OH-CA 3.47Å
264	R	90.2	Very high	83.1	Confident	202 Å²	202	98.8 Å²	98.8	76%	0.762	50%	0.499	S	S	*	.			trans	-115.7	142.9	168.8	-59.8	179	-176.3	177.5	0.2	108.2	Y259 S262 P266 V267	Y259-R264 PolarHBondContact OH-N 2.91Å; S262-R264 PolarHBondContact O-N 2.92Å; R264-P266 CarbonylContact O-C 3.23Å; R264-P266 VanDerWaalsContact O-C 3.23Å; R264-P266 VanDerWaalsContact O-O 3.07Å; R264-V267 PolarHBondContact O-N 2.87Å
265	L	81.9	Confident	82.5	Confident	159 Å²	159	103.2 Å²	103.2	83%	0.832	52%	0.519	S	S	*	.	S	Bend	trans	-92.3	139.2	175.4	-64.5	179.9	0	0	0	109.8	V267	L265-V267 HydrophobicContact CD2-CG2 4.01Å
266	P	80.3	Confident	81.8	Confident	100 Å²	100	108.2 Å²	108.2	65%	0.649	54%	0.541	S	S	*	.	S	Bend	cis	-69.6	148.6	-8.5	30.7	-34.1	0	0	0	111.4	R264 T268	R264-P266 CarbonylContact O-C 3.23Å; R264-P266 VanDerWaalsContact O-C 3.23Å; R264-P266 VanDerWaalsContact O-O 3.07Å; P266-T268 VanDerWaalsContact C-N 3.26Å; P266-T268 HydrophobicContact CB-CG2 4.29Å; P266-T268 HydrophobicContact CG-CG2 4.14Å; P266-T268 PolarHBondContact O-N 3.05Å
267	V	76.1	Confident	80.9	Confident	47 Å²	47	101.9 Å²	101.9	29%	0.285	53%	0.526	S	S	.	.			trans	-76.2	84.7	175.8	-173.8	0	0	0	0	108.1	V258 R264 L265	V258-V267 HydrophobicContact CG2-CG1 4.3Å; R264-V267 PolarHBondContact O-N 2.87Å; L265-V267 HydrophobicContact CD2-CG2 4.01Å
268	T	72.5	Confident	80.1	Confident	77 Å²	77	104.4 Å²	104.4	47%	0.472	54%	0.54	S	S	.	.			trans	-101.9	141.4	172	51.4	0	0	0	0	109.1	P266 D270	P266-T268 VanDerWaalsContact C-N 3.26Å; P266-T268 HydrophobicContact CB-CG2 4.29Å; P266-T268 HydrophobicContact CG-CG2 4.14Å; P266-T268 PolarHBondContact O-N 3.05Å; T268-D270 PolarHBondContact O-N 2.89Å; T268-D270 VanDerWaalsContact O-N 3.13Å
269	S	62.7	Low	79.1	Confident	84 Å²	84	109 Å²	109	59%	0.587	56%	0.56	S	S	*	*			trans	-67.8	107.8	163.1	57.4	0	0	0	0	106.7	R271	S269-R271 PolarHBondContact O-N 3.41Å
270	D	59.5	Low	78	Confident	135 Å²	135	114.1 Å²	114.1	72%	0.722	59%	0.591	S	S	*	*			trans	-54.9	116.8	167.3	-73.3	-26.5	0	0	0	106.9	T268	T268-D270 PolarHBondContact O-N 2.89Å; T268-D270 VanDerWaalsContact O-N 3.13Å
271	R	41.8	Very low	76.9	Confident	313 Å²	313	112.3 Å²	112.3	100%	1.181	58%	0.581	S	S	*	*			trans	-70.3	0	176.1	-88.3	-172	-173.3	-177.8	3.3	110.3	S269	S269-R271 PolarHBondContact O-N 3.41Å

Retrieved 271 of 271 residues in 133.4 ms (Link to these results)

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